NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.1408 8.3344 116.7762 58.1945 64.8221 173.7453 5 V 3.8343 7.5021 123.4180 60.3689 31.0900 169.9872 6 V 4.0538 8.8829 128.5309 62.0583 33.6887 174.7627 7 K 4.7489 8.1165 123.2063 54.3174 35.3231 177.2764 8 S 4.1899 8.9524 118.3377 62.0898 62.7436 176.4891 9 E 4.2785 8.1670 113.2585 57.4144 29.5010 176.5299 10 D 4.6387 7.9447 119.2075 54.3838 41.1788 177.6777 11 Y 4.1495 7.4116 118.7568 60.0104 37.7457 177.6352 12 A 4.1822 7.1527 120.7685 53.1078 18.8946 176.8156 13 L 4.7040 7.3026 115.6416 51.7945 43.7326 174.8439 14 P 4.3245 0.0000 0.0000 62.9964 31.7263 175.7882 15 S 4.8388 8.3351 115.3693 56.4781 66.0836 172.2028 16 Y 4.5462 8.3203 120.8759 56.3975 39.7622 174.8871 17 V 4.2802 6.8206 117.8484 59.9164 35.6486 174.7089 18 D 4.6215 8.4719 124.0114 52.6103 40.8124 175.5210 19 R 4.4998 7.8058 123.5370 53.9901 33.2124 176.0004 20 R 3.4913 8.7290 124.4583 59.1181 30.1528 177.0368 21 D 4.8153 7.9771 113.8774 53.4393 39.6519 176.1891 22 Y 4.7660 7.9267 120.6251 55.3597 38.8630 173.4198 23 P 4.3880 0.0000 0.0000 65.2229 31.7609 177.1624 24 L 4.6671 6.7160 116.3783 51.5112 40.9436 174.3012 25 P 4.6293 0.0000 0.0000 62.3116 32.0148 176.7253 26 D 4.5796 8.7288 119.1143 56.8122 40.9793 177.1906 27 V 4.5449 7.4223 109.4653 58.9845 35.6048 174.9011 28 A 4.2939 8.2872 124.0946 51.9093 19.1614 177.3132 29 H 3.6342 8.6445 121.7563 58.3150 29.8796 175.9023 30 V 4.1786 7.7217 119.1895 60.8130 32.7655 174.8396 31 K 4.1786 8.5967 126.4464 57.6005 33.6322 176.2151 32 N 4.7194 7.9636 117.0810 51.6279 39.2362 173.9980 33 L 4.6138 8.1805 123.6796 52.9066 43.7653 177.3800 34 S 4.4626 8.2694 117.5633 57.2908 65.7202 175.1138 35 A 3.9791 8.4527 122.8234 55.4155 17.9677 179.7592 36 S 4.0773 8.0160 112.0832 61.8584 63.0080 176.5842 37 Q 3.9720 7.8736 121.7272 58.5315 28.5599 178.9407 38 K 3.9816 8.5029 119.6294 59.1701 32.0136 179.3322 39 A 4.0072 7.8517 121.0553 55.0215 18.2342 179.4525 40 L 3.9447 8.0437 118.9585 58.2857 41.9897 179.3841 41 K 4.0204 8.0909 117.2832 59.1408 32.2806 178.8076 42 E 4.1901 7.9999 118.8352 58.9752 29.4757 178.9490 43 K 4.0394 8.1693 119.7872 59.2813 32.0387 178.3947 44 E 4.2279 8.3532 118.8672 58.6858 29.5933 178.3631 45 K 4.2283 7.8785 116.7621 58.0527 32.4504 176.5872 46 A 4.4570 7.6828 122.1331 50.1104 21.0621 176.3904 47 S 4.0030 8.3379 112.4252 58.5921 62.8918 175.4066 48 W 4.6669 8.5261 126.6062 59.2164 29.2197 178.5333 49 S 4.2731 7.8423 114.3849 61.3591 62.2786 175.3112 50 S 4.4581 7.8674 113.6722 58.7483 62.9445 173.8623 51 L 4.5073 7.5600 123.5908 54.2219 42.8350 176.9697 52 S 4.5997 9.3629 121.0478 57.3277 65.6112 175.4290 53 I 3.6602 8.2520 123.3616 65.0943 36.9192 178.4748 54 D 4.4019 8.0851 118.6466 57.2198 40.5816 178.5940 55 E 4.0409 7.9237 119.5300 59.0409 29.5072 179.3754 56 K 3.9258 8.4721 119.0550 59.5705 32.2085 179.6869 57 V 3.6797 8.1708 118.8135 65.7786 30.9060 177.7110 58 E 4.0055 8.1465 119.4004 59.1095 29.2962 178.7209 59 L 4.0000 8.0823 119.2474 57.8337 41.6111 178.9165 60 Y 4.1055 8.2097 119.4495 60.8145 38.6801 177.8750 61 R 4.6956 7.9643 117.4943 57.2759 30.3911 178.4538 62 L 4.1122 7.4405 119.4461 57.3874 41.7971 179.0086 63 K 3.6036 7.5715 119.4291 57.5867 32.3943 176.5363 64 F 5.1286 7.6300 116.9972 55.3115 41.4018 175.4863 65 K 3.4663 8.1802 125.1789 57.5717 32.5296 176.4769 66 E 4.9402 8.5966 119.5526 54.3324 32.3026 176.9304 67 S 5.1039 8.7048 118.7120 56.8556 65.7076 175.6018 68 F 3.8441 8.9201 119.8588 60.7100 38.3936 177.6503 69 A 4.0610 8.1269 118.4403 55.3366 18.3377 179.1196 70 E 4.1101 8.2091 116.8428 59.7160 29.3694 179.4684 71 M 4.2288 8.1097 116.2186 58.1383 31.3286 177.3715 72 N 4.7162 7.9751 115.1806 52.1347 39.1873 175.4830 73 R 4.0915 7.1474 118.3477 55.9849 30.1642 176.7007 74 S 4.5914 8.3433 115.3497 57.7153 64.5489 172.3676 75 T 4.7575 7.9611 109.8014 60.5154 71.9679 173.1448 76 N 4.8214 8.5156 115.7078 53.2531 38.9953 176.7091 77 E 3.9353 8.0522 122.3594 59.2632 29.4894 178.8474 78 W 4.3434 8.4447 116.1627 59.5579 27.8695 178.2690 79 K 3.0341 6.6340 118.7009 59.2391 31.2915 179.4035 80 T 3.7566 7.5094 115.3363 66.4689 68.3614 176.7403 81 V 3.5971 7.8540 120.0632 66.1271 31.6758 178.2155 82 V 3.7684 8.4365 118.4732 65.9320 31.3818 178.2267 83 G 3.5826 8.4028 105.5100 47.7950 0.0000 175.5668 84 A 4.1286 8.4265 123.6692 54.6364 18.3595 179.4301 85 A 4.1373 8.4340 119.5708 55.9616 18.4770 179.8716 86 M 4.0762 8.2805 116.9902 58.3165 31.9302 178.9027 87 F 4.0652 8.2069 120.9890 61.4243 39.6134 177.3451 88 F 4.1461 8.4282 117.2744 60.3173 38.4438 177.8404 89 I 4.0026 8.0233 119.3318 63.9827 37.2809 178.3455 90 G 3.6372 8.1600 107.0676 47.6657 0.0000 175.5426 91 F 3.9626 8.1815 123.5938 61.2579 39.2624 177.2587 92 T 3.7342 7.9279 115.1744 66.5676 68.2439 176.3038 93 A 4.0167 7.7480 122.0860 55.0498 18.3066 179.7312 94 L 3.8989 7.5501 117.7455 57.7554 41.5676 179.6130 95 L 3.8977 7.3001 118.4706 57.8117 41.6258 179.4101 96 L 4.0470 7.9168 118.9095 57.7337 41.4797 179.7206 97 I 3.7374 7.8001 119.9361 64.0707 37.0707 178.1870 98 W 4.1922 8.3745 129.2705 60.3468 30.4315 177.6252 99 E 3.7625 8.5472 119.3153 59.2812 28.9595 178.6216 100 K 4.0377 7.9036 118.1958 59.7444 32.2131 177.9654 101 H 4.0244 7.9294 117.6193 59.0470 30.0014 176.1698 102 Y 4.1704 7.6014 115.7025 57.7962 38.3746 176.3176 103 V 4.0084 7.3190 117.9153 64.3671 33.0657 175.7190 104 Y 4.5117 7.4995 116.2811 57.9752 38.4050 176.3629 105 G 4.0439 8.3653 113.5828 43.7122 0.0000 171.2952 106 P 4.4376 0.0000 0.0000 62.0057 32.2064 176.0320 107 I 3.9566 7.8109 113.4565 59.4041 38.8478 173.8642 108 P 4.3322 0.0000 0.0000 62.9986 31.8425 177.4770 109 H 4.3172 8.5896 116.3571 58.0312 28.5143 177.0195 110 T 2.7762 7.0540 109.1206 62.7665 68.5743 174.7218 111 F 4.5671 7.6543 119.9725 57.9582 39.8586 176.7098 112 E 4.2058 7.9931 121.3015 56.0607 31.1541 177.0923 113 E 3.9735 9.0019 122.9659 59.6912 29.5067 179.1525 114 E 3.9026 8.2027 118.4404 58.9992 29.8435 178.0878 115 W 3.8292 8.3401 127.9142 60.6762 30.7397 177.7017 116 V 3.6401 8.3324 117.9267 65.9919 30.8803 177.8130 117 A 4.0041 8.0147 120.3615 55.1317 18.2187 179.8202 118 K 3.7547 8.1199 117.1471 59.5613 32.0354 179.2642 119 Q 3.8446 8.4594 120.1791 59.5890 28.9093 178.6716 120 T 3.9999 8.4942 116.8990 66.4772 68.4787 176.5250 121 K 3.6169 7.8879 121.4705 59.4358 32.1617 178.6407 122 R 3.8393 8.1881 119.3208 59.8851 29.8397 178.3448 123 M 4.0461 8.3177 118.5249 58.4205 31.8007 178.7681 124 L 4.1124 7.9637 119.1371 57.6368 41.4706 179.2284 125 D 4.3975 8.2629 119.1975 56.8521 40.8532 177.5630 126 M 4.2826 8.1036 114.8531 53.9782 32.4765 176.0192 127 K 4.2342 7.6566 117.5811 56.4102 30.4042 176.3162 128 V 3.4645 8.2263 118.5245 64.3510 32.8939 175.1129 129 A 4.1525 8.7454 129.8872 52.9212 15.5117 175.6278 130 P 4.5583 0.0000 0.0000 64.3086 32.6843 178.7882 131 I 4.1197 7.8370 119.4210 63.9504 37.6069 175.9199 132 Q 4.7240 8.0180 114.6154 57.3498 35.7007 176.1098 133 G 3.8515 8.4163 105.6173 48.1907 0.0000 172.9485 134 F 4.8378 8.3335 121.1455 59.3036 42.2481 176.6949 135 S 4.2173 9.1996 116.5346 61.4167 63.0340 176.8174 136 A 4.2156 8.2188 121.9313 54.5367 18.4472 177.9131 137 K 4.4648 8.3908 114.5843 56.0492 32.4763 175.7033 138 W 4.7296 8.0262 129.6904 55.2591 32.7169 174.9309 139 D 4.4340 7.8209 125.9124 52.8971 39.6588 176.3824 140 Y 4.3384 8.3032 125.2948 60.9307 38.3979 178.0713 141 D 4.4838 8.2677 118.8629 57.4315 41.0982 177.6814 142 K 3.9753 7.9931 115.0735 56.3533 32.6421 176.3395 143 N 3.9389 7.4235 116.9335 53.3414 37.7187 171.6576 144 E 3.4271 5.9000 114.2755 54.5253 33.4601 175.7374 145 W 4.4357 7.9104 120.3642 56.1934 29.6825 176.7580 146 K 3.8005 8.6084 124.3411 56.7909 32.2165 177.2994 147 K 4.1377 8.5405 122.7400 56.7651 32.0663 176.8620 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 4 S 8.33 4.14 0.00 3.80 3.91 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 5 V 7.50 3.83 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 0.74 0.00 0.00 0.91 0.00 0.00 6 V 8.88 4.05 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 0.89 0.00 0.00 0.96 0.00 0.00 7 K 8.12 4.75 0.00 1.94 1.64 0.00 1.74 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.95 4.19 0.00 3.92 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 9 E 8.17 4.28 0.00 2.00 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 2.27 2.26 0.00 10 D 7.94 4.64 0.00 3.06 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 11 Y 7.41 4.15 0.00 3.01 3.11 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 12 A 7.15 4.18 1.05 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 0.00 0.00 13 L 7.30 4.70 0.00 1.76 1.57 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.32 0.00 2.06 2.02 0.00 3.62 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 2.04 2.10 0.00 15 S 8.34 4.84 0.00 3.98 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 16 Y 8.32 4.55 0.00 2.99 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 17 V 6.82 4.28 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 0.67 0.00 0.00 0.82 0.00 0.00 18 D 8.47 4.62 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.81 4.50 0.00 1.73 1.72 0.00 3.41 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 20 R 8.73 3.49 0.00 1.83 2.09 0.00 3.49 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 21 D 7.98 4.82 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.93 4.77 0.00 2.95 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.39 0.00 2.30 2.43 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 24 L 6.72 4.67 0.00 1.54 1.66 0.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.63 0.00 2.12 1.68 0.00 3.90 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.06 0.00 26 D 8.73 4.58 0.00 2.74 2.79 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 27 V 7.42 4.54 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 0.76 0.00 0.00 1.11 0.00 0.00 28 A 8.29 4.29 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 29 H 8.64 3.63 0.00 2.47 3.32 0.00 5.89 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.72 4.18 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 0.83 0.00 0.00 0.82 0.00 0.00 31 K 8.60 4.18 0.00 1.87 1.88 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.41 7.81 32 N 7.96 4.72 0.00 2.69 2.78 0.00 0.00 6.82 7.85 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 33 L 8.18 4.61 0.00 1.60 1.55 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.27 4.46 0.00 4.04 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 35 A 8.45 3.98 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 36 S 8.02 4.08 0.00 4.06 4.14 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 37 Q 7.87 3.97 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.39 0.00 38 K 8.50 3.98 0.00 1.77 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.61 7.81 39 A 7.85 4.01 1.42 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 40 L 8.04 3.94 0.00 1.78 1.85 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.09 4.02 0.00 1.91 1.88 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.64 1.62 7.81 42 E 8.00 4.19 0.00 2.19 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 2.58 2.46 0.00 43 K 8.17 4.04 0.00 1.87 2.01 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.35 4.23 0.00 2.17 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 2.66 2.45 0.00 45 K 7.88 4.23 0.00 1.96 1.87 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.53 1.74 7.81 46 A 7.68 4.46 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 47 S 8.34 4.00 0.00 3.81 3.75 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 48 W 8.53 4.67 0.00 3.48 3.08 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 49 S 7.84 4.27 0.00 3.85 3.97 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 50 S 7.87 4.46 0.00 4.03 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 51 L 7.56 4.51 0.00 1.88 1.60 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 52 S 9.36 4.60 0.00 4.04 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 53 I 8.25 3.66 1.87 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 1.64 0.94 0.90 0.00 0.00 54 D 8.09 4.40 0.00 2.72 2.73 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 55 E 7.92 4.04 0.00 2.19 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 2.36 0.00 56 K 8.47 3.93 0.00 1.94 1.81 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.39 1.57 7.81 57 V 8.17 3.68 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 1.02 0.00 0.00 0.93 0.00 0.00 58 E 8.15 4.01 0.00 2.26 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 0.00 2.31 2.36 0.00 59 L 8.08 4.00 0.00 1.98 1.68 0.88 0.60 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 60 Y 8.21 4.11 0.00 3.21 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 61 R 7.96 4.70 0.00 1.90 2.03 0.00 3.47 0.00 0.00 3.40 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.77 0.00 62 L 7.44 4.11 0.00 1.81 1.62 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.57 3.60 0.00 1.50 1.39 0.00 1.07 0.00 0.00 1.32 0.00 0.00 2.81 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.63 5.13 0.00 2.49 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 65 K 8.18 3.47 0.00 1.00 1.97 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.26 7.81 66 E 8.60 4.94 0.00 2.27 1.86 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 2.28 2.23 0.00 67 S 8.70 5.10 0.00 4.15 4.14 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 68 F 8.92 3.84 0.00 3.06 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 69 A 8.13 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 70 E 8.21 4.11 0.00 2.33 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 0.00 2.36 2.35 0.00 71 M 8.11 4.23 0.00 2.08 2.10 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 2.43 2.56 0.00 72 N 7.98 4.72 0.00 2.88 2.91 0.00 0.00 7.06 7.17 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 73 R 7.15 4.09 0.00 1.89 1.95 0.00 3.08 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.59 0.00 74 S 8.34 4.59 0.00 4.04 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.96 4.76 4.29 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 1.25 0.00 0.00 76 N 8.52 4.82 0.00 2.74 2.73 0.00 0.00 6.43 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 77 E 8.05 3.94 0.00 2.03 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 0.00 2.35 2.35 0.00 78 W 8.44 4.34 0.00 3.72 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 79 K 6.63 3.03 0.00 1.48 1.38 0.00 1.33 0.00 0.00 1.26 0.00 0.00 2.83 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.51 3.76 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 81 V 7.85 3.60 2.29 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 1.15 0.00 0.00 1.02 0.00 0.00 82 V 8.44 3.77 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 1.08 0.00 0.00 1.21 0.00 0.00 83 G 8.40 3.58 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 0.00 0.00 0.00 84 A 8.43 4.13 1.55 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 0.00 0.00 85 A 8.43 4.14 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 86 M 8.28 4.08 0.00 2.15 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 3.01 2.61 0.00 87 F 8.21 4.07 0.00 3.07 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 88 F 8.43 4.15 0.00 3.27 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 89 I 8.02 4.00 2.05 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 1.52 0.72 0.94 0.00 0.00 90 G 8.16 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 0.00 0.00 0.00 91 F 8.18 3.96 0.00 2.43 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 92 T 7.93 3.73 4.46 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 1.21 0.00 0.00 93 A 7.75 4.02 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 94 L 7.55 3.90 0.00 1.38 1.52 0.89 0.59 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 95 L 7.30 3.90 0.00 1.72 1.62 0.89 0.32 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 96 L 7.92 4.05 0.00 1.86 1.74 0.93 0.96 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 97 I 7.80 3.74 2.05 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 1.41 0.69 0.92 0.00 0.00 98 W 8.37 4.19 0.00 3.52 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 99 E 8.55 3.76 0.00 2.29 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 0.00 1.61 2.13 0.00 100 K 7.90 4.04 0.00 1.87 1.86 0.00 1.89 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.50 7.81 101 H 7.93 4.02 0.00 3.03 3.23 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.60 4.17 0.00 1.43 2.23 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 0.00 103 V 7.32 4.01 1.80 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 0.65 0.00 0.00 0.76 0.00 0.00 104 Y 7.50 4.51 0.00 3.10 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 0.00 105 G 8.37 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 0.00 106 P 0.00 4.44 0.00 2.16 2.02 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 1.96 1.92 0.00 107 I 7.81 3.96 1.53 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.54 0.59 0.00 0.00 108 P 0.00 4.33 0.00 2.27 1.93 0.00 3.81 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 2.25 2.11 0.00 109 H 8.59 4.32 0.00 3.38 3.47 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.05 2.78 3.60 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 0.11 0.00 0.00 111 F 7.65 4.57 0.00 3.18 3.10 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 0.00 112 E 7.99 4.21 0.00 2.28 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 2.40 2.40 0.00 113 E 9.00 3.97 0.00 2.09 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 2.44 2.46 0.00 114 E 8.20 3.90 0.00 2.14 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 0.00 2.37 2.38 0.00 115 W 8.34 3.83 0.00 3.59 3.23 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 0.00 116 V 8.33 3.64 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 0.87 0.00 0.00 1.16 0.00 0.00 117 A 8.01 4.00 1.44 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 0.00 0.00 0.00 118 K 8.12 3.75 0.00 1.58 1.57 0.00 1.42 0.00 0.00 1.24 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.43 7.81 119 Q 8.46 3.84 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 120 T 8.49 4.00 4.47 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 1.49 0.00 0.00 121 K 7.89 3.62 0.00 1.73 1.85 0.00 1.36 0.00 0.00 1.49 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.49 7.81 122 R 8.19 3.84 0.00 1.79 2.01 0.00 3.07 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 123 M 8.32 4.05 0.00 1.99 2.36 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.47 0.00 124 L 7.96 4.11 0.00 1.56 1.32 -0.82 0.67 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 0.00 125 D 8.26 4.40 0.00 2.74 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 0.00 126 M 8.10 4.28 0.00 2.14 2.15 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 2.56 2.81 0.00 127 K 7.66 4.23 0.00 1.87 1.95 0.00 1.56 0.00 0.00 1.32 0.00 0.00 2.52 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.52 1.25 7.81 128 V 8.23 3.46 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 0.81 0.00 0.00 0.91 0.00 0.00 129 A 8.75 4.15 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 0.00 130 P 0.00 4.56 0.00 2.27 2.39 0.00 3.83 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 131 I 7.84 4.12 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.46 0.95 0.00 0.00 132 Q 8.02 4.72 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 133 G 8.42 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 0.00 134 F 8.33 4.84 0.00 3.07 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 0.00 135 S 9.20 4.22 0.00 4.21 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 0.00 136 A 8.22 4.22 1.42 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 0.00 137 K 8.39 4.46 0.00 2.14 1.93 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.44 7.81 138 W 8.03 4.73 0.00 2.74 2.49 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 0.00 139 D 7.82 4.43 0.00 2.35 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 0.00 0.00 0.00 0.00 140 Y 8.30 4.34 0.00 3.12 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 0.00 141 D 8.27 4.48 0.00 2.80 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 0.00 142 K 7.99 3.98 0.00 1.56 1.69 0.00 1.87 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.28 7.81 143 N 7.42 3.94 0.00 2.81 2.73 0.00 0.00 6.94 7.14 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 0.00 144 E 5.90 3.43 0.00 1.69 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 1.91 1.90 0.00 145 W 7.91 4.44 0.00 3.15 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 0.00 146 K 8.61 3.80 0.00 1.68 1.77 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.35 7.81 147 K 8.54 4.14 0.00 1.71 1.70 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.39 7.81