NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 M 4.0619 8.3044 120.3177 56.6044 33.2855 174.1874 33 E 3.3490 8.5408 113.0986 56.6450 26.9110 173.1552 34 K 4.2481 7.6219 123.0089 55.9458 31.2249 177.1103 35 T 4.3442 7.7996 113.9123 60.7293 71.5841 175.0684 36 D 4.4564 8.7368 122.0391 57.8816 40.7997 179.1586 37 E 3.9519 8.1936 118.2388 59.5479 29.5512 178.5424 38 Y 3.9925 8.0863 119.3483 60.8108 38.9030 178.1529 39 L 3.7212 8.4009 120.1137 57.6407 41.7139 179.5417 40 L 4.0149 8.6366 118.9709 57.9208 41.4166 179.5405 41 A 3.9530 7.8028 119.2071 54.8557 18.5457 179.4011 42 R 3.6177 7.4248 117.5045 58.8111 30.0280 177.7096 43 F 4.8362 7.5772 115.1046 56.2466 39.7136 175.5676 44 K 4.3470 7.5419 121.5675 57.1458 33.8361 176.4505 45 G 3.9606 8.3082 114.8387 47.0789 0.0000 176.8473 46 D 4.3828 9.1013 125.8214 54.5132 41.5518 178.2810 47 G 4.0784 7.4528 107.5112 45.6436 0.0000 172.9609 48 V 4.3142 8.2551 121.4578 61.4373 34.1469 175.7020 49 K 5.2214 8.1098 124.7134 55.0030 35.3460 174.8277 50 Y 5.0483 9.4888 123.9921 56.0694 42.2117 174.5218 51 K 4.0716 8.8614 123.9465 56.2872 34.0672 175.6451 52 A 5.0375 8.1557 126.8579 51.6792 23.3551 174.6720 53 K 4.9161 8.9883 115.2833 54.7362 36.6674 176.3509 54 L 4.4370 8.5100 126.2058 54.2644 41.4725 176.3949 55 I 3.8288 8.5315 129.0789 62.3688 37.8661 176.8744 56 G 4.0315 6.8678 108.2220 46.3048 0.0000 171.0750 57 I 4.7503 7.7106 119.6960 59.2254 40.5115 175.1194 58 D 4.7414 8.4999 124.7184 52.4755 44.8729 174.0781 59 D 4.8564 8.7825 125.5860 54.3462 41.5682 175.7953 60 V 4.5806 8.5917 123.1026 60.3153 33.9270 174.0905 61 P 4.4033 0.0000 0.0000 65.0455 31.5698 175.4973 62 D 4.7492 7.5641 116.1563 52.1154 44.8005 175.0487 63 A 4.0089 8.1379 122.0820 54.0732 18.7681 177.2565 64 R 3.8725 7.8158 112.7144 54.0791 34.5066 172.6184 65 G 3.1248 6.3656 103.7493 44.3862 0.0000 174.5471 66 D 4.4442 8.8599 127.0125 57.3073 40.9731 178.6683 67 K 3.8757 7.8995 119.5763 59.6637 32.3393 178.2388 68 M 3.8754 7.8194 117.9211 58.8104 32.1749 178.2287 69 S 3.4021 8.0896 115.4243 61.1470 62.9418 176.4497 70 Q 3.8650 8.2385 122.6608 59.3084 28.8345 177.8641 71 D 4.3292 8.0737 119.9681 57.5549 40.8620 179.2314 72 S 3.9695 7.5450 114.7656 61.7012 62.8238 176.0982 73 M 4.1049 7.7066 120.8180 59.2290 31.9220 178.1096 74 M 4.0339 8.3948 118.8500 58.2909 32.1301 178.7170 75 K 3.9193 8.1458 119.6824 59.5331 32.3648 178.8779 76 L 3.9912 8.4771 119.5983 57.8086 41.5313 179.7224 77 K 4.2096 8.6810 119.0362 59.0491 31.8951 179.7583 78 G 3.5694 8.1315 106.3081 48.0280 0.0000 175.7379 79 M 4.0229 8.1870 121.2813 58.0698 31.9364 178.7346 80 A 3.9981 8.4509 121.0643 54.9652 18.4713 179.6433 81 A 3.8586 8.0672 119.1695 55.3316 18.2956 179.6229 82 A 4.0628 7.8087 118.1921 55.2625 18.5836 179.8649 83 G 3.6471 8.1032 104.2006 47.9876 0.0000 175.9641 84 R 4.2352 8.4270 123.2174 58.3804 29.8676 178.0544 85 S 4.4782 8.0226 111.4649 59.5492 61.6955 174.3810 86 Q 4.4984 8.0655 122.4266 55.8187 29.4363 176.6300 87 G 3.8716 8.2296 104.2360 46.1453 0.0000 173.8572 88 Q 4.5578 7.5316 118.7778 54.2557 30.0657 174.9436 89 H 4.9494 8.4884 119.7441 53.5992 31.2315 174.6942 90 K 4.2374 8.2291 120.4977 56.2315 33.0240 176.8886 91 Q 4.0931 8.5853 124.6931 56.3311 30.4375 175.3078 92 R 4.5636 8.6368 126.0567 56.1461 31.6486 175.6393 93 I 5.1634 9.0783 116.8156 59.2599 42.2539 173.5154 94 W 5.2224 9.4152 121.4882 54.9877 32.0523 175.2340 95 V 4.6733 9.5711 125.8101 61.6389 32.6216 173.7982 96 N 5.3631 9.3234 128.4205 52.1587 40.9616 173.3756 97 I 5.0049 8.9105 127.8850 59.7777 40.0578 175.0861 98 S 5.0318 8.7673 120.9613 57.4345 66.1425 174.9444 99 L 4.2923 8.7344 119.4302 57.9198 41.6111 178.9711 100 S 4.3079 7.9003 114.0357 59.2780 64.1024 173.4200 101 G 4.1138 8.4105 106.5949 44.1715 0.0000 173.0142 102 I 4.9402 8.7387 123.7548 59.3200 39.9427 174.6998 103 K 4.9783 9.0779 125.9032 54.6795 35.3378 175.0439 104 I 4.8563 8.8256 126.5204 60.0345 38.9937 174.7569 105 I 5.0986 8.7272 128.2211 59.1887 40.7863 174.6153 106 D 4.7186 8.9274 126.5068 54.1702 41.5262 176.6289 107 E 4.0552 8.9568 127.8974 59.5954 29.8139 178.2808 108 K 4.1352 8.4266 119.8413 59.5314 32.5784 177.7839 109 T 4.0848 9.1826 108.4995 62.1597 69.2783 175.9900 110 G 3.9522 8.4150 108.9953 45.1742 0.0000 173.1610 111 V 3.8048 7.6317 120.6163 62.5149 32.7725 175.5130 112 I 4.3486 8.3680 128.8941 60.8617 36.4144 175.3521 113 E 4.1119 8.9578 129.5734 59.1067 30.0040 176.6753 114 H 5.0613 8.0092 114.3476 54.2473 33.7996 172.1100 115 E 4.9287 8.4981 120.8878 55.1030 32.7393 173.9681 116 H 4.9346 9.1558 124.0577 53.2249 31.9500 171.8314 117 P 5.1005 0.0000 0.0000 61.6641 32.3485 177.5863 118 V 3.5412 8.6420 121.4492 66.3733 31.3172 177.4404 119 N 4.6354 8.0621 112.4750 53.3327 37.0621 175.1538 120 K 4.3910 8.3675 117.8593 56.2413 33.8848 175.5280 121 I 4.6762 7.4028 120.4028 59.9771 37.0437 175.2843 122 S 4.5456 8.6162 121.4963 59.9568 64.3548 174.7091 123 F 5.0670 8.2527 121.3469 56.5299 43.0602 173.0991 124 I 4.8906 7.8819 125.7150 59.6015 39.0266 174.5566 125 A 4.7106 9.4907 129.9538 50.4008 21.0467 175.5462 126 R 4.5978 8.6599 122.9380 55.3133 31.9845 175.4506 127 D 4.8657 8.6570 125.8162 52.6975 41.7096 177.0432 128 V 3.8742 8.5937 119.7407 63.2552 31.7798 177.4066 129 T 4.3335 8.2454 109.2520 61.9102 69.4418 174.3987 130 D 4.7071 7.8949 121.7303 52.9059 44.1589 174.6460 131 N 4.7231 8.8548 122.4793 54.5652 39.3892 175.4463 132 R 5.1510 9.5203 119.2014 54.0052 31.1308 174.9090 133 A 5.3124 7.9888 117.9560 51.2686 22.6229 176.0574 134 F 4.7670 8.7998 114.0884 56.8627 42.0425 172.4946 135 G 4.0648 9.2205 105.9742 45.5197 0.0000 171.1963 136 Y 5.6327 7.5591 116.1310 55.6694 42.0061 173.9865 137 V 5.1799 9.5856 121.6340 61.8568 34.0166 174.3287 138 C 5.2673 9.5909 120.9566 57.4144 33.5326 172.2997 139 G 4.3693 8.0881 105.5811 44.1872 0.0000 173.9568 140 G 3.8853 8.4303 108.9785 44.1453 0.0000 172.8886 141 E 4.1182 8.4094 119.1175 57.7823 29.6008 178.2157 142 G 4.0031 9.3830 111.7680 45.4445 0.0000 172.9583 143 Q 4.6153 7.5882 117.0917 55.1642 27.7769 174.5503 144 H 5.0544 7.9324 117.0558 55.9960 31.3710 176.2654 145 Q 5.0305 9.2295 120.4094 54.1561 33.2944 173.8607 146 F 5.1659 9.3521 125.7828 56.7490 41.7073 174.2741 147 F 4.2119 8.1683 125.7517 55.7263 40.4748 174.6755 148 A 4.3793 8.1889 126.7146 50.4636 20.7756 175.8098 149 I 4.6986 8.4016 123.0977 59.1330 41.3797 174.6216 150 K 4.9442 8.8133 128.4658 54.7704 33.5175 175.4410 151 T 4.3652 8.7086 119.2897 61.5232 69.6095 176.1346 152 G 3.5800 9.0028 111.8048 48.7373 0.0000 173.4671 153 Q 5.0641 7.7085 119.9626 54.8110 30.7922 174.9692 154 Q 4.2944 8.6261 120.0996 56.9753 29.7221 176.7163 155 A 4.1647 8.9997 123.7710 54.6348 18.6538 179.6037 156 E 3.7452 8.2249 117.8942 59.2818 29.6126 177.3402 157 P 4.4119 0.0000 0.0000 65.6572 30.9816 177.9438 158 L 3.3456 7.5505 120.2403 57.6384 41.9892 178.8631 159 V 3.0660 6.9944 117.6689 65.6106 31.4185 178.0048 160 V 3.4638 8.0119 118.4130 65.9438 31.3925 177.4644 161 D 4.5596 7.7328 118.1256 57.7713 40.7996 178.9603 162 L 3.4395 7.5062 119.0442 57.3691 41.4640 179.6856 163 K 3.6323 7.6098 119.3423 59.5533 32.2237 178.6184 164 D 4.4164 8.4150 119.5937 57.1734 40.7496 178.3494 165 L 3.4704 8.1281 121.0440 58.3252 42.0152 179.0936 166 F 4.4680 7.8708 117.4178 60.6773 38.6982 177.6010 167 Q 4.0463 8.2842 119.2440 59.1226 28.9030 178.3145 168 V 3.6532 8.4747 119.5441 66.1938 31.7831 177.6504 169 I 3.7225 7.9112 119.5580 64.8138 37.0096 177.5878 170 Y 4.0460 8.0640 119.6306 60.8103 38.6944 177.5217 171 N 4.1774 8.5019 117.5357 56.4718 38.7557 177.1021 172 V 3.5577 7.8339 119.1855 66.3181 31.5521 177.9982 173 K 4.0012 7.8244 117.4932 59.3753 31.9021 179.0920 174 K 3.6660 7.7863 119.5595 59.4595 32.0782 178.5860 175 K 3.8275 7.9854 118.5234 59.8031 31.8195 178.7674 176 E 3.9227 7.9574 117.4721 59.8226 29.7142 179.5026 177 E 4.0810 8.0287 118.0989 59.6242 29.4628 179.1222 178 D 4.4749 7.9319 116.7379 56.4881 40.8354 178.1755 179 K 4.1492 7.6493 119.8465 58.3083 33.4314 177.9239 180 K 4.3995 7.6588 119.6265 54.7270 29.5417 176.8965 181 K 4.0743 7.4335 123.9185 56.9622 32.0806 174.8353 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 32 M 8.30 4.06 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 33 E 8.54 3.35 0.00 2.02 1.78 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 2.16 2.40 0.00 34 K 7.62 4.25 0.00 1.83 1.92 0.00 1.91 0.00 0.00 1.87 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.35 7.81 35 T 7.80 4.34 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 1.28 0.00 0.00 36 D 8.74 4.46 0.00 2.83 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 37 E 8.19 3.95 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 38 Y 8.09 3.99 0.00 3.00 3.19 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 39 L 8.40 3.72 0.00 2.14 1.86 1.19 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.64 4.01 0.00 1.87 1.71 0.97 1.20 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 41 A 7.80 3.95 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 42 R 7.42 3.62 0.00 1.07 1.13 0.00 2.57 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.17 0.00 43 F 7.58 4.84 0.00 3.12 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 44 K 7.54 4.35 0.00 2.05 1.63 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.52 7.81 45 G 8.31 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 46 D 9.10 4.38 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 47 G 7.45 4.08 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 0.00 0.00 0.00 48 V 8.26 4.31 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 0.82 0.00 0.00 0.84 0.00 0.00 49 K 8.11 5.22 0.00 1.61 1.42 0.00 0.61 0.00 0.00 1.20 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.46 7.81 50 Y 9.49 5.05 0.00 3.01 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 51 K 8.86 4.07 0.00 1.62 1.57 0.00 1.27 0.00 0.00 0.61 0.00 0.00 2.78 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.24 1.05 7.81 52 A 8.16 5.04 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 53 K 8.99 4.92 0.00 1.58 1.62 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.31 7.81 54 L 8.51 4.44 0.00 1.68 1.61 0.98 0.98 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 55 I 8.53 3.83 1.91 0.00 0.00 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 1.12 0.63 0.89 0.00 0.00 56 G 6.87 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 57 I 7.71 4.75 1.58 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.33 0.32 0.00 0.00 58 D 8.50 4.74 0.00 2.75 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 8.78 4.86 0.00 2.60 2.59 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 0.00 0.00 0.00 0.00 60 V 8.59 4.58 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 0.84 0.00 0.00 0.89 0.00 0.00 61 P 0.00 4.40 0.00 2.19 2.15 0.00 3.72 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 62 D 7.56 4.75 0.00 2.48 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 63 A 8.14 4.01 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 64 R 7.82 3.87 0.00 1.53 1.35 0.00 3.23 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 65 G 6.37 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 0.00 0.00 0.00 66 D 8.86 4.44 0.00 2.78 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 67 K 7.90 3.88 0.00 1.74 1.74 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.41 7.81 68 M 7.82 3.88 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 69 S 8.09 3.40 0.00 4.09 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 Q 8.24 3.87 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 71 D 8.07 4.33 0.00 2.80 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 72 S 7.55 3.97 0.00 3.26 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 73 M 7.71 4.10 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.87 0.00 74 M 8.39 4.03 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 75 K 8.15 3.92 0.00 1.87 1.91 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 76 L 8.48 3.99 0.00 1.84 1.69 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.68 4.21 0.00 1.82 1.85 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.58 7.81 78 G 8.13 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 79 M 8.19 4.02 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.54 0.00 80 A 8.45 4.00 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 81 A 8.07 3.86 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 82 A 7.81 4.06 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 83 G 8.10 3.65 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 0.00 0.00 0.00 84 R 8.43 4.24 0.00 1.99 1.99 0.00 3.05 0.00 0.00 3.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.31 0.00 85 S 8.02 4.48 0.00 4.08 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 86 Q 8.07 4.50 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.96 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 87 G 8.23 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 88 Q 7.53 4.56 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.64 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 89 H 8.49 4.95 0.00 3.05 3.21 0.00 5.90 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 90 K 8.23 4.24 0.00 1.62 1.93 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.41 7.81 91 Q 8.59 4.09 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.11 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 92 R 8.64 4.56 0.00 1.71 1.73 0.00 3.23 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 93 I 9.08 5.16 2.06 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 1.30 0.98 1.00 0.00 0.00 94 W 9.42 5.22 0.00 3.28 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 95 V 9.57 4.67 2.34 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 1.21 0.00 0.00 1.10 0.00 0.00 96 N 9.32 5.36 0.00 2.85 2.82 0.00 0.00 6.63 7.50 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 97 I 8.91 5.00 2.06 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 1.31 0.90 0.74 0.00 0.00 98 S 8.77 5.03 0.00 4.13 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 99 L 8.73 4.29 0.00 1.66 1.80 1.03 1.14 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 0.00 100 S 7.90 4.31 0.00 3.83 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 0.00 101 G 8.41 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 0.00 0.00 0.00 102 I 8.74 4.94 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.58 0.89 0.00 0.00 103 K 9.08 4.98 0.00 1.68 1.71 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.37 7.81 104 I 8.83 4.86 2.04 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.12 1.07 0.00 0.00 105 I 8.73 5.10 2.13 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 1.18 0.77 1.11 0.00 0.00 106 D 8.93 4.72 0.00 2.87 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.96 4.06 0.00 1.77 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 2.32 2.01 0.00 108 K 8.43 4.14 0.00 1.80 1.90 0.00 1.86 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.38 7.81 109 T 9.18 4.08 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 1.23 0.00 0.00 110 G 8.42 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 0.00 111 V 7.63 3.80 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 0.97 0.00 0.00 0.95 0.00 0.00 112 I 8.37 4.35 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 0.92 0.00 0.00 113 E 8.96 4.11 0.00 2.14 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 0.00 2.37 2.29 0.00 114 H 8.01 5.06 0.00 2.98 2.92 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.50 4.93 0.00 1.89 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.31 0.00 116 H 9.16 4.93 0.00 2.98 3.11 0.00 5.69 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 5.10 0.00 2.17 1.96 0.00 3.92 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 118 V 8.64 3.54 2.06 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 0.91 0.00 0.00 1.03 0.00 0.00 119 N 8.06 4.64 0.00 2.82 2.86 0.00 0.00 5.80 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.37 4.39 0.00 1.90 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.52 7.81 121 I 7.40 4.68 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.69 1.15 0.00 0.00 122 S 8.62 4.55 0.00 4.00 4.05 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 0.00 123 F 8.25 5.07 0.00 3.31 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 0.00 124 I 7.88 4.89 1.71 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.96 0.83 0.00 0.00 125 A 9.49 4.71 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 0.00 126 R 8.66 4.60 0.00 1.82 1.87 0.00 3.34 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 127 D 8.66 4.87 0.00 2.91 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 0.00 128 V 8.59 3.87 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 0.81 0.00 0.00 0.95 0.00 0.00 129 T 8.25 4.33 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 1.22 0.00 0.00 130 D 7.89 4.71 0.00 2.65 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 0.00 131 N 8.85 4.72 0.00 2.85 3.03 0.00 0.00 6.91 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 0.00 132 R 9.52 5.15 0.00 1.78 2.08 0.00 3.17 0.00 0.00 3.28 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.41 0.00 133 A 7.99 5.31 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 0.00 134 F 8.80 4.77 0.00 3.32 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 0.00 135 G 9.22 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 0.00 0.00 0.00 136 Y 7.56 5.63 0.00 3.30 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 0.00 137 V 9.59 5.18 2.47 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 1.22 0.00 0.00 1.32 0.00 0.00 138 C 9.59 5.27 0.00 3.10 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 0.00 139 G 8.09 4.37 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 0.00 140 G 8.43 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 0.00 141 E 8.41 4.12 0.00 1.98 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 2.34 2.32 0.00 142 G 9.38 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 0.00 143 Q 7.59 4.62 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 144 H 7.93 5.05 0.00 3.36 3.31 0.00 5.56 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 9.23 5.03 0.00 2.18 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 146 F 9.35 5.17 0.00 3.06 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 0.00 147 F 8.17 4.21 0.00 1.51 2.37 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 0.00 148 A 8.19 4.38 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 0.00 149 I 8.40 4.70 0.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.66 0.90 0.00 0.00 150 K 8.81 4.94 0.00 1.74 1.67 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.33 1.48 7.81 151 T 8.71 4.37 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 1.42 0.00 0.00 152 G 9.00 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 0.00 153 Q 7.71 5.06 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 154 Q 8.63 4.29 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.09 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 155 A 9.00 4.16 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 0.00 156 E 8.22 3.75 0.00 2.05 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 2.42 0.00 157 P 0.00 4.41 0.00 2.40 2.35 0.00 3.57 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 158 L 7.55 3.35 0.00 1.13 1.25 0.27 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 159 V 6.99 3.07 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 0.80 0.00 0.00 0.49 0.00 0.00 160 V 8.01 3.46 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.92 0.00 0.00 161 D 7.73 4.56 0.00 2.89 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 0.00 162 L 7.51 3.44 0.00 1.43 0.97 0.67 0.44 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 0.00 163 K 7.61 3.63 0.00 1.77 1.88 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.41 7.81 164 D 8.42 4.42 0.00 3.09 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 0.00 165 L 8.13 3.47 0.00 0.27 1.22 0.51 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 166 F 7.87 4.47 0.00 3.16 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Q 8.28 4.05 0.00 2.40 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 168 V 8.47 3.65 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.17 0.00 0.00 169 I 7.91 3.72 2.10 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.28 0.94 0.00 0.00 170 Y 8.06 4.05 0.00 3.22 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 0.00 171 N 8.50 4.18 0.00 2.96 2.98 0.00 0.00 6.72 8.50 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 0.00 172 V 7.83 3.56 2.22 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 1.02 0.00 0.00 0.95 0.00 0.00 173 K 7.82 4.00 0.00 1.90 1.77 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.60 7.81 174 K 7.79 3.67 0.00 1.50 1.66 0.00 1.75 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.10 1.43 7.81 175 K 7.99 3.83 0.00 1.97 1.83 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.63 7.81 176 E 7.96 3.92 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 177 E 8.03 4.08 0.00 2.22 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 2.41 0.00 178 D 7.93 4.47 0.00 2.76 2.72 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 0.00 179 K 7.65 4.15 0.00 1.76 2.01 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.46 7.81 180 K 7.66 4.40 0.00 1.91 1.77 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.46 1.56 7.81 181 K 7.43 4.07 0.00 1.74 1.60 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.42 7.81