NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5248 8.3044 120.2868 55.2944 33.9048 174.0991 3 V 4.0683 8.0880 121.9764 59.6929 32.9260 173.1603 4 W 4.5259 9.0585 135.0000 57.2443 31.7519 174.8644 5 T 3.9712 8.0362 122.3168 61.5179 67.1424 172.2679 6 P 4.5974 0.0000 0.0000 62.8969 32.2587 175.3921 7 V 4.0190 7.3643 120.2678 62.7288 32.8598 175.3987 8 N 4.2643 8.6161 125.5051 55.0510 36.0066 173.7825 9 N 4.8950 7.5953 108.3644 52.6953 40.2114 174.1599 10 K 4.0073 8.3395 116.1025 56.7736 32.7023 176.4620 11 M 4.9583 8.4050 120.9225 53.8983 35.4203 175.3947 12 F 4.6038 8.1769 115.8486 57.2514 40.7389 175.8307 13 E 3.5193 8.1196 122.1351 56.9910 28.2167 174.5919 14 T 3.7609 8.3974 119.0069 66.6657 68.7917 173.9252 15 F 4.5045 9.1053 124.2638 57.6342 36.6231 176.4178 16 S 4.5018 8.3733 114.8071 60.2268 63.0638 174.4157 17 Y 4.4126 8.2713 117.5053 57.9769 38.1262 174.9970 18 L 4.7210 7.5145 119.9357 52.1424 43.7995 174.4507 19 P 4.5040 0.0000 0.0000 61.5987 31.8328 174.9734 20 P 4.2495 0.0000 0.0000 62.9536 31.6771 176.5705 21 L 4.1864 8.3245 123.1666 54.6133 42.2194 177.9074 22 S 4.4613 8.8581 118.8438 57.7900 65.3325 175.1158 23 D 4.3313 8.5824 122.0421 57.5511 40.4437 178.8724 24 E 3.9093 8.0529 119.4062 59.4082 29.8872 178.7557 25 Q 3.9625 7.9378 118.0302 58.7472 28.6968 178.7553 26 I 3.7381 8.0851 121.1892 64.2734 37.1220 178.2624 27 A 4.0539 8.3375 121.6523 55.0952 18.1634 179.5452 28 A 3.9706 8.0568 119.3793 55.4711 18.5646 179.9387 29 Q 4.1599 8.0011 116.1696 58.9915 28.7609 179.1260 30 V 3.7812 7.9285 119.5493 66.1063 31.6110 177.8026 31 D 4.4367 8.4683 118.8605 57.5074 40.4988 178.1072 32 Y 4.2874 8.1354 120.0873 60.7230 38.7752 178.2647 33 I 3.8674 7.7656 120.2275 64.5201 37.2439 178.6039 34 V 3.5179 7.8669 118.7119 65.9986 31.1679 177.8243 35 A 3.8882 8.2058 119.6758 54.6880 18.2350 178.3386 36 N 4.1106 7.1218 112.3208 52.0103 38.6324 175.5811 37 G 3.7820 7.4835 108.3517 46.1813 0.0000 174.1718 38 W 4.8573 7.5183 118.7709 55.8920 30.7424 176.5403 39 I 4.3069 8.8600 123.3441 59.6672 37.5427 174.1113 40 P 4.8230 0.0000 0.0000 63.0051 32.8162 175.2474 41 C 4.9294 8.5692 119.7820 58.6880 35.6570 172.5168 42 L 5.3020 8.5947 124.6911 53.3075 44.4177 175.1551 43 E 5.6024 9.2164 120.6563 54.9671 34.2851 174.4957 44 F 5.6553 9.2702 116.8364 55.9295 42.3055 172.9193 45 A 4.4314 8.1464 118.7675 50.5917 22.6061 176.2885 46 E 4.3700 8.4444 118.4128 55.7523 31.1790 177.9586 47 S 4.3931 9.0419 116.3993 62.3228 62.8990 176.9794 48 D 4.6029 8.1912 117.1181 56.3006 40.6381 177.0345 49 K 4.6570 7.9857 117.8920 55.9752 32.9656 177.1604 50 A 3.8300 7.8155 124.8191 54.0307 18.5334 178.5009 51 Y 4.7555 7.3971 111.1191 55.6597 40.6739 176.0735 52 V 4.5041 8.4384 115.1242 61.5975 32.2733 175.5394 53 S 4.7259 8.3481 115.7271 57.7791 66.0897 173.8423 54 N 5.0889 8.5718 114.4861 52.6678 39.4462 176.3197 55 E 3.8990 8.5147 119.2858 60.1686 29.2135 179.6561 56 S 4.0087 8.9050 116.1474 60.2313 62.7977 176.1337 57 A 2.5800 7.7473 123.4958 53.6954 17.7341 179.0921 58 I 3.5739 7.0027 116.5335 63.2731 38.0848 177.0464 59 R 4.3399 7.5410 116.8068 55.5119 30.5171 176.2157 60 F 4.9996 7.2351 118.2059 56.2983 41.1977 176.5746 61 G 4.0825 8.1876 114.9851 46.1339 0.0000 175.5183 62 S 4.6290 8.4287 113.8025 58.6935 62.2403 174.3889 63 V 4.4619 7.2185 106.9678 61.1799 33.0485 177.6779 64 S 4.4598 8.2624 114.8180 59.5143 63.5968 173.3169 65 C 3.8901 8.1050 118.7824 61.5872 27.9278 173.3268 66 L 3.5722 8.4797 123.9459 55.7461 38.9716 173.3847 67 Y 4.4593 7.5373 118.6959 55.7908 40.6960 174.4056 68 Y 4.9111 7.1663 122.9895 56.6219 42.3838 174.5118 69 D 4.5282 9.0428 123.6844 54.9958 41.9393 176.9856 70 N 4.4764 8.8521 116.0268 54.2201 35.9927 176.0039 71 R 4.0024 7.9620 118.8574 59.1840 30.4487 177.0514 72 Y 4.4471 7.7502 114.7724 57.7421 38.4613 174.7663 73 W 5.0855 8.7108 123.8948 55.3011 32.9349 174.4101 74 T 4.3120 8.3071 117.2442 62.6582 69.5451 174.5038 75 M 4.7032 8.5051 126.4552 55.2011 33.1877 175.1811 76 W 4.8074 9.3133 135.0000 56.1755 31.3433 176.9335 77 K 3.4450 8.5479 128.9216 57.4425 30.6215 178.3114 78 L 4.9132 8.2811 124.7582 52.7640 45.3975 173.9135 79 P 4.3303 0.0000 0.0000 63.3432 32.2346 177.6551 80 M 4.3199 8.6977 123.3584 53.7623 30.3937 175.7322 81 F 4.4792 7.3498 118.2862 59.0087 39.9763 176.4456 82 G 3.9844 9.1597 112.9610 45.4621 0.0000 172.8778 83 C 4.2957 7.9091 120.7965 59.5830 31.7776 173.2561 84 R 4.5635 8.6117 123.6438 55.4634 31.7531 174.3295 85 D 4.7948 7.8802 118.3977 51.1616 42.7761 174.3705 86 P 4.3414 0.0000 0.0000 66.2533 31.1065 178.0817 87 M 4.0350 8.3024 118.5454 58.2207 31.7436 178.2968 88 Q 3.9722 7.9998 119.3117 59.2660 29.3295 178.7295 89 V 3.6125 7.6692 118.5710 66.1236 31.8212 177.8111 90 L 4.0477 8.1522 118.7464 57.8716 41.3549 179.8001 91 R 3.9946 8.2527 118.2204 59.2201 30.0029 178.9035 92 E 4.1316 8.1721 118.1523 59.1226 29.3936 179.4139 93 I 3.5276 7.6282 119.9841 64.2015 37.1899 178.5500 94 V 3.4589 7.6018 118.3860 65.8644 31.3869 177.9570 95 A 3.9104 8.0396 120.5498 55.1656 18.1787 179.1694 96 C 2.0000 7.7291 117.6514 62.0968 31.0971 176.0050 97 T 3.6588 7.5762 111.1849 64.3090 67.9613 176.4011 98 K 3.8317 7.4383 121.8373 59.2531 32.3133 178.4138 99 A 3.9925 7.6873 120.0945 53.5428 19.9221 177.6760 100 F 4.6468 7.9200 115.6531 54.7862 39.0935 174.0281 101 P 4.3889 0.0000 0.0000 64.3815 31.6862 177.9381 102 D 4.7318 8.1064 116.5127 53.7635 41.1969 175.2108 103 A 4.8115 7.4469 120.5545 50.3246 21.8581 176.7322 104 Y 4.2221 8.8180 117.5308 57.5566 39.5471 175.2921 105 V 5.3148 8.9308 123.2923 61.1757 35.2349 174.3031 106 R 4.9870 9.4898 123.7136 54.2802 33.1329 173.6623 107 L 4.8843 8.1193 123.1442 53.7487 44.1961 175.6539 108 V 4.9236 8.6726 118.2069 59.7037 36.6763 173.9703 109 A 4.9226 7.9322 121.7257 50.6767 22.7005 175.4083 110 F 5.2773 9.0356 119.9221 55.7390 42.6466 174.2517 111 D 5.4018 8.7690 121.5323 52.6776 42.9175 176.2835 112 N 4.7522 9.2098 122.8631 53.9947 38.3770 176.3046 113 Q 4.1734 8.7987 119.0431 58.9265 29.0106 177.3488 114 K 4.1446 8.3943 113.4955 56.2391 32.9537 176.5696 115 Q 3.4229 7.9505 117.4909 55.4642 26.9338 172.4052 116 V 4.3674 7.8627 117.2147 60.1771 34.8648 173.3837 117 Q 4.4924 8.8255 123.4150 56.4525 29.2989 175.7624 118 I 4.2561 7.6950 117.9273 60.6252 38.5374 174.6852 119 M 4.3663 6.5812 118.8972 54.3579 33.9315 173.8148 120 G 4.8291 8.3227 110.9333 47.5050 0.0000 171.7443 121 F 5.0270 6.9680 115.3575 55.3597 41.1003 172.7841 122 L 4.5325 8.7965 122.4492 55.4698 42.1376 176.7790 123 V 4.5213 8.9900 117.4708 61.2903 33.9331 175.5284 124 Q 4.6083 7.6010 120.9301 54.6872 32.3992 172.9855 125 R 4.1721 8.0200 121.5547 52.9667 32.6690 173.1994 126 P 4.1619 0.0000 0.0000 62.6638 31.6062 177.4295 127 K 4.1435 8.5071 120.0919 59.2969 32.6409 177.9406 128 S 4.3111 7.9640 112.7457 59.4305 63.6326 174.3309 129 A 4.3349 7.9359 125.5350 52.8860 18.3924 177.3609 130 R 4.6688 8.7856 121.4826 56.0429 31.6662 175.4247 131 D 5.0120 8.6626 115.6752 52.5415 39.7277 175.1660 132 W 5.6488 7.5363 114.2351 54.2437 31.4036 173.9290 133 Q 4.3701 8.4684 117.3421 53.0285 31.4134 174.1656 134 P 4.6289 0.0000 0.0000 62.2027 32.5930 177.0119 135 A 3.9713 8.9677 123.2274 55.7412 18.1149 179.2931 136 N 4.7801 8.0928 108.5969 53.7544 37.5072 175.2917 137 K 4.5090 8.1173 117.3026 56.3785 33.3568 177.4906 138 R 3.6015 7.5202 119.8249 57.7562 30.1390 176.6830 139 S 4.8891 7.3667 110.5565 56.2832 66.0946 174.2470 140 V 3.9685 8.6282 115.0310 61.6864 31.9053 175.6140 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 M 8.30 4.52 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.09 4.07 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 0.92 0.00 0.00 0.96 0.00 0.00 4 W 9.06 4.53 0.00 3.44 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 5 T 8.04 3.97 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 1.01 0.00 0.00 6 P 0.00 4.60 0.00 2.24 2.19 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 7 V 7.36 4.02 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 0.76 0.00 0.00 0.91 0.00 0.00 8 N 8.62 4.26 0.00 2.98 2.83 0.00 0.00 6.52 6.92 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 9 N 7.60 4.89 0.00 2.64 2.72 0.00 0.00 7.29 6.68 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 10 K 8.34 4.01 0.00 2.05 1.74 0.00 0.89 0.00 0.00 1.46 0.00 0.00 2.61 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.46 1.39 7.81 11 M 8.40 4.96 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.67 0.00 12 F 8.18 4.60 0.00 3.08 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 8.12 3.52 0.00 2.15 1.82 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 2.22 2.15 0.00 14 T 8.40 3.76 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 0.14 0.00 0.00 15 F 9.11 4.50 0.00 3.27 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 16 S 8.37 4.50 0.00 4.14 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 17 Y 8.27 4.41 0.00 3.04 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 18 L 7.51 4.72 0.00 1.79 1.61 0.83 1.11 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 19 P 0.00 4.50 0.00 2.04 2.00 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 20 P 0.00 4.25 0.00 2.05 2.01 0.00 3.71 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 2.11 2.19 0.00 21 L 8.32 4.19 0.00 1.56 1.46 0.24 0.55 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 22 S 8.86 4.46 0.00 4.03 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 23 D 8.58 4.33 0.00 2.70 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 24 E 8.05 3.91 0.00 2.01 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 0.00 2.35 2.38 0.00 25 Q 7.94 3.96 0.00 2.24 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 26 I 8.09 3.74 2.07 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 1.56 0.94 1.09 0.00 0.00 27 A 8.34 4.05 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 28 A 8.06 3.97 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 29 Q 8.00 4.16 0.00 2.52 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.42 1.93 0.00 30 V 7.93 3.78 2.33 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 1.09 0.00 0.00 1.08 0.00 0.00 31 D 8.47 4.44 0.00 2.97 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 32 Y 8.14 4.29 0.00 3.10 3.29 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 33 I 7.77 3.87 2.18 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.85 1.03 0.00 0.00 34 V 7.87 3.52 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 1.07 0.00 0.00 0.99 0.00 0.00 35 A 8.21 3.89 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 36 N 7.12 4.11 0.00 1.44 1.42 0.00 0.00 7.01 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 37 G 7.48 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 38 W 7.52 4.86 0.00 3.33 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 39 I 8.86 4.31 2.11 0.00 0.00 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 1.47 0.90 0.71 0.00 0.00 40 P 0.00 4.82 0.00 2.08 1.97 0.00 3.80 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 8.57 4.93 0.00 3.03 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 42 L 8.59 5.30 0.00 1.86 1.62 0.86 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.22 5.60 0.00 2.05 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 0.00 2.36 2.30 0.00 44 F 9.27 5.66 0.00 2.95 3.01 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 45 A 8.15 4.43 -0.16 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 46 E 8.44 4.37 0.00 2.19 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 2.29 2.31 0.00 47 S 9.04 4.39 0.00 4.02 4.21 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 0.00 0.00 0.00 0.00 48 D 8.19 4.60 0.00 2.68 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 49 K 7.99 4.66 0.00 1.48 1.84 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.33 1.27 7.81 50 A 7.82 3.83 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.40 4.76 0.00 2.89 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.44 4.50 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 0.49 0.00 0.00 0.78 0.00 0.00 53 S 8.35 4.73 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 54 N 8.57 5.09 0.00 2.77 2.86 0.00 0.00 6.51 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 55 E 8.51 3.90 0.00 2.19 2.27 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 2.54 2.53 0.00 56 S 8.90 4.01 0.00 4.01 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 57 A 7.75 2.58 1.15 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 0.00 0.00 58 I 7.00 3.57 1.78 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 1.47 0.81 0.83 0.00 0.00 59 R 7.54 4.34 0.00 1.86 1.99 0.00 3.19 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 60 F 7.24 5.00 0.00 3.00 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 61 G 8.19 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 62 S 8.43 4.63 0.00 3.86 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 63 V 7.22 4.46 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 0.67 0.00 0.00 0.50 0.00 0.00 64 S 8.26 4.46 0.00 4.11 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 0.00 65 C 8.11 3.89 0.00 2.96 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 66 L 8.48 3.57 0.00 1.76 1.74 0.94 0.99 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 67 Y 7.54 4.46 0.00 2.89 2.97 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 0.00 0.00 0.00 68 Y 7.17 4.91 0.00 2.82 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 9.04 4.53 0.00 2.77 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 70 N 8.85 4.48 0.00 3.05 3.24 0.00 0.00 6.98 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 71 R 7.96 4.00 0.00 1.52 1.72 0.00 3.09 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 72 Y 7.75 4.45 0.00 3.05 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 W 8.71 5.09 0.00 3.07 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 74 T 8.31 4.31 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 0.89 0.00 0.00 75 M 8.51 4.70 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.79 0.00 76 W 9.31 4.81 0.00 3.68 3.29 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 77 K 8.55 3.44 0.00 1.67 0.74 0.00 1.73 0.00 0.00 1.55 0.00 0.00 2.74 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.79 0.21 7.81 78 L 8.28 4.91 0.00 1.59 1.56 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.33 0.00 0.68 1.80 0.00 3.67 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 1.98 2.18 0.00 80 M 8.70 4.32 0.00 2.04 2.00 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 2.61 2.53 0.00 81 F 7.35 4.48 0.00 3.12 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 82 G 9.16 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 83 C 7.91 4.30 0.00 3.06 2.97 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 0.00 0.00 0.00 84 R 8.61 4.56 0.00 1.79 1.86 0.00 3.20 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 85 D 7.88 4.79 0.00 2.71 2.52 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 86 P 0.00 4.34 0.00 2.33 2.33 0.00 3.77 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 2.09 2.17 0.00 87 M 8.30 4.03 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 8.00 3.97 0.00 2.23 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 89 V 7.67 3.61 2.26 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 1.03 0.00 0.00 0.96 0.00 0.00 90 L 8.15 4.05 0.00 1.89 1.71 0.94 0.83 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 91 R 8.25 3.99 0.00 2.06 2.01 0.00 3.15 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 92 E 8.17 4.13 0.00 2.18 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 0.00 2.60 2.66 0.00 93 I 7.63 3.53 2.00 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 1.33 0.74 0.83 0.00 0.00 94 V 7.60 3.46 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 0.97 0.00 0.00 0.92 0.00 0.00 95 A 8.04 3.91 1.50 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 96 C 7.73 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.58 3.66 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 1.07 0.00 0.00 98 K 7.44 3.83 0.00 1.82 1.95 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.38 7.81 99 A 7.69 3.99 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 0.00 100 F 7.92 4.65 0.00 2.78 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.39 0.00 2.12 2.11 0.00 3.27 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.11 4.73 0.00 2.68 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 0.00 103 A 7.45 4.81 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.82 4.22 0.00 2.52 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.93 5.31 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 0.97 0.00 0.00 0.92 0.00 0.00 106 R 9.49 4.99 0.00 1.81 1.87 0.00 2.32 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.35 0.00 107 L 8.12 4.88 0.00 1.51 0.81 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.67 4.92 1.64 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 0.50 0.00 0.00 0.51 0.00 0.00 109 A 7.93 4.92 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 0.00 110 F 9.04 5.28 0.00 3.00 2.89 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 0.00 111 D 8.77 5.40 0.00 2.42 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 0.00 112 N 9.21 4.75 0.00 2.93 3.04 0.00 0.00 6.32 7.39 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 0.00 113 Q 8.80 4.17 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.39 4.14 0.00 1.75 1.86 0.00 1.91 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 115 Q 7.95 3.42 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 V 7.86 4.37 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 0.53 0.00 0.00 0.92 0.00 0.00 117 Q 8.83 4.49 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.87 0.00 0.00 0.00 0.00 0.00 2.20 2.01 0.00 118 I 7.70 4.26 0.93 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.13 0.59 0.00 0.00 119 M 6.58 4.37 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.64 0.00 120 G 8.32 4.83 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 0.00 0.00 0.00 121 F 6.97 5.03 0.00 3.23 3.37 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 0.00 122 L 8.80 4.53 0.00 1.53 1.56 0.60 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.99 4.52 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 0.66 0.00 0.00 0.88 0.00 0.00 124 Q 7.60 4.61 0.00 1.98 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 125 R 8.02 4.17 0.00 1.22 1.38 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.23 0.00 126 P 0.00 4.16 0.00 2.15 2.22 0.00 2.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.72 0.00 127 K 8.51 4.14 0.00 1.91 1.98 0.00 1.57 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.44 7.81 128 S 7.96 4.31 0.00 4.05 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 0.00 129 A 7.94 4.33 1.64 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 0.00 0.00 130 R 8.79 4.67 0.00 1.79 1.85 0.00 3.29 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.53 0.00 131 D 8.66 5.01 0.00 2.90 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 0.00 132 W 7.54 5.65 0.00 3.67 3.22 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 0.00 133 Q 8.47 4.37 0.00 1.99 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.07 0.00 0.00 0.00 0.00 0.00 2.34 2.04 0.00 134 P 0.00 4.63 0.00 2.34 2.14 0.00 3.49 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.81 0.00 135 A 8.97 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 N 8.09 4.78 0.00 2.83 2.94 0.00 0.00 5.79 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 0.00 137 K 8.12 4.51 0.00 1.53 1.65 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.27 1.27 7.81 138 R 7.52 3.60 0.00 1.36 0.66 0.00 3.18 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 139 S 7.37 4.89 0.00 4.06 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 0.00 140 V 8.63 3.97 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 0.60 0.00 0.00 0.94 0.00 0.00