NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9379 8.3549 109.7852 44.9727 0.0000 173.9193 2 L 4.1339 7.5384 119.2859 51.5920 43.1846 174.7491 3 S 4.5718 10.1786 118.0707 57.6578 66.2640 174.5227 4 D 4.6751 8.7969 121.4695 57.8034 40.4860 179.4679 5 G 3.6825 8.1199 105.4811 47.8523 0.0000 175.4859 6 E 3.9558 7.9291 120.5776 58.9861 29.4016 179.3998 7 W 4.4202 8.3491 119.1791 59.6873 29.0684 178.3892 8 Q 4.0538 8.2362 119.7148 59.1142 28.4588 178.0899 9 L 4.0200 7.7729 119.5692 57.9670 41.7302 179.3925 10 V 3.7117 7.6693 117.3517 66.5112 31.5871 178.1350 11 L 4.2332 8.5482 118.6920 57.7708 41.2243 179.4533 12 N 4.4388 8.2462 116.1594 56.3481 38.8462 177.6162 13 V 3.8046 8.2644 120.8240 64.4064 31.5586 178.2155 14 W 4.0623 8.6371 129.1318 59.9039 30.2291 178.0858 15 G 3.6467 7.9964 105.6717 47.7664 0.0000 175.8397 16 K 3.9493 7.6059 119.9061 59.0940 32.1849 179.3575 17 V 2.9294 6.9481 118.0883 65.5648 31.1081 177.7617 18 E 3.4117 7.5879 117.1822 58.8150 29.3229 178.3957 19 A 4.2361 7.2349 117.4361 52.7920 20.3382 177.3151 20 D 4.5876 8.3029 115.4214 52.4239 43.5182 175.9492 21 V 3.4543 7.6507 124.1873 66.0846 32.1600 176.8777 22 A 4.0852 7.9631 120.1512 54.9463 18.3255 179.6971 23 G 3.4508 8.3677 104.5102 48.1086 0.0000 175.8399 24 H 4.1745 8.2355 118.5589 58.4392 28.7917 178.1794 25 G 3.5219 8.2248 107.7164 47.6392 0.0000 175.5020 26 Q 3.8196 8.2043 122.4326 59.0398 29.0526 178.1767 27 E 3.8260 7.8312 119.0024 59.3146 29.4337 179.6279 28 V 3.4661 7.7698 118.1084 66.1116 31.6579 178.2126 29 L 3.4438 7.5177 118.2294 57.2697 41.3144 179.5561 30 I 3.5913 7.7060 120.1260 64.4148 37.0745 178.5063 31 R 3.8563 7.9918 119.0642 59.2228 29.7904 178.9201 32 L 3.9382 7.6340 119.9299 58.2712 41.9632 179.1058 33 F 4.6326 7.8862 117.6903 60.3596 38.5844 177.9337 34 K 4.1594 8.1358 117.7938 59.0401 32.0467 179.3958 35 G 3.7178 7.9959 105.1556 46.6903 0.0000 173.9568 36 H 4.7147 8.2590 119.7335 51.4236 29.6290 171.7876 37 P 4.5914 0.0000 0.0000 64.6394 31.0247 177.4246 38 E 4.1526 8.2595 115.9555 59.3461 29.4449 179.1384 39 T 3.7351 8.2131 111.3746 64.4997 68.8563 176.2043 40 L 3.5615 7.8646 122.9358 58.1044 41.7531 178.8533 41 E 4.0642 7.6644 117.1794 59.1051 29.4374 178.4574 42 K 4.0461 8.1080 117.1163 57.7413 32.6051 176.6806 43 F 4.6567 8.1349 118.8297 55.4259 40.0572 176.1668 44 D 4.3156 8.6840 127.0060 56.9278 40.7882 177.6409 45 K 4.2094 7.4933 114.9651 57.1322 33.1710 176.8258 46 F 5.1020 7.2932 117.1825 57.2321 40.7099 176.8490 47 K 3.9429 8.0215 121.8848 59.3380 31.9392 176.8533 48 H 4.6522 7.9663 113.0424 55.4846 29.0770 174.9705 49 L 4.3477 8.1263 121.8240 54.7313 41.7526 177.0740 50 K 4.4835 9.3505 122.4473 56.4407 33.4656 176.3706 51 S 4.6438 7.3804 113.2127 55.9660 67.1800 174.3821 52 E 3.9607 8.6744 122.0760 59.0657 29.3294 178.2221 53 D 4.2810 8.0093 118.0056 57.2756 41.1496 177.9418 54 E 3.9344 7.8689 117.7070 59.7668 29.6422 178.8085 55 M 4.1434 8.1160 118.6828 58.4931 31.7721 179.0822 56 K 3.9442 8.5146 117.7438 59.2233 32.3045 179.0064 57 A 4.2627 7.8064 119.9023 53.1308 18.4864 177.5323 58 S 4.1727 7.4806 113.5723 58.1946 62.9469 174.6394 59 E 4.0033 9.0002 128.2355 59.7645 29.3134 179.0097 60 D 4.5453 8.1802 118.4526 57.0816 40.8593 178.4554 61 L 3.1842 7.9592 120.9885 57.8125 42.0847 178.8198 62 K 3.8033 7.6799 119.6439 59.4300 31.9559 178.6671 63 K 3.9396 8.1247 118.5768 59.9771 32.0309 178.7817 64 H 4.3114 8.6773 118.5375 59.2059 29.7539 177.5521 65 G 3.4991 8.3558 107.8567 47.6241 0.0000 175.1572 66 N 4.2987 8.1001 119.6407 56.7773 39.0932 176.9633 67 T 3.9148 8.1747 117.3074 66.9585 68.5545 176.7330 68 T 3.8873 8.0297 117.5404 66.8247 68.5384 176.9090 69 L 4.2371 8.1334 120.8465 57.8969 41.5226 179.5989 70 T 3.9869 8.5667 116.1101 66.7025 68.0940 176.4564 71 A 4.0098 7.9349 122.1480 55.0521 18.3940 179.4945 72 L 3.7483 8.0595 119.0899 58.0201 42.0195 179.4023 73 G 3.1602 8.6327 106.3688 47.4196 0.0000 175.9378 74 G 3.5524 7.6233 107.0011 47.5019 0.0000 175.7514 75 I 3.8614 7.3025 121.7257 64.2322 37.2411 178.4610 76 L 3.9458 7.6082 119.8028 57.6707 41.1601 179.7203 77 K 3.9896 7.9150 117.4331 58.4890 32.1116 177.8271 78 K 4.0746 7.5955 117.5538 55.1223 32.2239 176.9001 79 K 2.0000 7.9198 117.5096 56.4786 29.7478 175.9038 80 G 3.8521 8.2053 106.5370 45.2785 0.0000 173.3823 81 H 4.9895 7.6093 115.0213 55.2504 28.2963 173.8492 82 H 4.8121 7.4231 111.9720 55.9272 29.8169 176.0225 83 E 3.9542 8.4312 120.6382 60.3567 28.9932 178.7836 84 A 4.0223 8.0730 119.0353 55.3012 18.4491 178.7997 85 E 4.1860 8.0387 114.0543 58.6467 30.3912 178.2774 86 L 4.1561 8.1376 121.7234 58.3712 42.0595 178.2179 87 T 3.8502 8.0847 115.4410 66.8060 68.3443 174.1427 88 P 4.2713 0.0000 0.0000 65.7607 31.4380 178.5956 89 L 4.0170 7.9076 118.2280 58.0971 42.1382 178.5704 90 A 4.1591 8.3232 121.0738 55.3950 18.4341 179.2712 91 Q 3.8281 8.4349 117.0784 59.4571 28.7899 179.6372 92 S 4.0712 8.4949 115.1947 61.5407 63.0998 176.1300 93 H 4.1797 8.3925 119.8104 58.3195 28.1293 177.5982 94 A 3.0700 7.9026 123.1818 54.7371 17.8410 179.4312 95 T 4.0268 7.0738 105.9498 62.8451 69.5945 175.5335 96 K 4.2282 7.6143 120.4683 57.3157 33.7257 176.2973 97 H 4.4082 8.0461 114.5103 55.1289 29.9427 174.6876 98 K 3.7104 7.5027 118.7141 56.3667 30.0160 175.7854 99 I 4.2646 7.2434 119.1897 58.5550 38.2704 174.5339 100 P 4.3290 0.0000 0.0000 62.5767 31.6872 177.5124 101 V 3.2118 8.3979 119.6856 66.0818 31.1416 178.0923 102 K 3.5664 7.8630 118.6991 59.8832 31.9958 178.0997 103 Y 4.0771 7.8918 116.1070 60.4046 37.6922 178.0168 104 L 4.2631 8.1644 120.4447 57.0303 41.7020 178.6750 105 E 4.0761 7.7939 119.2825 58.8834 29.6908 178.3854 106 F 4.6908 7.8054 118.0454 60.7191 38.9491 177.5010 107 I 3.8369 8.0205 118.1939 63.9791 37.7108 178.1865 108 S 4.1966 8.1008 115.9936 61.5217 62.6121 176.4222 109 E 4.0096 8.3515 121.0616 59.4417 29.2837 179.2344 110 A 4.2823 7.9650 122.0819 54.5942 18.4069 179.6281 111 I 3.6467 8.4067 118.5405 64.7133 37.2315 178.6524 112 I 3.8127 7.9634 120.4814 64.6662 36.5221 178.5435 113 Q 4.0439 8.5314 119.2360 58.9419 28.4038 179.1563 114 V 3.5395 7.9111 119.3255 65.8581 31.5705 178.1033 115 L 3.6730 7.8383 118.8229 57.6022 41.0485 179.3253 116 Q 4.2239 7.8570 118.6497 59.3361 29.1278 178.2213 117 S 4.2368 7.8837 114.9812 61.5771 63.0383 176.4444 118 K 4.0850 8.4579 119.7363 57.7742 33.2537 176.8857 119 H 5.0268 8.5228 116.3714 53.3748 29.4756 172.4259 120 P 4.2881 0.0000 0.0000 66.0974 31.3326 178.2415 121 G 3.8590 8.1342 106.3591 48.7044 0.0000 174.2855 122 D 4.5317 8.0721 119.6384 55.2507 41.4534 176.8809 123 F 4.9025 8.0949 121.9384 56.2800 38.7903 175.4041 124 G 3.9381 7.5864 111.0668 43.0230 0.0000 169.9635 125 A 3.8792 8.4448 120.5252 55.5401 18.2395 179.8185 126 D 4.2186 7.9342 116.3996 57.2213 41.0478 178.5910 127 A 3.9959 7.8152 120.7892 55.2627 18.3326 179.5377 128 Q 3.3894 7.7113 116.6150 58.7965 28.7427 179.3076 129 G 3.4834 7.9442 106.4665 47.6265 0.0000 175.6320 130 A 3.8530 7.9415 123.3097 55.0721 18.3775 179.4582 131 M 4.0271 8.4615 117.1842 58.9209 32.3330 178.5936 132 S 4.1696 8.4261 115.6578 61.5789 62.9298 176.8790 133 K 3.9457 8.1640 121.0228 59.1707 31.7328 179.3163 134 A 3.8187 7.8326 121.2608 55.1093 18.3045 179.7009 135 L 4.1547 8.2284 117.6097 57.6653 41.6972 179.2639 136 E 4.0752 8.4518 119.6605 59.0560 29.4746 178.6244 137 L 4.0012 8.2489 120.7177 57.8102 42.1503 178.6168 138 F 4.1650 8.1802 120.6583 61.6220 39.4588 177.4930 139 R 3.4653 8.6626 117.7335 58.8471 29.7365 179.0083 140 N 4.2561 8.2245 116.6733 56.4309 38.5951 177.2246 141 D 4.3944 8.3878 120.5842 57.4506 40.7672 178.8029 142 M 3.9066 7.6668 119.2515 58.0506 31.8424 178.6049 143 A 3.6279 7.7050 120.8089 54.7021 18.5963 179.3705 144 A 3.9082 7.9373 119.3423 55.4783 18.5262 179.9412 145 K 3.9674 8.0350 116.5552 59.7706 32.0548 179.2378 146 Y 4.0156 8.4246 117.0159 61.1293 38.0302 178.7190 147 K 4.0764 8.6368 121.7854 58.5229 32.3591 178.4450 148 E 4.0131 8.1205 119.7624 59.1144 29.4326 177.9238 149 L 4.4115 7.8660 115.8964 54.3502 42.8694 176.3338 150 G 4.1101 7.7429 105.3783 47.9387 0.0000 172.3999 151 F 4.7955 8.9975 120.7405 56.7291 41.6170 176.5917 152 Q 4.6604 10.2533 124.4475 56.9979 27.8109 174.3808 153 G 3.7863 7.8644 110.3169 46.8553 0.0000 173.0989 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 8.35 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 L 7.54 4.13 0.00 0.51 0.91 0.46 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 3 S 10.18 4.57 0.00 4.01 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 4 D 8.80 4.68 0.00 2.77 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.12 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 6 E 7.93 3.96 0.00 1.95 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 2.21 2.26 0.00 7 W 8.35 4.42 0.00 3.57 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.24 4.05 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 9 L 7.77 4.02 0.00 1.94 1.74 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.67 3.71 2.43 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 1.23 0.00 0.00 0.90 0.00 0.00 11 L 8.55 4.23 0.00 1.89 1.80 0.92 0.97 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 12 N 8.25 4.44 0.00 2.88 2.93 0.00 0.00 7.06 7.20 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 13 V 8.26 3.80 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 1.06 0.00 0.00 0.92 0.00 0.00 14 W 8.64 4.06 0.00 3.65 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 15 G 8.00 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 16 K 7.61 3.95 0.00 1.63 1.48 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.39 7.81 17 V 6.95 2.93 0.67 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 -0.10 0.00 0.00 0.18 0.00 0.00 18 E 7.59 3.41 0.00 2.04 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 2.37 2.42 0.00 19 A 7.23 4.24 1.27 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 0.00 0.00 20 D 8.30 4.59 0.00 2.65 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.65 3.45 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 0.99 0.00 0.00 0.89 0.00 0.00 22 A 7.96 4.09 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 23 G 8.37 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 24 H 8.24 4.17 0.00 3.11 3.22 0.00 5.82 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 25 G 8.22 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.20 3.82 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 27 E 7.83 3.83 0.00 1.94 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 2.23 2.22 0.00 28 V 7.77 3.47 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 0.98 0.00 0.00 0.97 0.00 0.00 29 L 7.52 3.44 0.00 1.52 0.85 0.80 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.71 3.59 1.87 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 1.47 0.77 0.87 0.00 0.00 31 R 7.99 3.86 0.00 1.87 1.93 0.00 3.23 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.73 0.00 32 L 7.63 3.94 0.00 1.71 1.39 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.89 4.63 0.00 3.13 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 34 K 8.14 4.16 0.00 1.78 1.83 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.49 0.00 0.00 0.00 0.00 1.47 1.53 7.81 35 G 8.00 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 36 H 8.26 4.71 0.00 2.87 2.89 0.00 5.65 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.59 0.00 2.15 2.13 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 38 E 8.26 4.15 0.00 2.33 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 0.00 2.39 2.60 0.00 39 T 8.21 3.74 4.39 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 0.78 0.00 0.00 40 L 7.86 3.56 0.00 1.58 1.78 0.10 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.66 4.06 0.00 2.25 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 0.00 2.52 2.54 0.00 42 K 8.11 4.05 0.00 1.94 1.68 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.68 1.96 7.81 43 F 8.13 4.66 0.00 3.25 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 44 D 8.68 4.32 0.00 2.59 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 45 K 7.49 4.21 0.00 1.45 1.73 0.00 1.35 0.00 0.00 1.50 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.92 0.32 7.81 46 F 7.29 5.10 0.00 2.91 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 47 K 8.02 3.94 0.00 1.77 1.69 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.65 7.81 48 H 7.97 4.65 0.00 3.25 3.36 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 49 L 8.13 4.35 0.00 1.58 1.61 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.35 4.48 0.00 1.84 1.83 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.44 7.81 51 S 7.38 4.64 0.00 3.99 3.91 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 0.00 0.00 0.00 52 E 8.67 3.96 0.00 2.05 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 2.35 2.33 0.00 53 D 8.01 4.28 0.00 2.81 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 54 E 7.87 3.93 0.00 2.17 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 2.35 2.35 0.00 55 M 8.12 4.14 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 56 K 8.51 3.94 0.00 1.78 1.83 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.56 7.81 57 A 7.81 4.26 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 58 S 7.48 4.17 0.00 3.95 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 59 E 9.00 4.00 0.00 2.10 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 2.41 2.42 0.00 60 D 8.18 4.55 0.00 3.02 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 61 L 7.96 3.18 0.00 1.17 1.59 0.36 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.68 3.80 0.00 1.76 1.91 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.45 7.81 63 K 8.12 3.94 0.00 2.17 1.94 0.00 1.64 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.54 7.81 64 H 8.68 4.31 0.00 3.64 3.53 0.00 5.78 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 65 G 8.36 3.50 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 0.00 0.00 0.00 66 N 8.10 4.30 0.00 2.86 2.99 0.00 0.00 7.25 6.93 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 67 T 8.17 3.91 4.41 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 1.26 0.00 0.00 68 T 8.03 3.89 4.41 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 1.26 0.00 0.00 69 L 8.13 4.24 0.00 1.76 1.92 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.57 3.99 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 1.26 0.00 0.00 71 A 7.93 4.01 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 72 L 8.06 3.75 0.00 1.55 1.67 0.09 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.63 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 0.00 0.00 0.00 74 G 7.62 3.55 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 0.00 0.00 0.00 75 I 7.30 3.86 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.88 0.87 0.00 0.00 76 L 7.61 3.95 0.00 1.10 1.49 0.06 0.55 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 77 K 7.92 3.99 0.00 1.69 1.81 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.70 7.81 78 K 7.60 4.07 0.00 1.75 1.83 0.00 1.80 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.49 1.59 7.81 79 K 7.92 2.00 0.00 0.93 0.74 0.00 1.41 0.00 0.00 1.30 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.45 0.77 7.81 80 G 8.21 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.61 4.99 0.00 3.09 3.25 0.00 5.71 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.42 4.81 0.00 3.29 3.55 0.00 5.51 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.43 3.95 0.00 2.10 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 2.43 2.51 0.00 84 A 8.07 4.02 1.31 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 0.00 0.00 85 E 8.04 4.19 0.00 2.14 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 0.00 2.43 2.29 0.00 86 L 8.14 4.16 0.00 1.95 1.91 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.08 3.85 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 1.22 0.00 0.00 88 P 0.00 4.27 0.00 2.18 2.14 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 89 L 7.91 4.02 0.00 1.83 1.87 1.01 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.32 4.16 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 91 Q 8.43 3.83 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 92 S 8.49 4.07 0.00 3.92 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 93 H 8.39 4.18 0.00 3.52 3.53 0.00 5.81 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 94 A 7.90 3.07 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.07 4.03 4.24 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 1.13 0.00 0.00 96 K 7.61 4.23 0.00 1.57 1.67 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.18 1.34 7.81 97 H 8.05 4.41 0.00 3.06 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.50 3.71 0.00 1.84 1.78 0.00 1.61 0.00 0.00 1.55 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.36 7.81 99 I 7.24 4.26 2.05 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 1.54 1.19 1.13 0.00 0.00 100 P 0.00 4.33 0.00 1.79 1.93 0.00 3.29 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.25 0.00 101 V 8.40 3.21 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 0.89 0.00 0.00 0.18 0.00 0.00 102 K 7.86 3.57 0.00 1.70 1.60 0.00 1.90 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.56 1.24 7.81 103 Y 7.89 4.08 0.00 3.25 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.16 4.26 0.00 1.71 1.75 0.57 0.76 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 0.00 105 E 7.79 4.08 0.00 1.93 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 106 F 7.81 4.69 0.00 3.21 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 0.00 107 I 8.02 3.84 2.00 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 1.56 1.37 1.08 0.00 0.00 108 S 8.10 4.20 0.00 4.17 3.98 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 0.00 109 E 8.35 4.01 0.00 2.32 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 0.00 2.42 2.76 0.00 110 A 7.97 4.28 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 0.00 111 I 8.41 3.65 2.08 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 1.57 0.89 1.01 0.00 0.00 112 I 7.96 3.81 2.12 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 1.76 0.75 1.15 0.00 0.00 113 Q 8.53 4.04 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 114 V 7.91 3.54 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 0.92 0.00 0.00 0.93 0.00 0.00 115 L 7.84 3.67 0.00 0.89 0.45 0.67 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.86 4.22 0.00 2.31 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 117 S 7.88 4.24 0.00 3.82 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.46 4.08 0.00 1.34 1.45 0.00 1.69 0.00 0.00 1.43 0.00 0.00 2.30 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.26 1.42 7.81 119 H 8.52 5.03 0.00 3.14 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.29 0.00 2.20 2.24 0.00 3.86 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 121 G 8.13 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 0.00 122 D 8.07 4.53 0.00 2.77 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 0.00 123 F 8.09 4.90 0.00 2.93 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 0.00 124 G 7.59 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.44 3.88 1.27 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 0.00 0.00 126 D 7.93 4.22 0.00 2.66 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 0.00 127 A 7.82 4.00 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 0.00 128 Q 7.71 3.39 0.00 1.80 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.27 1.47 0.00 129 G 7.94 3.48 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 0.00 130 A 7.94 3.85 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 0.00 131 M 8.46 4.03 0.00 2.41 2.33 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.89 0.00 132 S 8.43 4.17 0.00 3.87 3.91 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 0.00 0.00 0.00 133 K 8.16 3.95 0.00 1.77 1.69 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.51 7.81 134 A 7.83 3.82 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 0.00 135 L 8.23 4.15 0.00 1.77 1.83 0.99 0.63 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 0.00 136 E 8.45 4.08 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 2.30 2.31 0.00 137 L 8.25 4.00 0.00 1.85 1.97 1.12 1.00 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 0.00 138 F 8.18 4.16 0.00 3.16 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 0.00 139 R 8.66 3.47 0.00 1.73 1.77 0.00 3.13 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.99 0.00 140 N 8.22 4.26 0.00 2.93 2.83 0.00 0.00 6.89 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 0.00 141 D 8.39 4.39 0.00 2.80 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 0.00 142 M 7.67 3.91 0.00 1.63 1.51 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 1.43 2.00 0.00 143 A 7.71 3.63 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 0.00 144 A 7.94 3.91 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 0.00 145 K 8.04 3.97 0.00 1.86 1.97 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.66 7.81 146 Y 8.42 4.02 0.00 3.17 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 0.00 147 K 8.64 4.08 0.00 1.83 1.85 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.34 7.81 148 E 8.12 4.01 0.00 2.37 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 0.00 2.33 2.37 0.00 149 L 7.87 4.41 0.00 1.91 1.93 0.84 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.74 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 0.00 151 F 9.00 4.80 0.00 3.05 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 0.00 152 Q 10.25 4.66 0.00 2.18 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 153 G 7.86 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