NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3986 0.0000 0.0000 62.4100 32.6383 175.6034 2 I 3.9367 8.2008 121.3111 60.3413 37.7419 170.6284 3 V 4.5515 8.2387 118.3712 59.7571 35.1587 175.2760 4 D 4.9552 8.4889 119.5583 52.8692 39.9740 175.1925 5 T 4.6609 7.5743 107.7020 61.8647 72.6827 175.7110 6 G 3.9753 9.4763 110.5767 46.0823 0.0000 174.7702 7 S 4.6148 8.2590 117.1241 56.8603 65.1567 173.2339 8 V 4.4637 7.8754 116.7720 58.9031 34.8664 175.7692 9 A 4.1486 8.3245 124.8789 51.4236 18.8723 175.9397 10 P 4.4251 0.0000 0.0000 62.3172 32.0702 176.3239 11 L 4.4155 8.1194 120.5167 54.3254 42.5636 178.0212 12 S 4.4589 9.1058 118.8099 57.5825 65.6118 175.1109 13 A 3.9718 8.6458 124.6351 55.5820 17.9704 180.0880 14 A 3.9574 7.9209 118.4699 55.4353 18.5351 179.5466 15 E 3.9640 7.9446 117.1888 59.4252 29.4161 179.7556 16 K 3.9655 8.0972 118.5435 59.7735 32.1455 179.4798 17 T 3.8697 7.8030 115.5448 66.4928 68.4007 176.5251 18 K 3.9630 8.0770 121.4870 59.5500 32.1403 178.8595 19 I 3.9026 8.0313 120.0119 64.5944 37.1355 178.4366 20 R 4.0831 8.2758 119.0468 59.5821 29.7076 179.2914 21 S 4.1657 7.9976 113.1881 61.7410 62.9701 176.4513 22 A 4.1437 7.9890 122.0386 54.5924 18.2816 179.3229 23 W 4.2931 8.9423 127.3011 60.7220 30.9012 177.8965 24 A 4.0122 8.1603 120.8025 55.0645 17.5730 177.6870 25 P 4.1426 0.0000 0.0000 65.7147 31.3996 178.7391 26 V 3.5378 7.4356 116.3417 66.1585 31.4795 177.3495 27 Y 3.9167 7.4709 119.2592 60.4215 38.2795 177.6236 28 S 4.0832 7.7920 115.9165 60.5989 63.8247 175.0120 29 T 4.4761 7.3652 109.9763 59.9705 68.9821 175.1450 30 Y 4.1333 7.7523 123.1372 61.5161 37.4776 177.6844 31 E 4.2405 7.1681 118.3125 58.8113 29.6637 179.0522 32 T 3.8396 7.5190 116.3399 66.1986 68.9672 176.7692 33 S 4.2136 8.0381 117.0865 61.7018 62.8639 176.9891 34 G 3.7983 8.5412 108.4679 48.0133 0.0000 175.7823 35 V 3.6214 7.3835 120.4687 65.7183 31.4882 177.7685 36 D 4.3776 8.2086 118.6026 57.4456 40.6808 178.8994 37 I 3.7682 8.0771 120.4347 64.3906 37.1568 178.3249 38 L 4.1256 8.2088 121.2638 58.0933 41.8568 179.0995 39 V 3.5874 8.1914 118.6166 65.8470 31.4939 177.7431 40 K 3.9121 8.3210 119.5282 59.5302 31.7990 178.3478 41 F 4.1651 8.1308 119.3486 61.2993 39.4148 176.2780 42 F 3.8048 8.7528 120.8610 61.6249 38.9289 177.2755 43 T 3.8428 8.1405 108.3133 64.3700 68.6823 175.6380 44 S 4.5740 7.6575 114.0162 58.0766 64.9941 174.9421 45 T 4.4565 7.0182 119.1697 59.9689 69.2925 172.1330 46 P 4.4359 0.0000 0.0000 64.7774 31.4980 177.5422 47 A 3.9762 7.8920 117.6134 55.1810 18.4865 178.9682 48 A 3.9069 7.6224 118.4921 54.4028 18.5783 179.4520 49 Q 3.9782 7.4621 116.8898 59.1263 28.4722 179.0070 50 E 4.0176 7.9570 115.9983 58.5147 29.7443 177.3737 51 F 4.5054 8.1906 117.2403 57.9497 39.5235 176.1101 52 F 4.6025 7.9992 120.5001 54.2403 38.8552 173.6411 53 P 4.2724 0.0000 0.0000 65.6751 31.6719 178.7917 54 K 4.3584 8.0465 114.3635 58.1161 32.2941 177.3269 55 F 4.7883 8.5315 117.9092 56.9875 39.5144 175.7839 56 K 4.1851 7.7996 121.1046 58.1046 32.2815 175.3834 57 G 4.2796 9.2635 114.4865 46.2943 0.0000 174.3980 58 L 4.4700 8.0230 119.6402 53.9670 42.1565 176.7418 59 T 4.5294 8.8677 111.6774 62.2003 71.2181 174.9120 60 T 4.4810 8.1253 111.7965 59.8582 71.8341 175.3107 61 A 3.9874 8.5204 124.0014 55.7339 17.8593 179.9497 62 D 4.2702 7.9947 116.6065 57.4895 40.5143 178.6538 63 E 3.9355 7.8025 118.2994 59.3072 29.4598 179.3414 64 L 3.7079 7.7807 118.7818 57.8549 41.5472 179.9085 65 K 3.9256 8.1164 116.8387 58.7354 32.0108 178.6251 66 K 4.3183 7.3762 116.2020 55.7303 32.7416 176.5212 67 S 4.2663 7.5709 115.9602 57.2133 62.9179 174.6641 68 A 4.0588 8.6523 129.9361 55.2231 18.1108 179.1064 69 D 4.4612 8.0477 117.2079 57.5841 41.0109 178.9229 70 V 3.4052 7.2738 117.4134 65.9540 31.3946 178.2731 71 R 3.9800 8.1327 117.8578 59.0276 29.9176 178.8717 72 W 4.7017 8.6373 128.3639 60.8860 30.7423 177.5130 73 H 3.9919 8.5099 118.0087 59.2187 29.3764 177.0765 74 A 4.0901 8.3171 122.6219 55.3610 18.2068 179.5141 75 E 4.1873 8.6119 117.2396 59.5364 29.2899 179.8981 76 R 3.7158 7.5100 117.5249 59.0068 30.3733 178.8090 77 I 3.8585 7.7439 119.5723 64.5399 37.2137 178.2020 78 I 3.9187 7.9595 119.3450 64.5135 37.8050 177.5566 79 N 4.5204 8.2355 116.3685 55.7685 38.2171 177.3422 80 A 3.9794 7.8932 122.7584 54.9563 18.4521 179.8492 81 V 3.3382 7.6922 116.4254 65.9702 31.6081 177.5276 82 D 4.0180 8.1033 117.8405 57.4135 40.7732 177.9926 83 D 4.2126 7.8618 118.1213 57.1497 41.1564 178.3790 84 A 3.9668 7.4767 121.1002 55.0062 18.2747 179.7671 85 V 3.2446 7.3930 116.4804 66.0974 31.3335 178.1453 86 A 4.0902 7.9199 118.7708 54.1142 18.3034 178.6773 87 S 4.5840 7.4138 112.4037 58.5893 63.0064 175.7387 88 M 3.9144 7.5492 123.8667 58.5167 31.7976 177.4968 89 D 4.5287 7.9435 116.2169 55.4464 41.8722 176.0633 90 D 4.8282 7.8891 119.7657 51.5627 40.8760 175.6787 91 T 3.8307 7.9114 117.5042 64.4967 67.5953 174.5936 92 E 3.8497 8.1103 120.9776 59.0727 29.8886 178.4975 93 K 3.8866 7.9375 119.8560 59.6110 32.2615 178.2748 94 M 3.9330 7.9298 118.4931 58.7457 32.0532 178.3895 95 S 4.0034 7.9832 115.0486 61.8415 63.0928 176.2991 96 M 3.9573 7.8207 121.2525 58.4814 31.8991 178.8124 97 K 3.8810 7.8520 119.1430 59.6510 32.3165 178.8688 98 L 4.0115 7.8654 119.1050 57.5429 41.4677 179.6913 99 R 3.8597 8.3873 118.8278 59.0239 29.9563 178.4749 100 N 4.2217 8.0558 116.8660 56.6467 38.9673 176.7045 101 L 3.9883 7.7056 121.3399 58.0036 42.0733 178.7650 102 S 4.1488 8.3290 113.6581 61.3440 62.3237 176.2340 103 G 3.5673 7.9320 108.3002 47.8522 0.0000 175.6514 104 K 3.5736 7.6861 120.4898 59.3706 32.0390 179.2057 105 H 4.3086 8.2128 116.1857 58.7074 28.4054 177.8525 106 A 3.5120 7.7491 121.8201 54.7505 18.2930 179.3730 107 K 4.0243 7.9894 115.7958 58.4676 32.5147 178.3118 108 S 4.4500 7.4753 113.3081 60.3623 63.7667 175.7946 109 F 4.5986 7.4525 116.8047 58.3894 39.3414 175.4742 110 Q 3.5577 7.7670 118.0739 56.9208 26.4057 173.9672 111 V 3.8439 7.6096 109.1381 59.5646 33.4380 176.1944 112 D 4.1832 6.6406 123.0871 53.3233 41.3581 175.4451 113 P 3.3341 0.0000 0.0000 64.9021 30.8883 178.1624 114 E 3.7174 7.4057 116.6590 59.1381 29.7262 177.9763 115 Y 4.4391 6.9664 116.2770 59.1366 38.0166 177.4434 116 F 4.3909 7.3139 120.1717 60.6351 39.1535 177.6616 117 K 4.0581 8.1335 117.5040 59.5996 32.2196 179.2647 118 V 3.6921 7.7001 119.5045 65.9578 31.6994 177.5947 119 L 3.7617 7.8805 119.8583 57.9171 41.7446 178.5892 120 A 4.0276 8.2790 120.6869 55.1156 18.1813 179.3954 121 A 4.0003 8.0685 119.2170 55.4163 18.4810 180.0361 122 V 3.6408 7.7162 116.8320 66.1731 31.5902 178.3148 123 I 3.8282 8.0731 119.3263 64.3712 36.9602 178.2353 124 A 4.3607 8.5262 121.8832 55.4356 18.0734 179.0108 125 D 4.3193 8.3104 115.5943 57.9090 41.2820 178.5548 126 T 4.0613 7.7469 115.1643 66.5000 68.6273 176.9246 127 V 3.7189 7.7045 118.5256 64.5926 33.1852 177.0229 128 A 4.4871 7.7195 119.7804 50.6591 20.9340 174.0738 129 A 4.1821 7.9798 123.3256 53.3761 19.2115 177.9198 130 G 4.0207 8.9886 111.2224 45.6190 0.0000 173.7428 131 D 4.3951 7.9982 119.3464 54.1647 41.9262 176.7089 132 A 4.1952 8.8119 129.8028 54.9180 18.5087 179.4103 133 G 3.5282 8.0608 104.0585 48.1172 0.0000 175.6280 134 F 4.0543 8.5988 123.7692 60.8399 39.4008 177.0334 135 E 3.9794 8.2759 117.9313 59.0736 29.1655 179.2696 136 K 3.8952 7.9536 119.8853 59.2690 32.3079 178.6466 137 L 3.7498 7.6235 120.5174 58.4436 41.9073 178.8628 138 M 3.8639 7.8290 118.6666 58.4146 31.7374 179.0010 139 S 4.2740 7.9715 116.6515 61.1683 62.9557 176.5369 140 M 3.9570 8.0580 121.4457 58.3961 31.6237 178.8427 141 I 3.5280 7.6046 119.7131 64.6589 37.0702 178.3439 142 C 3.9677 7.8866 116.1794 62.7309 28.0610 175.9462 143 I 3.8172 7.9019 121.5867 64.4324 36.7857 178.5497 144 L 3.9700 7.8319 119.8086 57.6046 41.2250 179.3798 145 L 3.8855 7.8468 117.8442 56.5692 41.7218 178.5187 146 R 4.6811 7.4625 117.2567 56.2962 30.4111 178.0753 147 S 4.1810 7.7396 114.1827 61.1450 62.8627 174.9751 148 A 4.2762 8.0293 122.5123 52.5723 18.9290 176.7123 149 Y 4.1800 8.0843 119.1740 58.0822 37.9890 175.3844 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 P 0.00 4.40 0.00 2.20 2.14 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 2 I 8.20 3.94 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.70 0.91 0.00 0.00 3 V 8.24 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 0.94 0.00 0.00 0.91 0.00 0.00 4 D 8.49 4.96 0.00 2.72 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 5 T 7.57 4.66 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 1.19 0.00 0.00 6 G 9.48 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 7 S 8.26 4.61 0.00 3.77 3.66 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 8 V 7.88 4.46 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 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.32 4.15 1.22 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 10 P 0.00 4.43 0.00 2.03 1.98 0.00 3.66 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 2.01 2.08 0.00 11 L 8.12 4.42 0.00 1.60 1.57 0.84 0.83 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 12 S 9.11 4.46 0.00 4.03 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 13 A 8.65 3.97 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 14 A 7.92 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 7.94 3.96 0.00 2.14 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 2.35 2.36 0.00 16 K 8.10 3.97 0.00 1.97 1.85 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.66 7.81 17 T 7.80 3.87 4.39 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 1.24 0.00 0.00 18 K 8.08 3.96 0.00 2.02 1.95 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.67 7.81 19 I 8.03 3.90 2.10 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 1.85 0.83 1.08 0.00 0.00 20 R 8.28 4.08 0.00 2.04 2.07 0.00 3.17 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.98 0.00 21 S 8.00 4.17 0.00 4.05 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 22 A 7.99 4.14 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 W 8.94 4.29 0.00 3.59 3.36 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 24 A 8.16 4.01 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 25 P 0.00 4.14 0.00 1.97 2.09 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.14 0.00 26 V 7.44 3.54 1.65 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 0.73 0.00 0.00 0.80 0.00 0.00 27 Y 7.47 3.92 0.00 2.14 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 28 S 7.79 4.08 0.00 3.97 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 29 T 7.37 4.48 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 1.10 0.00 0.00 30 Y 7.75 4.13 0.00 3.23 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 31 E 7.17 4.24 0.00 2.08 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 2.05 2.12 0.00 32 T 7.52 3.84 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 1.17 0.00 0.00 33 S 8.04 4.21 0.00 3.85 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 34 G 8.54 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 35 V 7.38 3.62 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 1.08 0.00 0.00 1.05 0.00 0.00 36 D 8.21 4.38 0.00 2.92 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 37 I 8.08 3.77 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.93 1.02 0.00 0.00 38 L 8.21 4.13 0.00 1.84 1.72 1.10 0.91 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 39 V 8.19 3.59 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 1.04 0.00 0.00 0.92 0.00 0.00 40 K 8.32 3.91 0.00 2.07 2.05 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.50 7.81 41 F 8.13 4.17 0.00 3.14 3.43 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 42 F 8.75 3.80 0.00 3.11 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 43 T 8.14 3.84 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 1.35 0.00 0.00 44 S 7.66 4.57 0.00 4.04 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 45 T 7.02 4.46 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 1.12 0.00 0.00 46 P 0.00 4.44 0.00 2.05 1.99 0.00 3.77 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.87 0.00 47 A 7.89 3.98 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 48 A 7.62 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 7.46 3.98 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 1.16 1.89 0.00 50 E 7.96 4.02 0.00 1.80 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 1.99 1.47 0.00 51 F 8.19 4.51 0.00 3.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.00 4.60 0.00 2.99 1.73 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.19 2.15 0.00 3.54 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 2.13 2.14 0.00 54 K 8.05 4.36 0.00 1.97 2.06 0.00 1.83 0.00 0.00 1.82 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.51 7.81 55 F 8.53 4.79 0.00 3.16 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 56 K 7.80 4.19 0.00 1.85 1.85 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.26 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.62 7.81 57 G 9.26 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 0.00 0.00 0.00 58 L 8.02 4.47 0.00 1.68 1.52 0.86 0.77 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 59 T 8.87 4.53 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 1.26 0.00 0.00 60 T 8.13 4.48 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 1.21 0.00 0.00 61 A 8.52 3.99 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 62 D 7.99 4.27 0.00 2.76 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 63 E 7.80 3.94 0.00 2.12 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 0.00 2.31 2.33 0.00 64 L 7.78 3.71 0.00 1.74 1.43 0.89 0.11 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 65 K 8.12 3.93 0.00 1.64 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.64 7.81 66 K 7.38 4.32 0.00 1.81 1.81 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.52 7.81 67 S 7.57 4.27 0.00 3.71 3.64 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 68 A 8.65 4.06 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.05 4.46 0.00 2.77 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 70 V 7.27 3.41 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 0.69 0.00 0.00 -0.20 0.00 0.00 71 R 8.13 3.98 0.00 2.09 2.07 0.00 3.20 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 72 W 8.64 4.70 0.00 3.45 3.28 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 73 H 8.51 3.99 0.00 3.59 3.62 0.00 5.66 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 74 A 8.32 4.09 1.49 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 75 E 8.61 4.19 0.00 2.44 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 0.00 2.66 2.62 0.00 76 R 7.51 3.72 0.00 1.60 1.74 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.52 0.00 77 I 7.74 3.86 2.06 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 1.49 1.00 0.97 0.00 0.00 78 I 7.96 3.92 2.15 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.63 1.18 0.00 0.00 79 N 8.24 4.52 0.00 2.87 2.82 0.00 0.00 6.89 8.26 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 80 A 7.89 3.98 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 81 V 7.69 3.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.98 0.00 0.00 82 D 8.10 4.02 0.00 2.89 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 83 D 7.86 4.21 0.00 2.80 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 84 A 7.48 3.97 1.11 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 0.00 0.00 0.00 85 V 7.39 3.24 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 0.83 0.00 0.00 -0.02 0.00 0.00 86 A 7.92 4.09 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 87 S 7.41 4.58 0.00 3.81 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 88 M 7.55 3.91 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.41 0.00 89 D 7.94 4.53 0.00 2.64 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 90 D 7.89 4.83 0.00 2.58 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 T 7.91 3.83 4.20 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 0.00 0.00 0.00 1.18 0.00 0.00 92 E 8.11 3.85 0.00 2.05 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 0.00 2.35 2.34 0.00 93 K 7.94 3.89 0.00 1.91 1.87 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.41 7.81 94 M 7.93 3.93 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 95 S 7.98 4.00 0.00 4.04 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 96 M 7.82 3.96 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.54 0.00 97 K 7.85 3.88 0.00 1.96 1.75 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.45 7.81 98 L 7.87 4.01 0.00 1.67 1.58 0.79 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.39 3.86 0.00 1.98 1.93 0.00 3.09 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 100 N 8.06 4.22 0.00 2.93 2.97 0.00 0.00 6.85 6.67 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 0.00 101 L 7.71 3.99 0.00 1.98 1.76 1.01 0.69 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 0.00 102 S 8.33 4.15 0.00 4.08 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 0.00 103 G 7.93 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.69 3.57 0.00 1.76 1.01 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.52 7.81 105 H 8.21 4.31 0.00 3.64 3.83 0.00 5.81 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 0.00 106 A 7.75 3.51 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.02 0.00 1.53 1.76 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.45 7.81 108 S 7.48 4.45 0.00 3.23 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.45 4.60 0.00 3.01 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 0.00 110 Q 7.77 3.56 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 111 V 7.61 3.84 1.70 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 0.77 0.00 0.00 0.96 0.00 0.00 112 D 6.64 4.18 0.00 2.27 2.32 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 0.00 113 P 0.00 3.33 0.00 1.79 0.69 0.00 3.47 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.47 0.00 114 E 7.41 3.72 0.00 1.77 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.47 0.00 115 Y 6.97 4.44 0.00 2.86 3.17 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 0.00 0.00 0.00 0.00 116 F 7.31 4.39 0.00 2.98 2.93 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 0.00 117 K 8.13 4.06 0.00 2.00 2.10 0.00 1.51 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.52 7.81 118 V 7.70 3.69 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 1.38 0.00 0.00 1.10 0.00 0.00 119 L 7.88 3.76 0.00 0.73 1.53 0.70 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.28 4.03 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 0.00 121 A 8.07 4.00 1.51 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 0.00 0.00 122 V 7.72 3.64 2.36 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 1.21 0.00 0.00 1.21 0.00 0.00 123 I 8.07 3.83 2.20 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 1.60 0.78 1.29 0.00 0.00 124 A 8.53 4.36 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 0.00 125 D 8.31 4.32 0.00 2.90 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 0.00 126 T 7.75 4.06 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 127 V 7.70 3.72 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 0.49 0.00 0.00 1.16 0.00 0.00 128 A 7.72 4.49 1.08 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 0.00 129 A 7.98 4.18 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 0.00 130 G 8.99 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 0.00 131 D 8.00 4.40 0.00 2.87 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 0.00 132 A 8.81 4.20 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 0.00 133 G 8.06 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.60 4.05 0.00 3.34 3.13 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 0.00 0.00 0.00 135 E 8.28 3.98 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 2.41 2.58 0.00 136 K 7.95 3.90 0.00 1.97 1.91 0.00 1.60 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.41 7.81 137 L 7.62 3.75 0.00 1.50 1.25 0.39 0.78 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 0.00 138 M 7.83 3.86 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.32 0.00 139 S 7.97 4.27 0.00 3.99 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 0.00 140 M 8.06 3.96 0.00 1.96 2.16 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 2.70 2.51 0.00 141 I 7.60 3.53 1.87 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.59 0.74 0.00 0.00 142 C 7.89 3.97 0.00 3.01 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 0.00 143 I 7.90 3.82 1.95 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 1.46 1.12 0.87 0.00 0.00 144 L 7.83 3.97 0.00 1.73 1.62 0.83 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 145 L 7.85 3.89 0.00 1.07 0.39 0.32 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.46 4.68 0.00 1.93 1.98 0.00 3.28 0.00 0.00 3.43 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 147 S 7.74 4.18 0.00 4.05 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 0.00 148 A 8.03 4.28 1.16 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 0.00 149 Y 8.08 4.18 0.00 3.13 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