NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3998 8.3044 118.1913 55.4171 32.5738 173.8394 2 H 4.6544 8.5399 118.9874 53.8705 31.3850 172.3721 3 L 4.8585 7.7072 125.8337 51.9265 46.4683 176.5702 4 T 3.9805 8.4755 113.3902 61.3329 70.4646 173.4754 5 P 4.1815 0.0000 0.0000 66.0277 31.2593 178.8164 6 E 3.9274 8.0516 116.5579 59.3837 29.5057 179.0051 7 E 3.8892 8.2503 118.6220 59.4280 29.5859 179.4721 8 K 3.8827 8.1269 119.5987 59.4897 32.2148 178.9788 9 S 4.1037 8.3184 115.4710 61.5334 62.6552 176.5442 10 A 4.0269 8.2109 123.5960 55.0968 18.1260 179.9277 11 V 3.4701 7.8013 116.7737 66.3681 31.3279 178.4916 12 T 3.9275 8.0771 115.3161 66.4987 68.0718 176.6505 13 A 4.0435 7.8379 121.5328 55.1497 18.8021 179.0664 14 L 3.9096 7.8521 118.6402 58.1152 42.1873 179.0301 15 W 4.3908 8.6186 128.1865 60.0630 30.3968 178.0903 16 G 3.7703 7.8680 105.0018 47.0848 0.0000 174.7737 17 K 4.4693 7.8047 118.0588 55.3928 32.6644 176.6395 18 V 3.6921 6.8265 120.7331 61.7884 31.7263 175.8611 19 N 4.3656 8.3940 125.7871 53.0743 38.7635 174.9711 20 V 3.3332 8.0373 128.2369 65.8687 31.7904 176.8806 21 D 4.2911 8.0997 117.9984 57.8047 40.7057 178.7525 22 E 4.0133 7.9932 118.3047 59.3987 29.5158 179.6954 23 V 3.6331 8.0162 118.7396 65.5949 31.4860 178.4068 24 G 3.4785 7.9215 105.7177 47.6482 0.0000 176.0476 25 G 3.6758 7.7544 107.0622 47.2279 0.0000 175.5105 26 E 3.9034 8.2246 121.4732 59.0618 29.6835 178.8574 27 A 4.0345 8.2363 120.8290 55.2004 18.5361 179.4226 28 L 3.9691 8.3211 119.1308 58.0199 42.2391 179.3831 29 G 3.5612 8.3155 105.8677 48.0026 0.0000 175.9922 30 R 3.9175 8.1483 120.8428 58.4416 29.9105 178.8888 31 L 3.9709 7.8738 120.3735 58.3384 42.0031 179.2112 32 L 3.9457 7.8263 118.6305 57.2613 41.2048 179.5322 33 V 3.6227 7.2091 117.3356 65.4168 31.7543 177.8682 34 V 3.5621 7.8106 117.2629 64.1079 32.7561 175.6277 35 Y 3.8316 7.4656 117.0590 54.4368 37.6757 174.2182 36 P 4.5634 0.0000 0.0000 64.0646 31.7373 178.1892 37 W 4.3369 7.7477 116.5318 58.9206 28.0481 177.5358 38 T 4.2936 7.7106 110.8948 63.8249 68.3522 176.0971 39 Q 4.2775 8.2501 121.7683 58.1508 28.4572 178.0851 40 R 3.8030 7.4542 116.7380 58.6280 29.2116 177.7600 41 F 4.4298 7.2780 116.0800 57.1869 39.6194 175.5692 42 F 4.5719 7.9744 118.4135 56.8354 39.8467 177.0697 43 E 4.0161 8.3658 122.5917 59.2592 29.4985 178.8936 44 S 4.5127 8.0111 110.6782 58.8725 63.5370 174.6690 45 F 4.5974 8.4346 119.8755 58.4793 39.8763 177.1153 46 G 3.9852 7.5003 108.1634 45.5547 0.0000 175.0955 47 D 4.5392 8.6602 126.5369 54.0991 41.0598 175.5114 48 L 4.9111 8.3286 125.8085 54.4216 43.4511 177.9508 49 S 4.2821 8.2020 115.8480 60.5568 63.3229 174.9811 50 T 4.7023 7.4650 109.8044 58.2652 72.7643 172.7024 51 P 4.1742 0.0000 0.0000 66.1962 31.5279 178.5627 52 D 4.3465 8.1200 116.5457 57.3521 40.5376 178.5564 53 A 3.9904 7.8086 120.0265 55.1456 18.7962 179.5885 54 V 3.6831 8.1292 116.9798 66.6214 31.4633 178.3127 55 M 4.2412 8.4334 117.4681 57.5569 31.8609 177.9885 56 G 3.9853 7.6143 102.9427 43.3639 0.0000 173.2517 57 N 4.4651 7.5340 121.5401 52.5910 39.6413 174.0748 58 P 4.2765 0.0000 0.0000 65.8926 31.5268 178.7731 59 K 3.7647 8.2887 118.2304 58.6390 31.6801 179.5601 60 V 3.7325 7.7501 118.4239 65.9420 31.6013 178.0756 61 K 3.9640 7.9592 117.7356 59.3878 31.7656 179.2668 62 A 3.9817 7.9911 121.0816 55.4870 18.3051 179.2392 63 H 4.3876 8.5706 116.9787 59.0166 30.0560 177.3956 64 G 4.0970 8.5413 108.2368 48.0597 0.0000 175.1735 65 K 3.7809 7.9490 122.2694 59.0473 31.9580 178.4446 66 K 3.9398 7.7426 119.9665 59.3585 32.2217 178.8152 67 W 4.3451 8.4180 116.9876 59.6513 28.2090 178.0394 68 L 3.4007 6.7973 120.8545 56.8229 41.2918 179.0746 69 G 3.6859 7.9423 105.9523 47.2224 0.0000 175.6165 70 A 4.1806 7.7340 122.2581 54.5860 18.7472 179.2125 71 F 4.4316 8.5133 119.5259 61.7009 39.2471 177.6060 72 S 4.1168 8.7888 115.3064 61.7486 62.5999 176.4086 73 D 4.6137 8.3944 121.4396 56.8277 40.3836 178.9925 74 G 3.4877 7.7844 106.3261 47.4690 0.0000 175.3383 75 L 3.8640 7.3818 118.9329 55.9417 41.7037 178.0852 76 A 4.3232 7.2137 119.8131 52.4027 19.9305 176.5331 77 H 4.8861 8.1332 115.2723 54.9455 29.7285 175.1793 78 L 4.0974 7.9270 118.8722 56.8746 41.8960 178.3008 79 D 4.6523 7.8499 117.1027 55.1717 42.0887 176.1127 80 N 4.9927 7.9489 117.2796 51.1873 38.9644 174.4705 81 L 4.0916 7.8358 122.7345 57.4638 42.1650 179.0345 82 K 4.0852 8.0570 117.1845 59.5666 32.4598 179.1594 83 G 3.7102 8.0320 106.0361 47.9498 0.0000 175.8872 84 T 3.7713 7.6709 117.2191 65.9525 68.6452 175.8429 85 F 4.6690 8.1259 117.1472 57.0986 39.1530 177.4175 86 A 4.0806 7.5467 121.6869 55.8521 18.2101 180.4272 87 T 3.8442 7.8813 113.4081 66.9110 68.6081 176.8543 88 L 4.1934 8.0135 120.2300 57.4021 41.6978 179.3887 89 S 4.3150 8.3963 113.7504 61.5125 62.3513 175.7223 90 E 3.8831 8.1021 121.2529 59.5423 29.2811 179.2940 91 L 3.9251 7.9914 119.9434 58.6486 42.1923 178.8273 92 H 4.2410 8.5328 116.0893 58.5568 28.6731 177.3991 93 C 3.5603 7.6750 120.6309 62.3846 31.2015 175.3383 94 D 4.4175 8.1316 119.4657 56.0565 40.5660 177.4843 95 K 4.2563 7.7124 116.6880 57.7517 33.4612 177.3763 96 L 4.1723 7.7348 116.0810 54.7592 42.3438 176.2039 97 H 4.1694 7.1313 114.1084 56.6116 26.6526 175.2081 98 V 3.7689 7.8303 118.2158 60.9916 32.3578 174.5542 99 D 4.2716 8.7953 126.9372 54.0365 41.3730 174.9536 100 P 3.0049 0.0000 0.0000 65.1090 31.6951 178.0660 101 E 3.8216 8.2961 118.6876 59.3162 29.2522 178.5547 102 N 4.2731 8.1526 116.7384 56.0333 38.4587 177.3079 103 F 4.3784 7.4049 119.4782 60.5290 38.9152 177.8932 104 R 4.0018 7.8762 117.4000 59.0161 29.9788 178.8273 105 L 3.8367 7.6145 118.5168 57.7198 41.5337 179.3587 106 L 3.9673 8.1124 120.5076 57.8043 42.0635 178.9102 107 G 3.8513 8.1520 105.8013 48.2678 0.0000 175.3552 108 N 4.4764 8.2949 119.3188 55.8681 38.5240 177.8102 109 V 3.6643 8.0631 119.7744 65.7771 31.5328 177.6935 110 L 4.0080 8.3402 120.5608 58.2975 41.9133 179.2071 111 V 3.6318 7.8224 117.6324 66.1828 31.4394 177.7717 112 C 4.1542 8.1006 116.4701 62.8221 27.8746 176.3525 113 V 3.5494 7.8869 119.8623 65.8453 31.1059 178.0310 114 L 3.8575 8.0759 118.9381 57.6008 41.2828 179.3540 115 A 3.7679 7.3146 120.5008 55.3168 18.1196 179.1231 116 H 4.0605 7.9829 115.4905 59.7786 30.0125 176.6872 117 H 4.0249 8.2272 119.1467 58.2945 29.7522 176.2651 118 F 4.6634 8.3017 117.5888 56.1894 40.0939 177.1097 119 G 3.9285 8.8686 108.8075 46.1176 0.0000 177.1675 120 K 4.1147 8.8819 123.6643 58.9299 32.1380 177.4486 121 E 4.0891 7.9058 118.7243 58.4175 29.9849 177.0570 122 F 4.6133 8.2113 123.6329 56.9776 37.8018 175.2989 123 T 4.1756 7.3645 115.7247 60.2532 71.3327 173.4767 124 P 4.1545 0.0000 0.0000 65.6084 31.4634 177.2884 125 P 4.2894 0.0000 0.0000 65.1608 31.2869 178.9288 126 V 3.5898 7.4256 117.5228 65.7508 31.3897 177.6902 127 Q 3.5969 7.7709 119.3874 59.0668 28.9366 178.2456 128 A 4.0038 8.0115 121.3715 55.2149 18.5206 179.4761 129 A 3.9252 7.8874 118.7332 55.6363 18.3820 179.5648 130 Y 3.9373 8.2707 115.1846 61.1469 37.9523 178.6576 131 Q 4.1406 8.8076 119.7300 58.6801 28.7526 178.7797 132 K 3.9765 8.0172 119.3314 59.4098 32.0204 179.5626 133 V 3.5301 7.6424 117.9714 66.1659 31.4285 178.5544 134 V 3.8464 8.3241 112.2379 64.3811 31.2770 178.4894 135 A 4.1315 8.2192 120.8199 55.0327 18.1555 179.9663 136 G 3.4958 8.3177 104.4470 47.7662 0.0000 176.2739 137 V 3.3603 8.1399 120.6130 65.5546 31.6902 177.8615 138 A 3.8715 8.1273 120.6689 55.4307 17.9979 179.3873 139 N 4.3089 8.2032 113.6108 56.3984 38.7554 177.2394 140 A 4.1639 8.1843 122.3561 55.1181 18.2666 179.6375 141 L 3.8602 7.8421 116.3551 56.8337 41.8481 178.4487 142 A 4.3516 7.8004 118.9579 52.7431 18.9108 178.4182 143 H 4.2564 7.9594 117.2641 58.5879 29.9855 175.8133 144 K 4.4595 7.9997 117.4628 56.2806 32.0848 176.2482 145 Y 4.2418 7.9199 117.5865 58.2894 38.4298 175.6137 146 H 4.4895 8.3673 117.8202 56.0658 28.5038 173.1622 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 4.40 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.65 0.00 2 H 8.54 4.65 0.00 3.19 3.20 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.71 4.86 0.00 1.49 1.39 0.80 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.48 3.98 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 1.28 0.00 0.00 5 P 0.00 4.18 0.00 2.08 2.14 0.00 3.84 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 2.10 2.06 0.00 6 E 8.05 3.93 0.00 2.03 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 2.39 2.45 0.00 7 E 8.25 3.89 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 2.30 2.29 0.00 8 K 8.13 3.88 0.00 1.73 1.74 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.39 7.81 9 S 8.32 4.10 0.00 3.89 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 10 A 8.21 4.03 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 11 V 7.80 3.47 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 0.66 0.00 0.00 0.42 0.00 0.00 12 T 8.08 3.93 4.38 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 1.24 0.00 0.00 13 A 7.84 4.04 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 14 L 7.85 3.91 0.00 1.94 1.99 0.55 0.65 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 15 W 8.62 4.39 0.00 3.83 3.18 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 0.00 0.00 0.00 16 G 7.87 3.77 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 0.00 0.00 0.00 17 K 7.80 4.47 0.00 1.87 2.02 0.00 1.66 0.00 0.00 1.44 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.56 7.81 18 V 6.83 3.69 1.06 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 0.09 0.00 0.00 0.63 0.00 0.00 19 N 8.39 4.37 0.00 2.68 2.56 0.00 0.00 6.81 7.71 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 20 V 8.04 3.33 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 0.95 0.00 0.00 0.85 0.00 0.00 21 D 8.10 4.29 0.00 2.85 2.66 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 0.00 0.00 0.00 0.00 22 E 7.99 4.01 0.00 1.83 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 23 V 8.02 3.63 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 0.90 0.00 0.00 0.68 0.00 0.00 24 G 7.92 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.75 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.22 3.90 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 27 A 8.24 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.32 3.97 0.00 1.96 1.90 0.57 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.32 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 30 R 8.15 3.92 0.00 1.93 1.94 0.00 3.10 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 31 L 7.87 3.97 0.00 1.74 1.81 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.83 3.95 0.00 1.83 1.64 0.70 0.82 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 33 V 7.21 3.62 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 0.71 0.00 0.00 0.92 0.00 0.00 34 V 7.81 3.56 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.73 0.00 0.00 35 Y 7.47 3.83 0.00 2.52 1.43 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 36 P 0.00 4.56 0.00 2.29 2.26 0.00 3.69 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.86 0.00 37 W 7.75 4.34 0.00 3.57 3.54 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 0.00 0.00 0.00 0.00 38 T 7.71 4.29 4.40 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 1.14 0.00 0.00 39 Q 8.25 4.28 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 40 R 7.45 3.80 0.00 1.57 1.94 0.00 2.97 0.00 0.00 2.63 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.50 0.00 41 F 7.28 4.43 0.00 2.01 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.97 4.57 0.00 2.79 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 0.00 0.00 0.00 43 E 8.37 4.02 0.00 1.98 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 2.34 2.19 0.00 44 S 8.01 4.51 0.00 4.11 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 45 F 8.43 4.60 0.00 3.18 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.50 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 47 D 8.66 4.54 0.00 2.65 2.63 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 0.00 0.00 0.00 0.00 48 L 8.33 4.91 0.00 1.64 1.60 1.00 1.03 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 49 S 8.20 4.28 0.00 4.02 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 50 T 7.46 4.70 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 51 P 0.00 4.17 0.00 2.15 2.12 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 52 D 8.12 4.35 0.00 2.75 2.71 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 53 A 7.81 3.99 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 54 V 8.13 3.68 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.96 0.00 0.00 55 M 8.43 4.24 0.00 1.96 2.09 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 2.60 2.88 0.00 56 G 7.61 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 57 N 7.53 4.47 0.00 3.00 2.85 0.00 0.00 6.91 6.98 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 58 P 0.00 4.28 0.00 2.24 2.25 0.00 3.71 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.29 3.76 0.00 1.22 0.74 0.00 1.34 0.00 0.00 1.39 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.25 1.25 7.81 60 V 7.75 3.73 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 1.18 0.00 0.00 1.04 0.00 0.00 61 K 7.96 3.96 0.00 1.86 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.66 7.81 62 A 7.99 3.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.57 4.39 0.00 3.64 3.65 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 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 65 K 7.95 3.78 0.00 1.89 1.93 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.59 7.81 66 K 7.74 3.94 0.00 2.11 1.89 0.00 1.90 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.53 7.81 67 W 8.42 4.35 0.00 3.75 3.34 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 68 L 6.80 3.40 0.00 0.46 1.23 0.29 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.94 3.69 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 0.00 0.00 0.00 70 A 7.73 4.18 1.56 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 71 F 8.51 4.43 0.00 3.32 3.12 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 72 S 8.79 4.12 0.00 4.11 4.60 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 73 D 8.39 4.61 0.00 2.67 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 7.78 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.38 3.86 0.00 1.44 1.39 -0.64 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.21 4.32 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 77 H 8.13 4.89 0.00 3.06 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.93 4.10 0.00 1.53 1.63 0.75 0.95 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 79 D 7.85 4.65 0.00 2.63 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 80 N 7.95 4.99 0.00 2.64 2.59 0.00 0.00 7.04 5.97 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 81 L 7.84 4.09 0.00 1.76 1.83 0.90 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.06 4.09 0.00 1.68 1.79 0.00 1.61 0.00 0.00 1.25 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.47 7.81 83 G 8.03 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 84 T 7.67 3.77 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 0.44 0.00 0.00 85 F 8.13 4.67 0.00 3.17 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 86 A 7.55 4.08 1.43 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 87 T 7.88 3.84 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 1.23 0.00 0.00 88 L 8.01 4.19 0.00 1.92 1.91 1.16 0.93 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 89 S 8.40 4.32 0.00 4.09 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 90 E 8.10 3.88 0.00 2.30 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 2.51 0.00 91 L 7.99 3.93 0.00 1.79 1.88 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.53 4.24 0.00 3.71 3.71 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.67 3.56 0.00 1.23 2.34 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 94 D 8.13 4.42 0.00 2.73 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 95 K 7.71 4.26 0.00 1.83 1.79 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.35 7.81 96 L 7.73 4.17 0.00 1.73 1.63 0.71 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.13 4.17 0.00 3.51 3.40 0.00 5.64 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.83 3.77 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 0.03 0.00 0.00 0.57 0.00 0.00 99 D 8.80 4.27 0.00 2.78 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.00 0.00 1.89 1.76 0.00 3.40 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.58 0.00 101 E 8.30 3.82 0.00 2.05 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 2.27 2.37 0.00 102 N 8.15 4.27 0.00 2.35 2.63 0.00 0.00 6.94 8.03 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 0.00 103 F 7.40 4.38 0.00 3.04 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 0.00 104 R 7.88 4.00 0.00 1.90 1.97 0.00 3.11 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 105 L 7.61 3.84 0.00 1.66 1.42 0.73 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 3.97 0.00 1.54 1.48 0.58 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.15 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.29 4.48 0.00 2.94 2.96 0.00 0.00 6.74 7.06 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 0.00 109 V 8.06 3.66 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 1.07 0.00 0.00 1.15 0.00 0.00 110 L 8.34 4.01 0.00 1.97 1.95 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.82 3.63 2.39 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 1.31 0.00 0.00 1.20 0.00 0.00 112 C 8.10 4.15 0.00 3.25 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 0.00 113 V 7.89 3.55 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 1.06 0.00 0.00 0.98 0.00 0.00 114 L 8.08 3.86 0.00 1.02 1.03 0.65 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.31 3.77 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.98 4.06 0.00 3.19 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.23 4.02 0.00 2.79 2.70 0.00 5.97 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.30 4.66 0.00 3.24 3.03 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 0.00 0.00 0.00 119 G 8.87 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 0.00 0.00 0.00 120 K 8.88 4.11 0.00 1.77 1.90 0.00 1.81 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.47 7.81 121 E 7.91 4.09 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 2.33 2.27 0.00 122 F 8.21 4.61 0.00 3.00 3.14 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 0.00 123 T 7.36 4.18 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 1.29 0.00 0.00 124 P 0.00 4.15 0.00 2.16 2.14 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.29 0.00 2.12 2.07 0.00 3.51 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 126 V 7.43 3.59 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 1.04 0.00 0.00 0.91 0.00 0.00 127 Q 7.77 3.60 0.00 1.68 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 128 A 8.01 4.00 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 0.00 129 A 7.89 3.93 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 0.00 130 Y 8.27 3.94 0.00 3.36 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.81 4.14 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 132 K 8.02 3.98 0.00 1.98 1.84 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.67 7.81 133 V 7.64 3.53 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.75 0.00 0.00 134 V 8.32 3.85 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 1.00 0.00 0.00 1.17 0.00 0.00 135 A 8.22 4.13 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.32 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.14 3.36 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 0.77 0.00 0.00 0.75 0.00 0.00 138 A 8.13 3.87 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 0.00 139 N 8.20 4.31 0.00 2.88 2.90 0.00 0.00 7.06 7.93 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 0.00 140 A 8.18 4.16 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.84 3.86 0.00 1.10 0.60 0.06 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.80 4.35 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.96 4.26 0.00 3.29 3.53 0.00 5.74 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.00 4.46 0.00 1.87 1.84 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.60 7.81 145 Y 7.92 4.24 0.00 3.05 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 0.00 146 H 8.37 4.49 0.00 3.21 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00