NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4619 8.3049 118.1881 55.1208 32.7604 174.1599 2 I 4.5335 7.9607 118.0826 58.6322 40.6613 172.8871 3 Q 4.5480 8.2877 124.8200 53.3306 32.1974 172.9078 4 P 4.5734 0.0000 0.0000 63.1682 29.4687 175.7021 5 Q 5.6667 7.9462 135.0000 57.7191 30.3333 173.2296 6 T 4.2554 7.0302 114.7735 63.7361 70.4909 173.0522 7 Y 5.1596 8.1792 119.3499 57.7653 39.3094 175.5474 8 L 4.9369 8.4552 119.9936 53.2572 46.3761 175.2196 9 E 4.6816 8.2498 118.4082 54.0455 32.9705 175.6395 10 V 3.6697 8.0641 113.9661 61.4795 31.9964 175.9797 11 A 4.8074 8.3388 125.8182 51.2893 20.0148 174.7974 12 D 5.4607 7.6495 114.7318 54.2004 42.2160 175.0429 13 N 5.1384 8.4409 116.9585 51.7286 41.8185 174.7167 14 T 4.1785 8.7870 118.4823 63.7557 70.9837 174.7216 15 G 4.6102 9.4493 114.4205 45.3070 0.0000 171.5326 16 A 4.7989 7.7412 122.0723 50.4501 21.7764 176.4457 17 R 4.5991 8.1715 118.0606 56.0711 33.3222 175.7601 18 K 4.3028 7.8389 116.8336 55.9167 36.1517 174.3192 19 I 4.7897 7.6783 118.4429 60.7057 40.9268 173.1205 20 M 4.8088 8.3610 116.7666 54.6787 34.9475 174.5761 21 C 4.4308 8.3629 121.3660 60.1410 33.2067 171.8015 22 I 4.5934 8.3809 110.8798 60.5884 37.8261 175.7527 23 R 4.7394 8.5262 118.4792 53.7218 34.4184 175.8727 24 V 4.7249 8.0850 125.5576 61.3394 34.3147 173.7549 25 L 4.7397 8.5993 118.3004 54.6048 42.9464 178.1293 26 K 4.1489 9.3758 126.8846 57.9092 30.7487 176.5548 27 G 4.0435 9.3065 104.2574 44.4708 0.0000 171.6672 28 S 4.6102 7.9200 117.4992 58.0684 59.4080 173.4069 29 N 4.5507 8.2371 116.1458 53.2364 38.1487 174.7298 30 A 3.7710 7.0294 120.5156 50.6272 19.0033 175.5255 31 K 3.8718 9.0526 124.7333 58.7095 31.8095 178.6803 32 Y 4.7326 8.9523 126.0663 56.5371 37.2214 176.7161 33 A 4.4573 8.2207 132.8268 53.9752 20.8891 175.0303 34 T 4.6439 8.0304 114.7255 62.0262 72.9673 174.3402 35 V 3.5746 8.1313 115.4489 63.6041 31.7914 176.7584 36 G 4.0245 9.4531 110.0334 45.6183 0.0000 172.2827 37 D 5.0940 7.7812 117.7655 52.2988 45.8141 174.2979 38 V 4.7930 8.3866 118.6126 61.4546 34.4333 174.5784 39 I 4.8628 7.9932 118.6503 59.5320 41.3382 173.6281 40 V 4.7934 8.0517 118.9283 62.1444 35.3957 175.0574 41 A 4.8149 8.7951 127.0089 51.0225 23.7857 174.6369 42 S 5.0951 8.6186 112.2564 55.2698 65.8751 174.5826 43 V 4.0037 8.4968 123.3992 63.4545 32.3225 175.8556 44 K 4.3341 8.5965 121.1412 57.4560 35.1188 176.5685 45 E 4.7173 8.1620 119.8019 54.5983 33.1263 174.2012 46 A 4.3189 8.1363 125.6873 51.4461 21.8289 175.8694 47 I 3.9325 7.9203 122.3848 60.4606 37.4713 175.4395 48 P 4.2844 0.0000 0.0000 65.5338 31.4621 179.1858 49 R 4.5039 7.8324 115.4383 55.5853 28.6232 177.1779 50 G 4.0006 9.5396 107.2982 49.0131 0.0000 173.4042 51 A 4.0428 9.2320 122.4356 52.3464 21.6717 177.0921 52 V 3.5565 8.1034 107.3579 64.4663 29.1223 173.9642 53 K 4.4796 9.4071 126.1097 55.8604 35.9781 178.2807 54 E 4.0597 7.1865 117.7720 57.9243 26.0372 176.0273 55 G 3.5577 7.9966 114.3677 45.4198 0.0000 173.3368 56 D 4.6143 8.2045 123.9092 54.2005 41.7281 176.0230 57 V 4.9258 8.2522 123.3175 60.9466 32.9920 175.6616 58 V 4.4677 8.0618 114.8507 60.4355 36.4297 173.3230 59 K 5.0582 8.8076 122.2691 54.4896 31.7978 177.8963 60 A 4.9089 8.5553 135.0000 51.1564 20.9608 177.9180 61 V 4.0532 7.9493 110.7613 61.9636 33.8999 172.8383 62 V 3.9422 8.7239 126.3851 63.6877 32.0435 176.2175 63 V 4.1822 8.2420 116.7079 63.1319 37.3762 173.5573 64 R 2.8718 7.3215 122.5300 54.2876 29.3052 175.9564 65 T 4.3618 7.8571 115.0737 59.9818 71.3077 175.6808 66 K 5.2046 8.6947 120.2005 56.7156 32.1328 176.5194 67 K 4.7660 7.5482 118.4924 54.2591 35.8698 175.1404 68 E 5.2218 8.7344 116.2598 55.7417 30.1817 177.4865 69 V 3.6462 8.5909 120.3815 62.8925 31.9841 176.6397 70 K 3.9102 8.1502 121.3649 55.3674 32.5999 173.7029 71 R 4.3637 7.5607 118.9016 55.1515 32.3267 173.1591 72 P 4.4965 0.0000 0.0000 63.6916 31.0419 176.8796 73 D 4.4079 8.1886 116.3184 52.5025 39.6958 176.0712 74 G 3.8048 9.1850 109.3400 46.6684 0.0000 172.8751 75 S 4.3147 8.5775 110.2806 58.9126 59.3215 170.0945 76 A 4.3482 7.6544 124.0273 54.1071 19.7796 176.5302 77 I 3.7800 7.8031 111.1666 60.9297 40.5985 173.9009 78 R 5.0524 8.5134 128.4409 54.1896 30.1270 175.6065 79 F 4.3283 8.9362 125.0563 57.2763 39.6682 176.4739 80 D 4.7537 8.7940 122.0265 54.4754 40.1957 175.3663 81 D 4.5703 7.5839 118.0934 53.8575 41.8348 174.4125 82 N 5.8991 8.4104 113.3989 52.4814 43.1362 173.7862 83 A 4.8857 7.9924 122.8538 50.1223 22.9808 174.8170 84 A 5.0724 7.6554 115.5554 51.1792 22.2355 175.6630 85 V 4.4251 7.9133 126.1811 62.0862 32.9142 178.3226 86 I 4.4636 8.1538 118.6350 60.4888 41.0616 172.0909 87 I 4.1394 9.3779 130.9966 59.5386 37.6438 175.7629 88 N 4.2933 9.1096 127.0002 54.7800 40.1471 176.4950 89 N 3.6101 9.7311 121.3651 53.4278 40.0277 178.5425 90 Q 2.5406 7.5281 125.2496 55.1207 32.1152 174.8936 91 L 5.4182 7.7178 121.9432 56.0680 42.5423 175.3512 92 E 4.4701 7.9871 122.2182 53.3390 28.3148 172.7627 93 P 4.2216 0.0000 0.0000 62.9375 31.8170 178.1544 94 R 4.0533 8.2713 118.2189 57.3337 29.6026 176.8271 95 G 3.8044 8.0303 106.9687 45.6881 0.0000 173.5277 96 T 4.4143 8.3097 115.1453 60.7151 69.6173 174.8437 97 R 4.5205 7.5426 121.5977 54.2759 33.1323 175.5018 98 V 4.0734 8.0990 122.2187 62.0269 32.3593 175.6038 99 F 4.6436 8.1739 117.7777 56.7211 42.2276 174.1805 100 G 4.0145 9.0443 110.1415 46.2238 0.0000 170.7295 101 P 4.8803 0.0000 0.0000 60.8400 33.1015 175.1645 102 V 4.0930 8.2845 112.4796 62.1713 35.0660 169.6807 103 A 3.6538 8.5314 128.0094 52.7831 15.4116 178.4600 104 R 4.8192 8.0580 120.3134 57.0965 30.5967 178.8108 105 E 4.5459 8.0948 119.5648 58.4858 30.8239 177.5580 106 L 4.1771 7.5837 118.8310 57.4603 41.0878 178.8586 107 R 3.8066 8.1730 118.3679 60.0720 29.6947 177.9750 108 E 4.2056 8.0391 115.6644 58.1893 29.8989 178.3853 109 K 4.1936 7.6859 117.1829 56.6937 33.5788 176.9047 110 G 3.7443 9.0171 106.4793 45.5413 0.0000 174.6720 111 F 5.2123 8.1203 120.6530 55.0776 40.8370 175.5021 112 M 3.8284 8.1564 118.3935 59.0852 31.5679 179.4351 113 K 4.4569 7.8007 118.2319 59.9787 33.3184 177.6278 114 I 3.7186 8.2811 113.2335 63.7579 37.0018 178.3354 115 V 3.1092 8.0053 118.8363 65.7205 32.2160 177.8037 116 S 4.2397 7.8991 114.1447 61.3572 62.7867 175.7077 117 L 3.9279 7.3618 119.0211 57.7211 41.4423 177.2608 118 A 3.9998 7.6827 123.6768 51.4110 17.4979 175.1378 119 P 4.1767 0.0000 0.0000 64.9910 31.7206 177.0380 120 E 4.2283 10.5678 120.3041 56.9184 29.7008 173.4825 121 V 4.5251 7.2047 114.4287 60.7583 35.9562 174.3061 122 L 4.2038 8.3783 119.8378 55.9170 42.5300 174.5987 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 M 8.30 4.46 0.00 1.84 2.03 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 2 I 7.96 4.53 2.07 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 1.31 1.13 0.94 0.00 0.00 3 Q 8.29 4.55 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.11 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 4 P 0.00 4.57 0.00 2.37 2.07 0.00 3.86 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.89 0.00 5 Q 7.95 5.67 0.00 2.12 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.04 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 6 T 7.03 4.26 4.23 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 0.00 0.00 0.00 1.11 0.00 0.00 7 Y 8.18 5.16 0.00 2.78 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 8 L 8.46 4.94 0.00 1.50 1.46 0.92 0.85 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 9 E 8.25 4.68 0.00 1.94 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 2.08 2.33 0.00 10 V 8.06 3.67 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.68 0.00 0.00 11 A 8.34 4.81 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 12 D 7.65 5.46 0.00 2.69 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 13 N 8.44 5.14 0.00 2.56 2.79 0.00 0.00 7.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.79 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 15 G 9.45 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.74 4.80 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 17 R 8.17 4.60 0.00 1.66 1.97 0.00 3.46 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 18 K 7.84 4.30 0.00 1.71 1.53 0.00 1.53 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.17 1.25 7.81 19 I 7.68 4.79 2.03 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 1.26 0.59 0.91 0.00 0.00 20 M 8.36 4.81 0.00 2.06 2.22 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 2.48 2.45 0.00 21 C 8.36 4.43 0.00 3.03 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 22 I 8.38 4.59 1.87 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 1.24 0.82 0.91 0.00 0.00 23 R 8.53 4.74 0.00 1.86 1.75 0.00 3.15 0.00 0.00 3.38 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 24 V 8.08 4.72 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 0.79 0.00 0.00 0.95 0.00 0.00 25 L 8.60 4.74 0.00 1.61 1.27 0.94 0.85 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 26 K 9.38 4.15 0.00 1.91 1.11 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.43 7.81 27 G 9.31 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 28 S 7.92 4.61 0.00 4.07 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 0.00 29 N 8.24 4.55 0.00 2.84 2.96 0.00 0.00 6.02 7.26 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 30 A 7.03 3.77 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 31 K 9.05 3.87 0.00 1.92 1.74 0.00 1.88 0.00 0.00 1.92 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.51 7.81 32 Y 8.95 4.73 0.00 2.90 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 33 A 8.22 4.46 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 34 T 8.03 4.64 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 35 V 8.13 3.57 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 0.63 0.00 0.00 0.94 0.00 0.00 36 G 9.45 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 0.00 0.00 0.00 37 D 7.78 5.09 0.00 2.72 2.55 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 38 V 8.39 4.79 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 0.92 0.00 0.00 0.98 0.00 0.00 39 I 7.99 4.86 1.98 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 1.23 1.06 0.92 0.00 0.00 40 V 8.05 4.79 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 0.95 0.00 0.00 0.93 0.00 0.00 41 A 8.80 4.81 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 42 S 8.62 5.10 0.00 3.87 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 43 V 8.50 4.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.01 0.00 0.00 44 K 8.60 4.33 0.00 1.72 1.70 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.72 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.26 1.34 7.81 45 E 8.16 4.72 0.00 2.02 1.68 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 2.18 2.28 0.00 46 A 8.14 4.32 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 47 I 7.92 3.93 1.88 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 1.42 0.97 0.91 0.00 0.00 48 P 0.00 4.28 0.00 2.17 2.10 0.00 3.60 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 49 R 7.83 4.50 0.00 1.91 2.02 0.00 3.15 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 50 G 9.54 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 9.23 4.04 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 52 V 8.10 3.56 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 0.82 0.00 0.00 0.93 0.00 0.00 53 K 9.41 4.48 0.00 1.88 1.82 0.00 1.36 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.39 7.81 54 E 7.19 4.06 0.00 2.04 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 0.00 2.34 2.28 0.00 55 G 8.00 3.56 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 0.00 0.00 0.00 56 D 8.20 4.61 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.25 4.93 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 0.85 0.00 0.00 0.93 0.00 0.00 58 V 8.06 4.47 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 0.77 0.00 0.00 0.93 0.00 0.00 59 K 8.81 5.06 0.00 1.80 1.98 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.30 7.81 60 A 8.56 4.91 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.95 4.05 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 0.62 0.00 0.00 0.75 0.00 0.00 62 V 8.72 3.94 2.17 0.00 0.00 0.00 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 0.95 0.00 0.00 63 V 8.24 4.18 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 0.59 0.00 0.00 0.94 0.00 0.00 64 R 7.32 2.87 0.00 1.06 1.42 0.00 3.07 0.00 0.00 3.32 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 65 T 7.86 4.36 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 1.25 0.00 0.00 66 K 8.69 5.20 0.00 1.78 1.90 0.00 1.64 0.00 0.00 1.85 0.00 0.00 3.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.71 1.48 7.81 67 K 7.55 4.77 0.00 1.93 1.90 0.00 1.41 0.00 0.00 1.90 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.62 1.47 7.81 68 E 8.73 5.22 0.00 2.18 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 2.28 2.21 0.00 69 V 8.59 3.65 2.24 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 0.76 0.00 0.00 1.01 0.00 0.00 70 K 8.15 3.91 0.00 1.90 1.87 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.47 7.81 71 R 7.56 4.36 0.00 1.83 1.86 0.00 3.43 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 1.48 1.48 0.00 72 P 0.00 4.50 0.00 2.22 2.14 0.00 3.86 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 1.99 1.96 0.00 73 D 8.19 4.41 0.00 2.79 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 74 G 9.19 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 75 S 8.58 4.31 0.00 3.96 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 76 A 7.65 4.35 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 77 I 7.80 3.78 1.80 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.97 1.09 0.00 0.00 78 R 8.51 5.05 0.00 1.82 1.83 0.00 3.11 0.00 0.00 4.01 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 79 F 8.94 4.33 0.00 3.53 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 80 D 8.79 4.75 0.00 2.68 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 81 D 7.58 4.57 0.00 2.61 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.41 5.90 0.00 2.68 2.64 0.00 0.00 7.25 7.54 0.00 0.00 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 A 7.99 4.89 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 84 A 7.66 5.07 1.14 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 85 V 7.91 4.43 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 0.96 0.00 0.00 0.95 0.00 0.00 86 I 8.15 4.46 1.87 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 1.34 0.71 0.91 0.00 0.00 87 I 9.38 4.14 1.96 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 0.97 0.00 0.00 88 N 9.11 4.29 0.00 2.77 3.03 0.00 0.00 7.43 7.79 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 89 N 9.73 3.61 0.00 2.83 2.56 0.00 0.00 7.19 7.69 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 90 Q 7.53 2.54 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.49 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 91 L 7.72 5.42 0.00 2.35 1.95 0.98 0.72 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 92 E 7.99 4.47 0.00 1.96 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 2.22 2.28 0.00 93 P 0.00 4.22 0.00 2.24 2.09 0.00 3.76 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 2.05 1.88 0.00 94 R 8.27 4.05 0.00 1.84 1.97 0.00 3.25 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 95 G 8.03 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 96 T 8.31 4.41 4.23 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 0.00 0.00 0.00 1.21 0.00 0.00 97 R 7.54 4.52 0.00 1.95 1.70 0.00 3.25 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 98 V 8.10 4.07 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 0.57 0.00 0.00 0.89 0.00 0.00 99 F 8.17 4.64 0.00 3.05 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 0.00 100 G 9.04 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 0.00 101 P 0.00 4.88 0.00 2.20 2.23 0.00 3.88 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 1.95 2.05 0.00 102 V 8.28 4.09 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 1.05 0.00 0.00 0.86 0.00 0.00 103 A 8.53 3.65 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 0.00 104 R 8.06 4.82 0.00 1.96 2.07 0.00 3.32 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 105 E 8.09 4.55 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 106 L 7.58 4.18 0.00 1.95 1.93 0.97 0.65 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 0.00 107 R 8.17 3.81 0.00 1.91 1.98 0.00 3.20 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 108 E 8.04 4.21 0.00 1.99 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 2.33 2.35 0.00 109 K 7.69 4.19 0.00 2.02 1.82 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.62 1.61 7.81 110 G 9.02 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 0.00 0.00 0.00 111 F 8.12 5.21 0.00 3.14 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 M 8.16 3.83 0.00 2.13 2.01 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 2.73 2.75 0.00 113 K 7.80 4.46 0.00 1.87 1.78 0.00 1.72 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.60 7.81 114 I 8.28 3.72 1.73 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.43 0.76 0.00 0.00 115 V 8.01 3.11 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 0.87 0.00 0.00 1.14 0.00 0.00 116 S 7.90 4.24 0.00 3.97 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 0.00 117 L 7.36 3.93 0.00 2.01 1.74 0.92 0.80 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 0.00 118 A 7.68 4.00 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 0.00 119 P 0.00 4.18 0.00 2.20 2.09 0.00 3.77 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 120 E 10.57 4.23 0.00 2.08 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 0.00 2.17 2.31 0.00 121 V 7.20 4.53 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 0.73 0.00 0.00 0.96 0.00 0.00 122 L 8.38 4.20 0.00 1.73 1.54 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00