NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3908 8.3344 115.4117 57.9151 64.2541 174.1072 2 M 4.1131 8.2978 121.2548 56.0371 29.4844 173.8358 3 Q 4.1640 8.3366 122.3488 56.4280 30.7371 175.1659 4 D 4.5762 7.6547 115.7573 50.7957 42.7761 173.2282 5 P 4.3866 0.0000 0.0000 65.6638 31.5662 178.0013 6 I 3.6726 7.8883 118.8953 64.2293 36.9593 177.5159 7 A 3.9143 8.4733 121.2418 55.4948 18.0739 178.7784 8 D 4.7606 7.4897 116.3415 57.0884 41.1948 178.2665 9 M 4.1212 7.7629 117.6654 58.7471 32.1835 178.0469 10 L 3.9152 7.8118 118.4608 57.9546 42.0332 179.2706 11 T 3.7990 8.5596 110.5713 65.0963 68.5389 176.1187 12 R 3.9212 8.7215 122.5413 59.0878 30.1490 178.7345 13 I 3.6615 7.8305 119.3830 64.3401 37.2007 178.3675 14 R 3.9035 8.0446 116.6155 59.7665 28.8615 178.4895 15 N 4.4403 8.1178 116.0980 55.8328 38.8224 177.2976 16 G 3.7842 8.0577 107.0209 48.1329 0.0000 175.4360 17 Q 4.0135 8.1830 121.1092 58.6929 28.5347 179.4850 18 A 4.1960 7.8981 119.6052 53.9564 18.3219 178.4153 19 A 4.4517 8.4764 118.1852 51.2434 19.0084 177.5435 20 N 4.5391 7.6818 112.0248 53.1018 37.0746 174.6930 21 K 3.9543 7.7026 116.9851 56.3882 32.3294 176.2975 22 A 3.9056 8.4160 126.1085 55.1917 19.1008 178.3390 23 A 5.1720 7.3595 120.0647 51.0092 22.4897 174.5844 24 V 4.6415 7.8787 110.4392 61.3947 35.0871 173.3104 25 T 5.9020 8.5340 111.2187 59.1001 72.0846 172.5148 26 M 4.2925 8.0839 118.9578 54.1893 33.1462 173.5233 27 P 5.3751 0.0000 0.0000 62.4259 30.9620 175.8468 28 S 4.4932 8.5570 121.4811 58.9207 64.1402 172.8456 29 S 4.4825 8.5142 112.5176 56.3621 64.0726 176.0368 30 K 3.6674 7.6549 116.8025 60.6641 31.5392 178.5370 31 L 3.8659 7.8279 119.3677 58.4675 42.4857 179.2912 32 K 3.7635 7.5308 117.1014 59.7756 31.9714 179.0837 33 V 3.3128 7.9291 117.5006 65.9615 31.3259 177.5194 34 A 3.9275 7.5705 119.1055 55.5510 18.4105 179.3807 35 I 3.6998 8.2075 117.9152 64.4940 37.2146 178.4866 36 A 3.7948 7.5935 121.5538 55.1115 18.0352 179.1222 37 N 4.0984 7.9439 115.7930 56.6722 38.6725 177.3355 38 V 3.6392 7.3552 119.1495 65.9144 32.0354 177.8435 39 L 4.3412 7.7428 118.1862 57.2598 41.5720 179.1995 40 K 4.0867 8.0566 119.9555 59.4646 32.1781 178.3287 41 E 4.2981 8.4530 114.8574 57.2758 29.1542 176.9035 42 E 4.3820 7.8922 118.5907 58.6302 31.8038 176.3172 43 G 4.0407 7.2769 107.5478 45.7804 0.0000 172.7495 44 F 4.9638 7.8759 118.0169 57.8028 44.8481 174.8273 45 I 4.8950 7.5091 111.9799 58.7387 40.5755 174.5730 46 E 4.1409 8.7399 122.5622 58.9546 29.9340 176.4538 47 D 4.6668 7.6412 114.8167 54.9652 46.5296 174.0483 48 F 5.8075 8.4181 111.1890 57.0852 40.5437 173.2400 49 K 4.4748 8.6497 119.6520 55.3631 35.8234 174.9526 50 V 4.6745 8.2799 125.0233 59.5132 32.4097 174.8237 51 E 4.2575 8.7135 128.6314 55.7267 32.0771 174.3008 52 G 4.7889 8.6039 109.3265 45.8335 0.0000 172.3401 53 D 4.7029 8.4078 118.1287 55.8792 42.6581 177.9780 54 T 4.0591 7.7808 112.2705 63.0782 68.1739 174.4349 55 K 4.4671 7.7333 121.2748 53.3875 33.2216 173.3084 56 P 4.7581 0.0000 0.0000 62.9878 32.1314 175.1947 57 E 5.2771 8.6897 123.9382 54.7453 33.9298 174.0415 58 L 4.6256 8.0902 121.0445 53.9666 44.6778 175.4594 59 E 4.3364 9.3801 133.7755 55.5993 27.6962 178.4510 60 L 4.7771 8.0529 124.0346 54.9153 41.4458 174.7957 61 T 4.1512 8.6981 112.5527 61.1816 69.8093 174.3631 62 L 4.4491 8.2452 126.2301 54.5033 42.3742 176.6069 63 K 4.8501 8.4900 122.9079 55.1978 35.0168 174.3540 64 Y 5.0969 8.5671 120.8138 56.5280 43.2045 176.2338 65 F 5.4506 8.3327 124.2157 58.6177 39.8478 178.1715 66 Q 4.3991 8.2164 123.9565 55.2949 27.3971 177.9972 67 G 3.9001 8.5198 111.5331 45.3077 0.0000 172.0163 68 K 4.2199 7.2878 117.2425 55.7340 35.2309 173.3599 69 A 4.6385 8.5329 125.6422 50.9471 19.0627 176.8354 70 V 3.4172 7.0323 119.0798 64.8997 31.8380 175.8236 71 V 3.6447 7.9227 130.0259 63.6760 31.3978 175.7262 72 E 4.3873 8.5270 124.7967 56.6000 30.7969 176.1994 73 S 4.3673 7.5408 114.2042 57.7101 65.4063 173.3337 74 I 4.6518 8.2368 128.4329 60.0513 40.2703 173.5340 75 Q 4.6706 8.4841 127.2072 53.8132 33.5068 174.6942 76 R 4.0298 8.3203 120.6598 56.4139 31.0406 174.4696 77 V 3.9811 8.0393 118.7159 64.2257 34.0630 176.7386 78 S 4.4585 7.5765 116.3265 57.4232 62.2980 174.7813 79 R 3.8960 7.8828 115.5631 55.1088 29.6352 174.0448 80 P 4.3303 0.0000 0.0000 63.0174 31.9781 176.4034 81 G 4.1037 8.5388 103.6132 45.7620 0.0000 173.4106 82 L 4.5185 7.2025 115.5357 53.8335 44.3563 175.0322 83 R 4.0153 8.2321 117.1865 56.6124 31.2059 176.6477 84 I 4.5802 8.0118 121.5249 59.7608 40.2161 173.9916 85 Y 4.6401 8.9010 124.5710 56.0764 40.4410 175.3333 86 K 4.8105 8.6018 122.2349 54.5392 36.8705 176.2643 87 R 4.6747 8.3561 120.8794 54.8280 31.1631 177.8191 88 K 3.8260 8.7010 117.7638 60.6541 32.0722 178.2021 89 D 4.6740 8.0240 116.3958 53.3198 39.5441 176.0956 90 E 4.6371 8.2131 119.0165 56.2522 29.9811 175.3277 91 L 4.4479 7.3864 119.6089 52.6744 42.5945 175.2289 92 P 4.4584 0.0000 0.0000 62.5758 32.0052 176.4170 93 K 4.2506 7.7777 119.0564 53.2321 32.1862 173.7956 94 V 3.0909 7.9136 122.1206 64.2925 32.3748 175.7771 95 M 3.0267 9.3922 127.4997 58.0603 30.3650 176.0514 96 A 3.9626 9.0497 113.1254 53.4497 17.0262 177.1517 97 G 4.2191 8.4253 110.1709 47.8458 0.0000 177.1412 98 L 3.9247 8.0417 119.3042 56.8521 41.8435 177.0819 99 G 4.3149 7.1846 106.9110 43.9078 0.0000 172.0463 100 I 4.9133 7.8967 110.7543 59.3415 41.9400 174.4146 101 A 5.2898 9.7613 124.9968 48.8091 21.4589 175.6402 102 V 3.9738 8.4412 122.5418 64.0691 32.6684 174.9492 103 V 4.5783 8.5562 128.0763 61.0834 34.8927 174.4840 104 S 4.7812 9.4154 123.5941 57.6948 62.7138 173.2716 105 T 4.6551 8.3556 118.3091 59.7819 71.2623 175.6510 106 S 4.2940 8.7904 115.2851 59.8975 62.5944 174.4333 107 K 4.2893 9.0403 118.7079 56.2384 33.1731 176.6653 108 G 4.0732 6.7581 107.6154 45.1295 0.0000 172.6597 109 V 4.5534 7.6845 119.8425 62.8943 29.5143 175.7002 110 M 4.5027 8.3023 124.7101 53.8942 34.7034 175.4132 111 T 4.9902 7.9643 108.1239 60.0730 71.5781 173.5044 112 D 4.2269 8.0060 120.0337 57.3874 39.9052 179.1494 113 R 3.8537 8.2075 118.9213 59.2675 30.1929 177.5950 114 A 3.9309 8.1969 118.5800 54.8207 18.0336 178.8570 115 A 3.9295 8.0546 117.1067 54.6743 18.7641 179.8148 116 R 3.7972 7.8273 115.6398 60.0596 30.2397 178.5410 117 Q 4.1102 8.2273 116.1544 58.8171 28.7230 178.4451 118 A 4.1273 7.8153 121.2472 52.7782 19.5613 177.2530 119 G 3.7054 9.5458 104.5827 44.7092 0.0000 172.9969 120 L 4.3564 7.0992 114.6198 54.8347 43.1888 175.5064 121 G 3.9867 8.3610 110.2545 44.5834 0.0000 172.6968 122 G 4.0841 7.7404 103.7279 45.1247 0.0000 173.3345 123 E 4.1566 8.0096 123.6260 55.4868 30.5370 177.0092 124 I 4.0649 8.1307 127.8185 62.0821 37.8383 174.9765 125 I 4.6640 7.7988 119.6823 62.8599 43.9104 175.2967 126 C 4.5788 7.4359 113.8543 57.2988 32.1051 173.3525 127 Y 5.5626 7.6586 115.0764 56.4250 36.5943 178.6896 128 V 3.7314 7.6697 119.7320 63.2934 31.8038 176.6812 129 A 4.2566 8.5577 129.1404 52.0386 18.5013 177.2572 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 S 8.33 4.39 0.00 3.99 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 2 M 8.30 4.11 0.00 2.05 2.05 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 2.68 0.00 3 Q 8.34 4.16 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 4 D 7.65 4.58 0.00 2.54 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 5 P 0.00 4.39 0.00 2.28 2.27 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 6 I 7.89 3.67 1.94 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 1.53 1.11 0.85 0.00 0.00 7 A 8.47 3.91 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 7.49 4.76 0.00 2.78 2.81 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 9 M 7.76 4.12 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 10 L 7.81 3.92 0.00 1.82 1.63 0.84 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.56 3.80 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 12 R 8.72 3.92 0.00 1.99 2.04 0.00 3.30 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.90 0.00 13 I 7.83 3.66 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.14 0.86 0.00 0.00 14 R 8.04 3.90 0.00 2.02 2.17 0.00 2.76 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.67 0.00 15 N 8.12 4.44 0.00 2.94 2.93 0.00 0.00 7.03 6.99 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 16 G 8.06 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 17 Q 8.18 4.01 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 18 A 7.90 4.20 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 19 A 8.48 4.45 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 20 N 7.68 4.54 0.00 2.93 2.87 0.00 0.00 6.98 7.49 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 21 K 7.70 3.95 0.00 1.87 1.97 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.58 7.81 22 A 8.42 3.91 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 A 7.36 5.17 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 24 V 7.88 4.64 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 0.77 0.00 0.00 0.95 0.00 0.00 25 T 8.53 5.90 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 1.27 0.00 0.00 26 M 8.08 4.29 0.00 2.03 2.06 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 2.32 2.34 0.00 27 P 0.00 5.38 0.00 2.10 2.16 0.00 3.39 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.81 0.00 28 S 8.56 4.49 0.00 3.92 4.16 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 29 S 8.51 4.48 0.00 3.96 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 30 K 7.65 3.67 0.00 1.82 1.81 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.55 7.81 31 L 7.83 3.87 0.00 1.73 1.64 0.90 0.56 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 32 K 7.53 3.76 0.00 2.11 1.85 0.00 1.87 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.47 7.81 33 V 7.93 3.31 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 1.19 0.00 0.00 1.03 0.00 0.00 34 A 7.57 3.93 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 35 I 8.21 3.70 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.73 0.83 0.00 0.00 36 A 7.59 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 7.94 4.10 0.00 2.60 2.94 0.00 0.00 6.83 7.35 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 38 V 7.36 3.64 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 0.92 0.00 0.00 1.00 0.00 0.00 39 L 7.74 4.34 0.00 1.84 1.79 0.84 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.06 4.09 0.00 2.11 2.16 0.00 1.81 0.00 0.00 2.11 0.00 0.00 3.34 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.65 7.81 41 E 8.45 4.30 0.00 1.98 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 2.41 2.72 0.00 42 E 7.89 4.38 0.00 2.26 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 2.36 2.47 0.00 43 G 7.28 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 44 F 7.88 4.96 0.00 3.15 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 45 I 7.51 4.89 2.21 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 1.49 0.76 0.96 0.00 0.00 46 E 8.74 4.14 0.00 2.11 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 2.58 2.53 0.00 47 D 7.64 4.67 0.00 2.87 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 48 F 8.42 5.81 0.00 3.08 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 49 K 8.65 4.47 0.00 1.76 1.78 0.00 1.41 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.49 7.81 50 V 8.28 4.67 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 0.99 0.00 0.00 1.02 0.00 0.00 51 E 8.71 4.26 0.00 2.45 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 2.36 2.32 0.00 52 G 8.60 4.79 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 53 D 8.41 4.70 0.00 2.66 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.78 4.06 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 1.22 0.00 0.00 55 K 7.73 4.47 0.00 1.80 1.72 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.33 7.81 56 P 0.00 4.76 0.00 2.24 2.20 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 57 E 8.69 5.28 0.00 2.11 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 2.20 2.27 0.00 58 L 8.09 4.63 0.00 1.94 1.52 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 59 E 9.38 4.34 0.00 1.95 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 2.31 2.32 0.00 60 L 8.05 4.78 0.00 1.79 1.62 0.98 1.03 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 61 T 8.70 4.15 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 1.27 0.00 0.00 62 L 8.25 4.45 0.00 1.97 1.53 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.49 4.85 0.00 1.77 1.82 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.52 7.81 64 Y 8.57 5.10 0.00 3.07 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 8.33 5.45 0.00 2.86 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 0.00 0.00 0.00 0.00 66 Q 8.22 4.40 0.00 1.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.52 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 67 G 8.52 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.29 4.22 0.00 1.85 1.71 0.00 1.67 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.44 7.81 69 A 8.53 4.64 1.12 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 70 V 7.03 3.42 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.96 0.00 0.00 71 V 7.92 3.64 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 0.73 0.00 0.00 0.96 0.00 0.00 72 E 8.53 4.39 0.00 2.13 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 2.22 2.24 0.00 73 S 7.54 4.37 0.00 3.89 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 74 I 8.24 4.65 1.71 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.78 0.84 0.00 0.00 75 Q 8.48 4.67 0.00 1.97 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 76 R 8.32 4.03 0.00 1.71 1.73 0.00 3.24 0.00 0.00 3.07 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 77 V 8.04 3.98 1.77 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 0.54 0.00 0.00 -0.19 0.00 0.00 78 S 7.58 4.46 0.00 3.71 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 79 R 7.88 3.90 0.00 1.85 1.89 0.00 3.07 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.56 0.00 80 P 0.00 4.33 0.00 2.22 2.22 0.00 3.80 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 2.05 1.94 0.00 81 G 8.54 4.10 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 0.00 0.00 0.00 82 L 7.20 4.52 0.00 1.50 1.54 0.89 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.23 4.02 0.00 2.07 1.91 0.00 3.27 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 84 I 8.01 4.58 1.75 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.41 0.90 0.00 0.00 85 Y 8.90 4.64 0.00 2.76 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 86 K 8.60 4.81 0.00 1.69 1.85 0.00 1.71 0.00 0.00 1.96 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.46 7.81 87 R 8.36 4.67 0.00 2.03 1.88 0.00 3.16 0.00 0.00 3.70 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 88 K 8.70 3.83 0.00 1.93 2.10 0.00 1.51 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.46 7.81 89 D 8.02 4.67 0.00 2.79 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 90 E 8.21 4.64 0.00 2.06 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 2.25 2.25 0.00 91 L 7.39 4.45 0.00 1.63 1.59 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.46 0.00 1.87 2.08 0.00 3.73 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 2.12 0.00 93 K 7.78 4.25 0.00 1.62 1.64 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.33 7.81 94 V 7.91 3.09 1.91 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 0.92 0.00 0.00 0.55 0.00 0.00 95 M 9.39 3.03 0.00 2.28 1.96 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 96 A 9.05 3.96 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 97 G 8.43 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 8.04 3.92 0.00 1.70 1.76 0.91 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.18 4.31 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 0.00 100 I 7.90 4.91 1.93 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.06 1.02 0.00 0.00 101 A 9.76 5.29 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 8.44 3.97 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 0.89 0.00 0.00 0.89 0.00 0.00 103 V 8.56 4.58 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 0.94 0.00 0.00 1.01 0.00 0.00 104 S 9.42 4.78 0.00 3.88 3.83 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 0.00 105 T 8.36 4.66 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 0.00 106 S 8.79 4.29 0.00 3.87 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 0.00 107 K 9.04 4.29 0.00 1.73 1.84 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.51 7.81 108 G 6.76 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.68 4.55 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 0.80 0.00 0.00 0.91 0.00 0.00 110 M 8.30 4.50 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.48 0.00 111 T 7.96 4.99 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 1.24 0.00 0.00 112 D 8.01 4.23 0.00 2.85 2.91 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 0.00 113 R 8.21 3.85 0.00 1.85 1.98 0.00 3.36 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.65 0.00 114 A 8.20 3.93 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 0.00 115 A 8.05 3.93 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 0.00 116 R 7.83 3.80 0.00 1.92 2.24 0.00 3.26 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 117 Q 8.23 4.11 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.60 0.00 118 A 7.82 4.13 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 0.00 119 G 9.55 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 0.00 0.00 0.00 120 L 7.10 4.36 0.00 1.72 1.61 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.36 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 0.00 0.00 0.00 122 G 7.74 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 0.00 123 E 8.01 4.16 0.00 1.53 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 2.04 1.66 0.00 124 I 8.13 4.06 1.79 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.63 1.01 0.00 0.00 125 I 7.80 4.66 2.02 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 1.20 0.49 0.84 0.00 0.00 126 C 7.44 4.58 0.00 2.94 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 0.00 127 Y 7.66 5.56 0.00 2.75 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 0.00 128 V 7.67 3.73 1.63 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 0.07 0.00 0.00 0.73 0.00 0.00 129 A 8.56 4.26 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00