NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3387 8.2649 123.5826 52.3048 19.9064 175.6440 3 R 4.1534 8.4357 113.8060 57.8517 31.9245 176.6661 4 R 3.8541 9.0975 117.3496 57.7785 29.4592 178.1142 5 R 4.3475 8.7269 122.1498 55.6054 32.0609 177.4030 6 R 3.9085 8.5304 118.6136 57.2981 30.3801 176.1282 7 A 3.6969 7.3706 116.4761 53.5686 15.8020 175.7931 8 E 4.1881 7.7693 120.3913 54.9621 30.7938 176.9882 9 V 3.7117 7.9493 120.1167 62.7777 32.1578 175.3918 10 R 4.2763 8.1370 122.8571 54.9424 29.1954 176.1270 11 Q 4.2775 8.2613 128.8212 54.2929 27.2419 175.2522 12 L 4.1589 7.7370 121.9043 54.9411 41.3861 177.5499 13 Q 4.1029 8.3276 120.5894 54.9786 29.5842 174.2552 14 P 4.4530 0.0000 0.0000 62.4619 31.4664 174.9206 15 D 4.6758 8.4775 117.5512 54.6654 41.6435 176.0411 16 L 5.2261 8.5091 124.8327 54.8039 42.0725 177.1276 17 V 4.4815 7.8049 116.7435 63.9605 38.1653 174.4209 18 Y 4.4524 8.7590 115.6102 56.9809 39.5829 175.6180 19 G 3.8638 7.9214 106.8089 46.4764 0.0000 173.1157 20 D 4.8238 7.8334 116.9120 51.1780 44.8116 175.8378 21 V 3.7494 8.7061 119.9313 64.6385 31.5046 178.1977 22 L 3.9851 8.1602 119.9533 58.3878 41.5684 179.1799 23 V 3.2357 7.1825 115.7345 66.1472 31.6283 177.6735 24 T 3.9882 7.9767 108.7331 64.7116 68.4167 175.6090 25 A 3.9612 7.6783 123.6108 55.1261 18.1061 179.3245 26 F 3.9452 7.9444 118.7911 61.4044 39.3357 176.8730 27 I 3.7524 7.4400 119.2167 64.8581 36.9890 177.5825 28 N 4.2289 7.7283 115.2447 56.7477 38.3042 177.5755 29 K 4.0178 7.3784 117.1673 58.6752 32.1237 179.0097 30 I 4.0914 7.4013 119.9411 62.6333 37.2635 175.4763 31 M 4.0348 7.5035 119.4250 55.8808 31.5322 175.2775 32 R 4.4475 8.4405 125.7995 55.9060 31.8165 176.5780 33 D 4.4476 9.2766 120.4393 55.0182 38.6440 174.1604 34 G 3.9561 7.4906 106.6890 46.6034 0.0000 174.7412 35 K 4.6930 7.2506 121.1604 54.5682 33.7336 178.2879 36 K 3.5366 8.2492 121.0806 60.0514 31.6370 176.8126 37 N 4.4513 8.1470 116.2344 55.9473 38.4541 176.9712 38 L 4.0310 8.7697 122.4758 57.8943 42.1179 178.9432 39 A 4.0110 7.9914 120.0424 55.1373 18.5133 178.9509 40 A 4.1699 8.2065 119.4624 55.6391 18.1843 179.7232 41 R 4.0224 7.8673 115.8380 59.9674 30.3281 178.6841 42 I 3.8024 7.7312 119.2574 64.3517 37.0688 178.1984 43 F 4.5925 8.6818 121.6661 61.4348 39.2702 177.2159 44 Y 3.7076 8.4553 116.7086 60.7429 37.5809 178.1293 45 D 4.3628 9.7001 120.0213 57.4778 40.7934 178.6793 46 A 4.1509 7.9080 118.7763 54.5703 18.6499 178.8804 47 C 4.0832 7.6386 115.8764 62.9701 28.2619 176.2480 48 K 4.1301 7.9015 119.4050 58.7806 31.5636 178.7267 49 I 3.9734 7.2994 117.3653 62.3951 37.1846 177.5869 50 I 4.0200 7.3698 122.2773 64.1828 37.1688 177.6595 51 Q 5.0275 7.3344 116.3685 57.5678 28.6623 177.5291 52 E 4.1956 8.0865 120.0900 58.4785 29.8136 178.2629 53 K 4.1730 7.7863 121.6512 58.4579 32.8212 177.4172 54 T 4.3581 7.5481 112.8873 60.8226 70.3625 174.1681 55 G 3.8626 8.9116 117.9771 47.1473 0.0000 173.3884 56 Q 4.1450 7.5080 119.6730 55.4247 29.5183 176.5796 57 E 4.1934 8.6141 120.4928 55.6946 31.5720 176.4285 58 P 4.3512 0.0000 0.0000 65.0262 31.3849 178.5103 59 L 3.7290 7.8639 119.4254 57.6348 42.1022 178.1394 60 K 4.1889 7.9346 118.3135 58.1914 32.2525 178.3651 61 V 3.6693 7.5694 117.1515 64.8899 31.6832 177.2037 62 F 4.2708 8.0019 120.0631 60.7130 39.5126 177.4936 63 K 3.9159 8.0144 118.1307 59.6293 31.4249 178.6927 64 Q 4.0521 8.3634 118.5360 57.9135 28.8472 177.3631 65 A 4.1024 7.5848 120.8602 54.2113 18.7566 179.3028 66 V 3.7019 7.2419 116.5016 65.6385 31.8405 177.1447 67 E 4.2765 7.6143 115.2516 57.3134 29.4257 176.8830 68 N 4.9315 7.7005 113.6452 53.6495 39.3029 174.9127 69 V 4.2795 7.7483 116.9858 62.2339 33.4465 175.6749 70 K 4.3032 7.9522 120.2863 54.9700 30.6240 173.8932 71 P 4.5282 0.0000 0.0000 62.8736 31.7480 176.8663 72 R 4.2661 8.5863 121.5568 58.5714 30.6611 176.0593 73 M 5.1432 7.5208 114.2534 54.2651 36.1096 173.7611 74 E 4.7854 9.1096 118.6346 55.0942 34.2025 174.7776 75 V 4.6680 8.4622 113.7903 60.5407 32.3738 175.5828 76 R 4.7162 9.1669 125.9610 54.3711 32.2532 176.4712 77 S 5.4208 8.6204 119.6603 58.1420 63.9540 173.6091 78 R 4.5709 8.2120 122.1935 54.7171 33.6240 174.3592 79 R 4.9469 8.2360 123.3588 55.1695 31.2460 177.3537 80 V 4.1158 7.2265 112.9622 60.0542 32.6058 175.0536 81 G 4.1909 8.3107 113.5295 45.5165 0.0000 172.2584 82 G 4.4221 6.8789 107.1290 43.1451 0.0000 171.7219 83 A 4.0927 6.0968 121.1237 51.8900 22.6969 176.2438 84 N 5.0911 8.6091 118.4751 51.7461 39.1454 173.9472 85 Y 4.3796 8.1180 121.1437 57.1746 39.7223 175.4306 86 Q 4.7067 8.1683 122.3480 54.4331 27.0090 175.3897 87 V 3.9698 8.2926 121.3213 62.6448 33.0949 173.6481 88 P 5.7352 0.0000 0.0000 62.0885 32.8385 174.8634 89 M 4.5593 8.2716 116.9060 54.2711 34.1728 173.5531 90 E 4.3637 8.8806 119.7319 57.0139 30.0123 177.7614 91 V 3.9638 8.3358 117.1203 60.4752 32.9793 176.5896 92 S 4.2058 8.4334 116.1735 57.6473 64.1831 173.0189 93 P 4.2444 0.0000 0.0000 66.1245 31.0849 179.0265 94 R 3.9750 7.9341 115.8562 59.2975 29.9956 178.8225 95 R 3.8389 7.7975 118.1467 59.8798 29.9682 177.9386 96 Q 4.0169 8.2802 117.6211 58.8688 28.6975 178.3427 97 Q 3.9325 7.8569 119.0168 59.8184 29.1844 179.3978 98 S 4.0468 8.2198 115.8004 61.8199 62.8690 177.0807 99 L 3.3740 8.0506 121.1713 57.6726 41.3578 178.7193 100 A 4.3702 8.6212 120.7634 55.6901 18.1887 179.2941 101 L 4.0038 8.6197 116.3885 58.3580 41.8603 179.6156 102 R 3.6677 7.8320 118.2166 58.9713 29.8457 178.1994 103 W 5.1550 8.7188 119.9941 59.5438 29.0610 178.3215 104 L 3.9997 8.3129 117.4508 58.1821 41.3589 179.4687 105 V 3.7455 7.5908 117.2004 66.4097 31.6775 178.1855 106 Q 4.0131 8.0693 117.1372 58.7446 28.4220 178.9759 107 A 4.1085 8.3324 122.1602 55.0737 18.2365 179.2837 108 A 4.0473 7.9953 118.3564 55.6086 18.4042 179.2463 109 N 4.5271 7.6703 112.8991 56.1259 38.7706 177.4889 110 Q 4.1473 7.8676 119.0626 57.9822 29.1429 177.2085 111 R 4.0656 7.4470 116.8280 56.2462 30.5936 174.6280 112 P 4.5927 0.0000 0.0000 62.9078 31.7472 176.6867 113 E 4.1657 7.8967 119.2087 56.3932 30.0509 177.2314 114 R 4.0744 8.7859 123.0245 58.8802 30.6298 177.7220 115 R 4.5648 7.7205 116.3464 54.3470 32.6539 176.7087 116 A 3.9883 8.6013 125.4902 55.5658 18.6207 179.8708 117 A 4.2100 8.0247 119.5706 54.7426 18.2979 180.1057 118 V 3.6561 7.7254 110.9686 64.3356 31.5612 179.0305 119 R 3.9814 8.2869 118.3476 59.4951 30.0779 179.1916 120 I 3.9908 7.8787 118.2574 63.5532 36.5910 178.2815 121 A 3.9932 8.0435 122.3811 55.6278 17.9090 179.4674 122 H 4.2871 8.6028 114.6698 58.3184 28.7649 177.7838 123 E 4.0494 8.2631 121.5042 59.0911 29.5541 178.4506 124 L 4.1052 8.0063 118.3258 57.1857 41.5457 179.4289 125 M 4.0282 7.7094 118.5224 58.3628 32.1631 178.2169 126 D 4.4816 7.8031 117.2316 56.3466 40.6498 178.8293 127 A 3.9891 7.6547 120.9188 55.1430 18.7866 179.3705 128 A 4.3105 7.2664 118.1945 54.1739 18.4341 179.0639 129 E 4.0667 8.2207 118.1785 58.2155 29.8776 177.9668 130 G 4.6105 6.4829 118.3768 45.6569 0.0000 172.4841 131 K 4.5192 7.0661 120.8537 54.2267 34.6697 175.6091 132 G 4.1282 8.1138 109.4570 42.9306 0.0000 174.5830 133 G 3.7352 8.9744 108.3372 47.6157 0.0000 175.4037 134 A 4.2255 7.8742 121.0993 54.4710 18.8360 179.8008 135 V 3.5934 7.5527 116.3998 65.8770 31.7224 178.1671 136 K 4.0260 8.0575 118.2089 58.6519 31.4541 178.6766 137 K 3.9860 7.4574 116.1209 57.2347 31.9288 178.1854 138 K 3.5173 7.1141 119.7550 57.9728 33.0464 177.5992 139 E 3.9179 7.9513 118.7871 59.2790 28.9831 178.9899 140 D 4.2127 7.8125 118.0017 57.3774 41.2433 178.4920 141 V 3.6531 7.1502 118.1822 65.6102 31.3657 177.7224 142 E 4.0487 8.1562 118.2953 58.8972 29.1270 179.1106 143 R 3.9072 7.6463 118.9083 59.3835 30.2431 178.4803 144 M 3.9321 7.9021 117.8939 59.2602 31.7783 177.9210 145 A 3.9761 7.6690 119.5062 56.2077 18.8260 179.1538 146 E 4.0320 8.5312 115.2708 58.6397 29.5405 179.6444 147 A 4.0158 8.0008 120.6468 55.2406 18.7567 178.6950 148 N 4.6910 7.8027 112.5608 53.5263 38.4097 177.0971 149 R 3.8852 7.5287 121.7905 58.4803 30.6172 177.5412 150 A 3.8184 7.7749 120.4135 56.1182 18.3072 178.5131 151 Y 4.1371 7.3231 110.8287 58.1851 37.7790 177.5766 152 A 4.1679 7.6466 124.9642 54.6647 18.4682 178.7345 153 H 4.5202 7.2053 111.2707 56.0521 28.9894 175.1463 154 Y 5.3227 7.9280 116.3262 58.3283 39.1249 177.8983 155 R 4.0061 8.8228 121.1551 57.3587 30.5858 177.0659 156 W 4.1497 7.8046 117.8689 56.9111 30.1372 173.9991 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 2 A 8.26 4.34 1.28 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 0.00 0.00 0.00 3 R 8.44 4.15 0.00 1.89 1.99 0.00 3.21 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 4 R 9.10 3.85 0.00 1.80 1.72 0.00 3.20 0.00 0.00 3.23 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 8.73 4.35 0.00 1.92 1.85 0.00 3.18 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 6 R 8.53 3.91 0.00 1.78 1.96 0.00 3.39 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 7 A 7.37 3.70 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 8 E 7.77 4.19 0.00 1.97 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 2.32 2.30 0.00 9 V 7.95 3.71 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 0.75 0.00 0.00 0.93 0.00 0.00 10 R 8.14 4.28 0.00 1.80 1.85 0.00 3.28 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 11 Q 8.26 4.28 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 12 L 7.74 4.16 0.00 1.80 1.69 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.33 4.10 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 14 P 0.00 4.45 0.00 2.12 2.08 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 15 D 8.48 4.68 0.00 2.98 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.51 5.23 0.00 1.76 1.68 0.96 0.86 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 17 V 7.80 4.48 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 0.18 0.00 0.00 0.69 0.00 0.00 18 Y 8.76 4.45 0.00 3.08 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 19 G 7.92 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 20 D 7.83 4.82 0.00 2.68 2.49 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 21 V 8.71 3.75 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 1.01 0.00 0.00 0.96 0.00 0.00 22 L 8.16 3.99 0.00 1.84 1.77 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.18 3.24 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 0.95 0.00 0.00 0.71 0.00 0.00 24 T 7.98 3.99 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 25 A 7.68 3.96 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.94 3.95 0.00 3.36 2.80 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 27 I 7.44 3.75 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.74 0.99 0.00 0.00 28 N 7.73 4.23 0.00 2.86 2.86 0.00 0.00 7.16 6.86 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 29 K 7.38 4.02 0.00 1.33 1.65 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.42 7.81 30 I 7.40 4.09 2.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.89 0.97 0.00 0.00 31 M 7.50 4.03 0.00 2.13 2.02 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 2.62 2.53 0.00 32 R 8.44 4.45 0.00 1.91 1.81 0.00 3.32 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 33 D 9.28 4.45 0.00 2.81 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.49 3.96 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 0.00 0.00 0.00 35 K 7.25 4.69 0.00 1.79 1.75 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.67 7.81 36 K 8.25 3.54 0.00 1.85 1.88 0.00 1.76 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.60 1.62 7.81 37 N 8.15 4.45 0.00 2.80 2.88 0.00 0.00 6.81 6.74 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 38 L 8.77 4.03 0.00 1.75 1.83 0.96 0.77 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 39 A 7.99 4.01 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 40 A 8.21 4.17 1.70 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 41 R 7.87 4.02 0.00 2.17 2.02 0.00 3.14 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.72 0.00 42 I 7.73 3.80 2.12 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 1.48 1.30 1.04 0.00 0.00 43 F 8.68 4.59 0.00 3.07 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 44 Y 8.46 3.71 0.00 3.23 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 45 D 9.70 4.36 0.00 2.95 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 46 A 7.91 4.15 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 47 C 7.64 4.08 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.90 4.13 0.00 1.73 1.84 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.61 7.81 49 I 7.30 3.97 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.73 0.88 0.00 0.00 50 I 7.37 4.02 2.11 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.53 0.99 0.00 0.00 51 Q 7.33 5.03 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.27 0.00 52 E 8.09 4.20 0.00 1.93 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 0.00 2.54 2.33 0.00 53 K 7.79 4.17 0.00 1.73 1.90 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.44 7.81 54 T 7.55 4.36 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 55 G 8.91 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 56 Q 7.51 4.14 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 57 E 8.61 4.19 0.00 2.26 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 2.38 2.42 0.00 58 P 0.00 4.35 0.00 2.15 2.10 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.32 0.00 59 L 7.86 3.73 0.00 1.73 1.68 0.75 0.43 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 60 K 7.93 4.19 0.00 1.92 1.79 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.55 7.81 61 V 7.57 3.67 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 0.87 0.00 0.00 1.04 0.00 0.00 62 F 8.00 4.27 0.00 3.29 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.01 3.92 0.00 2.07 1.87 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.54 7.81 64 Q 8.36 4.05 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 65 A 7.58 4.10 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 66 V 7.24 3.70 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 1.07 0.00 0.00 0.58 0.00 0.00 67 E 7.61 4.28 0.00 2.08 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 2.31 2.38 0.00 68 N 7.70 4.93 0.00 2.83 2.82 0.00 0.00 6.67 7.68 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 69 V 7.75 4.28 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 0.76 0.00 0.00 0.95 0.00 0.00 70 K 7.95 4.30 0.00 1.95 1.76 0.00 2.12 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.62 1.46 7.81 71 P 0.00 4.53 0.00 2.34 2.09 0.00 4.02 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 2.24 2.64 0.00 72 R 8.59 4.27 0.00 1.92 2.12 0.00 3.29 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 73 M 7.52 5.14 0.00 1.92 1.91 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 2.52 2.64 0.00 74 E 9.11 4.79 0.00 2.08 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 2.25 2.36 0.00 75 V 8.46 4.67 2.15 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 0.77 0.00 0.00 0.99 0.00 0.00 76 R 9.17 4.72 0.00 1.84 1.91 0.00 3.24 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 77 S 8.62 5.42 0.00 3.75 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.21 4.57 0.00 1.74 1.64 0.00 3.01 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.36 0.00 79 R 8.24 4.95 0.00 1.57 1.67 0.00 3.30 0.00 0.00 4.01 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.33 0.00 80 V 7.23 4.12 1.80 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 0.04 0.00 0.00 0.36 0.00 0.00 81 G 8.31 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 0.00 0.00 0.00 0.00 82 G 6.88 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 A 6.10 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.61 5.09 0.00 2.50 2.70 0.00 0.00 6.99 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 85 Y 8.12 4.38 0.00 2.80 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 86 Q 8.17 4.71 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 87 V 8.29 3.97 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.19 0.00 0.00 88 P 0.00 5.74 0.00 2.15 2.19 0.00 3.57 0.00 0.00 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.83 0.00 89 M 8.27 4.56 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 90 E 8.88 4.36 0.00 1.82 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 0.00 2.30 2.41 0.00 91 V 8.34 3.96 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 0.75 0.00 0.00 1.06 0.00 0.00 92 S 8.43 4.21 0.00 3.89 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.24 0.00 2.19 2.12 0.00 3.64 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 2.21 0.00 94 R 7.93 3.97 0.00 1.85 1.97 0.00 3.13 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 95 R 7.80 3.84 0.00 1.91 2.15 0.00 3.10 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 96 Q 8.28 4.02 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.45 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 97 Q 7.86 3.93 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 98 S 8.22 4.05 0.00 3.96 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 99 L 8.05 3.37 0.00 1.69 0.43 0.87 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.62 4.37 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 0.00 101 L 8.62 4.00 0.00 1.65 1.68 0.96 1.09 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 0.00 102 R 7.83 3.67 0.00 1.73 1.56 0.00 2.66 0.00 0.00 2.91 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.46 0.00 103 W 8.72 5.15 0.00 3.61 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 0.00 104 L 8.31 4.00 0.00 1.91 2.07 0.98 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.59 3.75 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 1.00 0.00 0.00 0.42 0.00 0.00 106 Q 8.07 4.01 0.00 2.45 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 107 A 8.33 4.11 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 0.00 108 A 8.00 4.05 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 0.00 109 N 7.67 4.53 0.00 2.97 2.91 0.00 0.00 7.06 7.57 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 0.00 110 Q 7.87 4.15 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.71 0.00 111 R 7.45 4.07 0.00 1.83 1.92 0.00 3.30 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 112 P 0.00 4.59 0.00 2.05 2.09 0.00 3.69 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 2.01 2.10 0.00 113 E 7.90 4.17 0.00 2.01 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 2.36 2.36 0.00 114 R 8.79 4.07 0.00 1.82 2.00 0.00 3.21 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 1.65 1.67 0.00 115 R 7.72 4.56 0.00 1.84 1.86 0.00 3.32 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 116 A 8.60 3.99 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 0.00 117 A 8.02 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 0.00 118 V 7.73 3.66 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 0.86 0.00 0.00 1.08 0.00 0.00 119 R 8.29 3.98 0.00 2.01 2.13 0.00 3.36 0.00 0.00 3.52 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.00 0.00 120 I 7.88 3.99 2.04 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.20 1.13 0.00 0.00 121 A 8.04 3.99 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 122 H 8.60 4.29 0.00 3.33 3.36 0.00 5.63 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.26 4.05 0.00 2.35 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 124 L 8.01 4.11 0.00 1.89 1.72 1.02 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.71 4.03 0.00 2.11 2.13 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 2.69 2.59 0.00 126 D 7.80 4.48 0.00 2.87 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 0.00 127 A 7.65 3.99 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 0.00 128 A 7.27 4.31 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 0.00 129 E 8.22 4.07 0.00 1.99 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 2.31 2.32 0.00 130 G 6.48 4.61 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 0.00 131 K 7.07 4.52 0.00 1.67 1.65 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.36 7.81 132 G 8.11 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 0.00 133 G 8.97 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 0.00 0.00 0.00 0.00 134 A 7.87 4.23 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 0.00 135 V 7.55 3.59 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 1.17 0.00 0.00 0.93 0.00 0.00 136 K 8.06 4.03 0.00 1.79 1.76 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.42 7.81 137 K 7.46 3.99 0.00 1.31 1.23 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.51 7.81 138 K 7.11 3.52 0.00 1.41 1.72 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.24 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.53 7.81 139 E 7.95 3.92 0.00 1.98 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 0.00 2.27 2.40 0.00 140 D 7.81 4.21 0.00 3.03 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.15 3.65 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 1.07 0.00 0.00 0.96 0.00 0.00 142 E 8.16 4.05 0.00 2.18 1.96 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 2.30 2.58 0.00 143 R 7.65 3.91 0.00 2.04 1.94 0.00 3.13 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 144 M 7.90 3.93 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.75 0.00 145 A 7.67 3.98 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 0.00 146 E 8.53 4.03 0.00 1.93 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 0.00 2.32 2.45 0.00 147 A 8.00 4.02 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 0.00 148 N 7.80 4.69 0.00 2.92 3.02 0.00 0.00 6.71 8.20 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 0.00 149 R 7.53 3.89 0.00 1.84 1.91 0.00 3.50 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 150 A 7.77 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.32 4.14 0.00 3.11 2.80 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 0.00 152 A 7.65 4.17 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 0.00 153 H 7.21 4.52 0.00 3.00 3.27 0.00 5.51 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.93 5.32 0.00 3.22 2.98 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 0.00 155 R 8.82 4.01 0.00 1.82 2.02 0.00 3.36 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 156 W 7.80 4.15 0.00 3.77 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