NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.3049 8.2549 119.7077 56.1232 31.5402 174.3184 4 E 4.2727 8.4560 117.4681 55.5395 31.2082 171.6565 5 V 4.3085 9.0316 121.8435 61.4229 34.9506 173.6077 6 K 5.0834 8.6078 127.4084 54.6777 35.0414 175.5381 7 L 5.8351 9.2426 122.9944 52.5854 47.0365 174.4084 8 T 4.4034 8.0585 113.5742 61.3133 71.0441 173.9975 9 K 4.1260 9.2561 122.7269 57.9362 31.4819 178.9871 10 A 4.4497 8.3536 128.6734 56.1286 19.3183 179.3339 11 G 3.8934 8.0332 103.4844 48.9139 0.0000 174.5424 12 Y 4.3213 9.0490 121.7937 60.5016 38.6615 178.3835 13 E 4.0138 8.3079 118.0759 59.7881 29.6588 179.6775 14 R 3.9092 8.5301 117.5107 58.8885 30.3381 178.1783 15 L 4.0612 7.9267 120.4583 58.3101 42.1183 178.4925 16 M 3.8517 8.7236 119.6949 58.8875 31.5441 179.3537 17 K 3.8854 8.8064 118.9792 58.9712 32.0827 178.1584 18 Q 4.2338 8.5193 118.4095 57.1367 29.5061 177.4183 19 L 3.8949 7.4908 121.0166 58.4738 42.2630 179.1208 20 E 3.9173 8.0718 117.5927 59.0933 29.1183 179.0440 21 Q 4.0396 7.5888 119.4206 59.1194 29.1262 177.7567 22 E 4.0846 8.3938 119.7860 58.8539 29.5941 179.1480 23 R 3.8652 8.1801 118.5732 59.3611 30.2848 178.5011 24 E 3.9479 7.7403 117.4149 58.7173 29.4102 178.5867 25 R 4.1246 7.1207 119.9678 58.8094 30.4745 177.3876 26 L 3.8912 8.0605 120.5078 58.5357 41.9836 179.0272 27 Q 4.1972 8.0456 117.3841 59.1659 28.5474 178.7402 28 E 4.1446 7.6206 116.6268 58.6831 29.7402 178.5101 29 A 4.0967 8.1590 121.4092 55.3164 18.6511 179.2961 30 T 3.8146 8.7254 115.2503 66.9817 68.4684 176.4646 31 K 4.0054 8.4232 119.4011 58.9040 32.3366 178.5893 32 I 3.9323 7.8367 120.5778 64.2060 37.2708 177.7112 33 L 3.9284 7.7814 121.0422 58.4880 41.7599 179.1562 34 Q 4.2438 8.0502 117.0288 58.7051 28.6303 178.3598 35 E 4.8404 8.0493 121.2869 58.4858 29.2204 179.1882 36 L 3.9994 7.5854 117.9923 57.9470 42.2010 178.7702 37 M 4.1220 8.4076 117.1838 57.7055 31.9778 177.8702 38 E 4.3089 7.7423 119.2626 58.5432 30.0019 178.1758 39 S 4.7973 8.0233 111.9334 57.9965 62.9451 174.4386 40 S 4.3223 7.9604 120.0932 59.3351 62.1036 174.3572 41 D 5.4565 7.2892 135.0000 54.2584 40.4487 175.3834 42 D 4.7241 7.1600 119.1359 54.1302 44.6417 173.4946 43 Y 4.9429 8.2151 117.4844 56.4849 40.4647 174.7793 44 D 4.4713 9.0216 124.9582 53.0363 39.6279 176.6814 45 D 5.5415 8.1595 133.4363 55.7682 41.1365 177.5562 46 S 4.3536 7.3615 115.6865 60.9639 63.1940 176.0808 47 G 3.7778 7.3520 109.5566 47.4904 0.0000 175.0935 48 L 3.9395 8.0276 119.1678 57.1122 42.7332 179.1831 49 E 4.0679 8.4013 117.6207 57.1829 29.0431 178.6547 50 A 4.4182 6.4995 120.7430 55.5476 19.3423 179.6637 51 A 4.0177 8.6541 119.5263 55.3302 18.5692 179.8330 52 K 3.8471 8.4479 116.9632 59.7470 32.2402 179.6306 53 Q 3.9930 8.5376 118.5014 59.1034 28.6508 178.7107 54 E 3.9788 8.8583 120.2407 59.0720 29.3848 179.1682 55 K 3.8157 8.2456 119.7260 59.5227 32.0882 178.5659 56 A 4.0785 8.0806 120.6712 55.3940 18.2877 179.3567 57 R 4.0932 8.3925 117.6722 59.9852 30.1257 178.5113 58 I 3.7451 7.6326 118.8849 64.1017 37.0921 178.0440 59 E 3.9031 8.4645 119.7345 59.7192 29.5305 179.5063 60 A 4.1187 8.9997 121.5227 54.9023 18.3482 179.5436 61 R 3.8261 8.2070 117.8192 60.1097 30.0960 178.4438 62 I 3.8104 8.1221 120.4701 63.9263 37.1878 177.8909 63 D 4.5290 8.8412 120.7234 56.8821 39.0476 178.2470 64 S 4.0642 7.9452 114.5850 60.8343 62.1319 175.5760 65 L 3.9191 7.8271 122.1244 58.9003 41.8978 178.9174 66 E 3.8038 8.7375 117.5495 59.4859 29.6204 178.7186 67 D 4.3953 8.6774 117.4345 57.8785 41.2412 179.5271 68 V 3.6646 7.7132 118.3278 66.0451 31.3115 179.2624 69 L 4.5561 8.1585 115.5434 55.0102 41.5031 177.8468 70 S 4.7149 9.2079 113.0099 57.7713 64.2862 174.7827 71 R 4.1785 7.5006 117.2789 57.1150 30.5703 176.5571 72 A 3.9634 7.8310 119.4434 52.0379 18.7587 176.5077 73 V 4.3933 8.3647 122.6727 60.8629 34.4252 175.5175 74 I 4.3703 8.2828 128.1827 61.3837 38.3101 175.1831 75 L 4.7280 7.8626 122.1252 52.9793 45.5822 176.6617 76 E 3.9322 8.9163 123.4176 56.3402 29.9503 176.9257 77 E 4.0197 8.8404 123.3912 57.0075 30.0806 178.4675 78 G 3.9823 8.5795 105.6785 47.0458 0.0000 175.1373 79 T 4.1845 7.7643 117.5070 60.3291 66.5898 173.5502 80 G 3.9331 7.3789 112.9477 44.9441 0.0000 170.0407 81 E 4.1178 8.6162 118.6662 56.7155 30.5376 178.0203 82 V 4.6686 7.9295 122.1350 62.6129 34.1994 174.9381 83 I 4.6081 8.2521 117.9839 59.3989 40.9880 173.0493 84 G 4.0075 8.4232 116.5467 45.9909 0.0000 173.9371 85 L 4.4204 9.0059 121.4408 57.3771 42.4747 178.1368 86 G 4.1194 8.3722 106.3567 48.6809 0.0000 173.6343 87 S 4.5527 7.7384 113.5922 57.1958 62.9380 173.0947 88 V 4.7157 8.2135 122.5396 60.9720 34.3655 174.0831 89 V 4.6693 9.3902 128.4589 61.0052 34.2042 173.6875 90 E 4.6801 8.7187 129.0218 55.5358 31.0417 175.0671 91 L 5.4373 8.8450 125.7552 52.2363 46.6686 174.6995 92 E 5.2534 8.5446 118.0166 56.3983 33.1326 173.2798 93 D 4.7261 8.1913 124.0021 51.6276 42.7389 174.9850 94 P 3.9632 0.0000 0.0000 65.0634 31.5886 176.1254 95 A 4.3649 7.8142 122.3609 54.5256 18.4462 175.2613 96 T 3.5482 8.5475 119.0849 63.1033 67.4965 173.5846 97 G 3.8049 9.9324 107.4670 45.9834 0.0000 172.8879 98 E 4.3750 7.6317 117.4162 55.0244 30.5112 176.3535 99 R 4.4615 8.6350 123.6984 56.0762 31.7794 175.9834 100 L 4.4040 8.3832 118.3975 54.8251 46.5134 173.0199 101 S 5.2499 8.9022 121.8915 56.9788 66.0229 173.6804 102 V 4.6888 8.9954 116.6594 60.1061 36.7002 173.4415 103 Q 4.7533 9.2184 122.8858 54.2919 32.6012 174.2749 104 V 4.4165 8.1038 125.0896 62.7871 32.5126 175.6706 105 V 4.5686 8.4124 119.2614 59.6095 36.4185 173.7872 106 S 4.2665 8.8975 118.0384 58.4448 62.9079 173.4584 107 P 4.2166 0.0000 0.0000 65.7460 31.4455 178.7827 108 A 4.0218 7.7557 120.4101 54.7115 18.3284 177.6971 109 E 4.4708 7.6455 112.2831 56.3075 30.3259 175.9144 110 A 4.4783 7.5219 123.6786 52.4132 19.5556 177.8421 111 S 4.6134 8.8105 116.5493 57.7544 66.0657 175.3567 112 V 4.1339 8.0602 112.7679 61.6837 31.8206 177.5899 113 L 4.0347 7.4816 120.1016 57.2090 42.2758 177.4191 114 E 4.0996 8.0754 117.2634 56.6524 30.5358 177.8598 115 N 4.8295 8.7931 117.2224 54.5389 40.1272 175.0484 116 P 4.0919 0.0000 0.0000 60.3754 27.9730 174.1594 117 M 4.3825 8.2546 120.7953 54.9943 33.3596 175.9589 118 K 4.8702 8.6717 123.6016 55.6234 32.7814 175.9703 119 I 4.6992 9.0442 119.7549 58.9981 40.8852 174.7857 120 S 4.9745 8.3391 117.7716 57.4917 63.4682 174.5972 121 D 4.4698 8.7961 124.9067 54.9880 39.4615 176.7247 122 A 4.5678 8.3600 122.2651 51.7737 19.8265 176.8741 123 S 4.4453 7.4965 111.6992 57.0326 64.1120 173.1307 124 P 4.1641 0.0000 0.0000 66.4291 31.4789 178.5683 125 M 4.1346 8.1789 116.6119 59.0116 31.9563 177.4408 126 G 4.1388 8.4070 106.4864 45.7365 0.0000 175.5921 127 K 4.0871 7.9186 122.3014 58.8233 32.9081 178.2817 128 A 4.1986 9.9554 119.3055 54.6384 18.4355 178.7555 129 L 4.6136 7.8591 115.3461 54.8170 40.9333 176.4602 130 L 4.1394 7.3103 122.9295 58.0359 41.4331 176.8764 131 G 4.0379 8.0828 120.2603 46.6801 0.0000 171.3446 132 H 4.9292 7.9917 115.4257 53.3776 32.3959 172.8742 133 R 4.7043 8.6116 115.7134 53.6921 32.1559 175.0208 134 V 3.6517 8.2526 117.5588 64.7105 31.7840 175.8462 135 G 4.4371 9.1616 112.5302 46.4205 0.0000 172.7898 136 D 4.9793 7.6966 119.0709 53.2725 43.1047 175.2376 137 V 5.0150 8.2491 121.9695 61.1699 34.1240 174.5745 138 L 4.9341 8.9822 127.2929 52.9482 45.3896 175.8934 139 S 5.1641 8.5384 114.8897 56.9062 64.0882 173.2810 140 L 4.6656 8.7874 125.8052 53.6509 44.0623 175.5214 141 D 4.9774 8.5221 121.1321 53.8577 41.8447 176.7365 142 T 4.4119 8.2298 118.9350 60.0771 69.1897 172.7960 143 P 4.4246 0.0000 0.0000 65.6273 31.4549 181.1496 144 K 4.2420 7.7869 116.3446 56.5367 32.7369 177.6636 145 G 4.0764 9.2999 111.2334 43.3656 0.0000 177.5317 146 K 4.7456 8.4117 126.0663 56.0068 34.4701 174.8378 147 K 4.2756 8.8642 124.9799 55.9528 33.7845 175.7993 148 E 5.8721 8.0701 120.9912 53.6796 33.2032 174.7939 149 F 5.5536 8.7623 121.7460 54.3841 43.0745 174.3587 150 R 4.4905 8.6559 123.2575 56.3186 31.6701 175.2499 151 V 4.0228 8.4814 126.2870 61.9013 32.4085 175.8533 152 V 4.1913 8.7402 131.3530 61.4442 30.0520 170.7682 153 A 3.6668 7.9279 132.9547 51.5850 19.0421 178.7204 154 I 4.5156 7.9666 126.4859 60.2307 35.4862 175.7528 155 H 4.2314 7.8221 119.2482 56.6607 29.7773 176.5988 156 G 4.0448 9.0285 112.6378 45.8817 0.0000 173.2082 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 3 R 8.25 4.30 0.00 1.83 1.99 0.00 3.17 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 4 E 8.46 4.27 0.00 1.93 1.87 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 2.28 2.37 0.00 5 V 9.03 4.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.95 0.00 0.00 6 K 8.61 5.08 0.00 1.73 1.66 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.41 1.42 7.81 7 L 9.24 5.84 0.00 1.49 1.54 1.05 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.06 4.40 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 1.30 0.00 0.00 9 K 9.26 4.13 0.00 1.87 1.64 0.00 1.77 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.53 7.81 10 A 8.35 4.45 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 11 G 8.03 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 12 Y 9.05 4.32 0.00 3.09 3.04 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 0.00 0.00 0.00 13 E 8.31 4.01 0.00 2.06 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 2.52 2.65 0.00 14 R 8.53 3.91 0.00 1.88 1.98 0.00 3.27 0.00 0.00 3.40 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 15 L 7.93 4.06 0.00 2.12 1.61 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 M 8.72 3.85 0.00 1.78 1.89 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.29 0.00 17 K 8.81 3.89 0.00 1.74 1.84 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.65 7.81 18 Q 8.52 4.23 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 19 L 7.49 3.89 0.00 1.72 1.66 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.07 3.92 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 2.34 2.36 0.00 21 Q 7.59 4.04 0.00 2.41 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 22 E 8.39 4.08 0.00 2.09 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 2.53 2.46 0.00 23 R 8.18 3.87 0.00 1.98 1.96 0.00 3.25 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 24 E 7.74 3.95 0.00 2.12 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 2.38 0.00 25 R 7.12 4.12 0.00 1.99 1.88 0.00 3.17 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 26 L 8.06 3.89 0.00 1.75 1.80 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 8.05 4.20 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 28 E 7.62 4.14 0.00 1.98 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 2.32 2.37 0.00 29 A 8.16 4.10 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 30 T 8.73 3.81 4.33 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 1.21 0.00 0.00 31 K 8.42 4.01 0.00 1.90 1.84 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.48 7.81 32 I 7.84 3.93 2.10 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 1.63 0.68 0.91 0.00 0.00 33 L 7.78 3.93 0.00 1.72 1.88 0.92 0.61 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 34 Q 8.05 4.24 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.69 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 35 E 8.05 4.84 0.00 2.29 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 2.43 2.21 0.00 36 L 7.59 4.00 0.00 1.73 1.72 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 37 M 8.41 4.12 0.00 1.93 2.22 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 2.73 2.57 0.00 38 E 7.74 4.31 0.00 2.01 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 2.24 2.32 0.00 39 S 8.02 4.80 0.00 4.02 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 40 S 7.96 4.32 0.00 3.90 3.78 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 41 D 7.29 5.46 0.00 2.79 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 42 D 7.16 4.72 0.00 2.72 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 43 Y 8.22 4.94 0.00 2.95 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 44 D 9.02 4.47 0.00 2.83 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 45 D 8.16 5.54 0.00 2.72 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 46 S 7.36 4.35 0.00 3.93 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 47 G 7.35 3.78 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 0.00 0.00 0.00 48 L 8.03 3.94 0.00 1.74 1.78 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.40 4.07 0.00 2.29 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 2.38 2.60 0.00 50 A 6.50 4.42 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 51 A 8.65 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 52 K 8.45 3.85 0.00 1.94 1.89 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.56 7.81 53 Q 8.54 3.99 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 54 E 8.86 3.98 0.00 2.24 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 0.00 2.33 2.46 0.00 55 K 8.25 3.82 0.00 2.01 1.93 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.22 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.47 7.81 56 A 8.08 4.08 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 57 R 8.39 4.09 0.00 1.82 1.95 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 58 I 7.63 3.75 1.99 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 1.51 0.41 0.90 0.00 0.00 59 E 8.46 3.90 0.00 2.12 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 0.00 2.33 2.34 0.00 60 A 9.00 4.12 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 61 R 8.21 3.83 0.00 2.13 2.01 0.00 3.12 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 1.78 1.69 0.00 62 I 8.12 3.81 2.08 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 1.56 0.57 0.90 0.00 0.00 63 D 8.84 4.53 0.00 2.82 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 64 S 7.95 4.06 0.00 3.92 4.02 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 65 L 7.83 3.92 0.00 1.76 1.73 0.88 1.02 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 66 E 8.74 3.80 0.00 2.09 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 2.33 2.48 0.00 67 D 8.68 4.40 0.00 2.78 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 68 V 7.71 3.66 2.23 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 1.00 0.00 0.00 0.94 0.00 0.00 69 L 8.16 4.56 0.00 1.67 1.90 0.99 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 70 S 9.21 4.71 0.00 3.77 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 71 R 7.50 4.18 0.00 2.06 2.03 0.00 3.22 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 72 A 7.83 3.96 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 73 V 8.36 4.39 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 0.94 0.00 0.00 1.00 0.00 0.00 74 I 8.28 4.37 1.79 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 1.09 0.47 0.82 0.00 0.00 75 L 7.86 4.73 0.00 1.69 1.50 0.92 0.88 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 76 E 8.92 3.93 0.00 1.95 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 2.31 2.28 0.00 77 E 8.84 4.02 0.00 2.03 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 2.42 2.33 0.00 78 G 8.58 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 0.00 0.00 0.00 79 T 7.76 4.18 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 1.21 0.00 0.00 80 G 7.38 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 0.00 0.00 0.00 81 E 8.62 4.12 0.00 1.95 1.89 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 2.29 2.26 0.00 82 V 7.93 4.67 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 0.78 0.00 0.00 0.98 0.00 0.00 83 I 8.25 4.61 1.99 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 1.28 1.12 0.96 0.00 0.00 84 G 8.42 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 9.01 4.42 0.00 1.62 1.72 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.37 4.12 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 87 S 7.74 4.55 0.00 4.01 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 88 V 8.21 4.72 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 0.97 0.00 0.00 0.97 0.00 0.00 89 V 9.39 4.67 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 0.94 0.00 0.00 0.92 0.00 0.00 90 E 8.72 4.68 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 91 L 8.84 5.44 0.00 1.70 1.74 0.54 0.72 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 92 E 8.54 5.25 0.00 2.05 1.79 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 2.30 2.14 0.00 93 D 8.19 4.73 0.00 1.94 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 0.00 0.00 0.00 0.00 94 P 0.00 3.96 0.00 2.02 2.08 0.00 3.85 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 2.00 2.13 0.00 95 A 7.81 4.36 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.55 3.55 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 1.31 0.00 0.00 97 G 9.93 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 0.00 0.00 0.00 98 E 7.63 4.38 0.00 2.12 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 2.31 2.34 0.00 99 R 8.64 4.46 0.00 1.75 1.94 0.00 3.28 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 100 L 8.38 4.40 0.00 1.71 1.57 0.89 0.85 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 0.00 101 S 8.90 5.25 0.00 3.73 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 0.00 102 V 9.00 4.69 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 0.65 0.00 0.00 0.88 0.00 0.00 103 Q 9.22 4.75 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.99 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 104 V 8.10 4.42 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 0.82 0.00 0.00 0.92 0.00 0.00 105 V 8.41 4.57 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 0.62 0.00 0.00 1.01 0.00 0.00 106 S 8.90 4.27 0.00 3.90 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 0.00 107 P 0.00 4.22 0.00 2.21 2.09 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 108 A 7.76 4.02 1.26 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 0.00 0.00 109 E 7.65 4.47 0.00 2.07 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 2.25 2.24 0.00 110 A 7.52 4.48 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 0.00 111 S 8.81 4.61 0.00 3.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.06 4.13 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 0.74 0.00 0.00 0.93 0.00 0.00 113 L 7.48 4.03 0.00 1.63 1.66 0.92 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 0.00 114 E 8.08 4.10 0.00 2.03 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 2.33 2.35 0.00 115 N 8.79 4.83 0.00 2.71 2.80 0.00 0.00 7.01 8.02 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 0.00 116 P 0.00 4.09 0.00 2.07 2.07 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.15 0.00 117 M 8.25 4.38 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.62 0.00 118 K 8.67 4.87 0.00 1.66 1.77 0.00 1.91 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.62 1.37 7.81 119 I 9.04 4.70 1.85 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 1.09 0.86 0.92 0.00 0.00 120 S 8.34 4.97 0.00 3.92 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 0.00 121 D 8.80 4.47 0.00 2.85 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 0.00 122 A 8.36 4.57 1.26 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 0.00 0.00 123 S 7.50 4.45 0.00 4.00 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 0.00 124 P 0.00 4.16 0.00 2.19 2.16 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 125 M 8.18 4.13 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 126 G 8.41 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 0.00 127 K 7.92 4.09 0.00 1.95 1.91 0.00 1.96 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.68 7.81 128 A 9.96 4.20 1.33 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 0.00 0.00 129 L 7.86 4.61 0.00 1.72 1.72 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.31 4.14 0.00 1.79 1.77 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.08 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 132 H 7.99 4.93 0.00 3.13 3.44 0.00 5.64 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 8.61 4.70 0.00 1.96 2.20 0.00 2.87 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 134 V 8.25 3.65 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 0.83 0.00 0.00 0.93 0.00 0.00 135 G 9.16 4.44 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 0.00 136 D 7.70 4.98 0.00 3.17 2.56 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 0.00 137 V 8.25 5.01 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 0.90 0.00 0.00 0.97 0.00 0.00 138 L 8.98 4.93 0.00 1.70 1.56 0.89 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 139 S 8.54 5.16 0.00 3.84 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 0.00 140 L 8.79 4.67 0.00 1.75 1.62 0.58 1.02 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 0.00 141 D 8.52 4.98 0.00 2.57 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 0.00 142 T 8.23 4.41 4.29 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 1.31 0.00 0.00 143 P 0.00 4.42 0.00 2.09 2.09 0.00 3.76 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 2.03 2.11 0.00 144 K 7.79 4.24 0.00 1.75 1.84 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.45 7.81 145 G 9.30 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 0.00 146 K 8.41 4.75 0.00 1.74 1.99 0.00 1.20 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.26 7.81 147 K 8.86 4.28 0.00 2.00 1.57 0.00 1.74 0.00 0.00 2.05 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.45 7.81 148 E 8.07 5.87 0.00 1.76 1.76 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 2.45 2.10 0.00 149 F 8.76 5.55 0.00 2.91 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 0.00 150 R 8.66 4.49 0.00 1.94 1.84 0.00 3.20 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 151 V 8.48 4.02 2.29 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 0.97 0.00 0.00 1.01 0.00 0.00 152 V 8.74 4.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.01 0.00 0.00 153 A 7.93 3.67 1.45 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 0.00 154 I 7.97 4.52 1.86 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 1.43 1.18 0.98 0.00 0.00 155 H 7.82 4.23 0.00 3.17 3.23 0.00 5.59 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 0.00 156 G 9.03 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00