NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 L 4.3145 8.1693 120.6168 54.9040 43.2074 175.5953 12 T 4.4021 7.6535 109.8477 59.9086 71.8043 171.4918 13 D 4.3552 9.4478 120.0787 55.4028 40.1112 176.1013 14 L 4.4010 7.9455 118.3250 55.0999 41.6371 177.1594 15 Q 4.9073 8.9198 123.3596 53.6679 31.8873 175.6220 16 E 3.9752 8.8291 121.1750 56.5300 30.4879 175.5773 17 A 4.7140 8.2617 123.0650 51.0979 23.4964 175.5976 18 H 4.8850 8.8807 115.0605 54.2780 30.1916 173.4647 19 F 5.5900 8.6879 120.4742 54.4572 42.7029 174.8021 20 V 4.4762 7.7106 118.7839 60.4651 35.1446 173.6523 21 V 4.4641 9.5103 123.9327 62.0900 32.3544 175.1775 22 F 5.5242 9.3575 127.7985 56.2564 41.2966 175.6378 23 E 4.6275 8.6230 120.4934 55.9509 29.7533 177.5636 24 S 4.3480 8.9840 116.2611 61.1904 62.8843 175.2850 25 E 4.5538 8.1852 117.5068 55.7617 31.4912 175.7292 26 E 4.6555 7.8498 116.8858 54.5420 32.0339 176.5128 27 N 4.6691 8.3145 120.8293 51.9280 37.2768 174.4538 28 S 3.8497 6.3300 115.0004 56.1057 67.6625 173.9903 29 E 4.4794 8.4119 121.5091 57.4052 29.8837 177.3323 30 S 4.5763 9.2623 117.7547 57.3214 63.7452 175.5166 31 V 3.7409 8.1398 118.0123 64.5358 31.2319 178.7002 32 M 4.2162 7.8147 118.2217 58.0031 31.2643 177.9702 33 D 4.9930 8.4127 118.5602 56.9501 41.1453 177.8058 34 G 3.8432 8.1008 104.3815 46.0293 0.0000 173.8238 35 F 4.9535 8.7763 119.6997 57.2522 40.3247 175.5216 36 V 5.0796 7.8534 111.1646 59.5988 35.0936 175.5712 37 E 4.5455 9.1665 123.8735 56.6289 30.4164 175.9964 38 H 5.1341 8.6238 117.2128 53.5745 32.7167 171.8932 39 P 4.7378 0.0000 0.0000 61.9560 32.7398 175.1855 40 F 4.8226 8.4752 117.4813 57.3647 40.6027 173.9862 41 Y 5.2973 8.8175 115.9376 56.8949 42.8935 174.7394 42 T 4.9465 9.2365 111.0066 60.1196 71.8307 172.9341 43 A 5.3000 9.0503 126.2598 50.6747 23.8049 174.0767 44 T 5.1689 8.7773 114.8080 62.0417 71.8229 174.0034 45 L 4.7012 9.3224 127.1244 54.3557 45.9907 175.5383 46 N 4.2973 9.9272 123.3125 54.4614 36.2225 175.0496 47 G 3.9691 8.5685 102.5247 45.9481 0.0000 173.8593 48 Q 4.7057 8.3062 118.6356 53.5959 32.5106 174.3496 49 K 4.9626 8.3367 123.5179 55.6002 33.9779 174.8490 50 Y 5.2320 9.0512 124.2967 56.0598 42.4991 174.5595 51 V 4.0892 8.3741 121.6808 62.0760 33.1532 174.8022 52 V 4.5984 9.3342 128.0102 61.3747 33.9675 174.0369 53 M 4.5721 8.5550 126.0449 53.6796 36.0819 173.4695 54 K 5.0092 8.2796 124.0358 54.9032 34.9988 175.6422 55 T 4.7952 8.2923 114.4748 60.4145 70.8590 173.9697 56 K 4.6067 9.0140 121.6729 55.0454 35.1089 175.9894 57 D 4.9642 8.6789 120.9001 54.0801 39.7720 174.1314 58 D 4.5589 8.6166 120.8802 57.4490 41.9072 178.2428 59 S 4.3373 8.4220 112.6180 61.1112 63.3828 174.8377 60 Y 4.4960 8.7090 123.0369 60.0154 38.8211 175.8882 61 W 4.5375 8.3677 118.7530 56.6844 29.8487 174.9744 62 K 4.4849 9.0750 121.9470 57.8404 33.7217 175.4011 63 D 4.7295 7.7552 116.4094 53.4949 45.1885 173.8250 64 L 5.1465 8.3708 123.6174 53.7943 45.6469 174.5717 65 I 4.7193 8.7882 127.6899 59.6409 40.0155 174.6787 66 V 4.3806 8.6425 128.1314 61.6793 33.1706 175.6412 67 E 3.8961 10.4055 127.5562 57.2585 27.6142 175.9515 68 G 3.9599 8.6924 105.9516 44.8785 0.0000 173.8268 69 K 4.5270 8.1030 121.8478 53.9019 34.3039 175.1103 70 R 4.4062 8.5585 126.7185 56.1488 30.4803 176.3437 71 V 4.1725 8.0790 119.0230 61.8897 32.8048 175.2613 72 T 4.6630 8.5161 111.3393 60.3266 71.3155 173.5706 73 T 4.6342 8.4725 121.2019 63.3265 69.1546 174.8334 74 V 4.4114 8.5407 117.7273 61.8967 34.3423 176.0132 75 S 4.6496 7.5391 112.4743 57.1624 65.9717 173.8728 76 K 4.6906 8.5412 120.2259 54.7032 35.2985 176.1359 77 D 4.8505 8.3643 124.0517 51.3142 40.2744 174.3571 78 P 4.3330 0.0000 0.0000 64.6275 32.0514 177.9669 79 K 4.1459 7.8001 117.8442 58.5142 32.1543 176.9233 80 N 4.8245 8.0439 115.7338 54.6020 39.8895 174.4392 81 N 4.0074 7.9767 112.6926 54.5702 37.3425 171.0325 82 S 5.2405 7.0171 115.2565 57.2498 67.5895 172.5932 83 R 4.6825 8.0155 117.1421 55.7253 33.9629 173.2445 84 T 4.9695 8.6730 122.5957 61.7325 70.9210 173.5905 85 L 5.3157 8.6288 125.8984 53.9770 44.7474 175.0985 86 I 5.6008 8.9702 111.8713 58.8787 41.5375 173.8882 87 F 5.5372 7.9652 116.7847 54.3780 41.4701 171.6837 88 P 4.1758 0.0000 0.0000 64.0510 31.2614 174.7249 89 Y 4.6693 8.6425 125.2784 56.5984 40.4562 174.7203 90 I 4.5907 8.3641 126.8274 58.3453 39.8498 173.4001 91 P 4.6532 0.0000 0.0000 64.4794 31.2900 175.5588 92 D 4.3608 8.9387 120.0906 54.6548 39.4500 172.7641 93 K 4.1828 7.6652 118.3288 54.4625 32.5739 175.9084 94 A 4.1439 8.5591 129.0733 54.3196 19.8040 176.7263 95 V 4.5243 7.6273 114.9978 61.5802 33.2783 174.8675 96 Y 4.6607 9.2024 127.3459 56.1847 39.2379 174.9294 97 N 4.9868 9.4185 123.2679 53.4870 39.9722 174.4443 98 A 5.1308 9.2127 123.7208 50.9070 24.0309 174.8282 99 I 4.9030 8.7036 118.9344 59.7220 41.0199 175.0365 100 V 4.8870 8.9139 127.3803 61.0540 34.1116 174.4001 101 K 4.9482 8.8987 126.2276 54.7063 35.3028 175.8174 102 V 4.4164 7.9815 117.7238 59.5328 35.2730 174.7326 103 V 4.2230 7.3081 118.6002 61.0497 34.3092 173.6313 104 V 4.6007 8.2135 121.0389 60.7377 30.9898 175.1548 105 A 4.2039 8.4392 127.4547 55.0471 18.7867 179.7077 106 N 4.4869 8.2972 113.0767 56.0045 38.8584 175.0921 107 I 4.5965 8.1823 111.2771 60.1524 38.2951 175.8923 108 G 4.4849 8.0102 106.3261 47.3146 0.0000 173.3663 109 Y 4.7689 7.3463 119.9922 56.5532 40.7030 174.2431 110 E 4.1196 7.6094 125.1463 54.8488 32.6161 174.1982 111 G 4.1218 8.0033 113.3962 43.2953 0.0000 171.2283 112 Q 4.9324 8.0660 121.2052 54.3728 32.3236 173.4894 113 Y 4.7976 9.1656 123.8054 56.5062 41.4670 174.2106 114 H 5.0623 9.0595 121.2916 55.0863 29.9645 174.9243 115 V 4.7171 9.0568 116.0256 59.6622 36.9120 174.7448 116 R 5.0002 8.9719 120.3236 54.6950 32.9354 175.4798 117 I 4.7044 8.9429 127.0067 60.6168 38.4868 175.1081 118 I 4.6775 8.5600 129.3734 59.8122 39.3978 174.9524 119 N 3.1400 8.9997 126.8128 51.8506 38.4190 175.3651 120 Q 3.9531 8.5754 126.9127 58.5348 29.0935 177.7558 121 D 4.5111 7.9930 116.3902 55.1265 41.2561 176.2570 122 I 4.0105 7.3185 125.4081 61.3817 37.1874 175.4398 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 11 L 8.17 4.31 0.00 1.57 1.61 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.65 4.40 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 1.19 0.00 0.00 13 D 9.45 4.36 0.00 2.81 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 14 L 7.95 4.40 0.00 1.51 1.56 0.75 0.81 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 Q 8.92 4.91 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.95 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 16 E 8.83 3.98 0.00 1.77 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 0.00 1.93 2.38 0.00 17 A 8.26 4.71 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 18 H 8.88 4.88 0.00 3.07 3.11 0.00 5.58 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.69 5.59 0.00 1.82 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.71 4.48 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 0.24 0.00 0.00 1.11 0.00 0.00 21 V 9.51 4.46 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.25 0.00 0.00 22 F 9.36 5.52 0.00 3.10 2.94 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 23 E 8.62 4.63 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 24 S 8.98 4.35 0.00 4.03 4.35 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 25 E 8.19 4.55 0.00 1.96 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 2.22 2.31 0.00 26 E 7.85 4.66 0.00 1.87 1.75 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 2.20 2.28 0.00 27 N 8.31 4.67 0.00 2.69 2.92 0.00 0.00 6.77 7.57 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 28 S 6.33 3.85 0.00 3.58 3.46 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 29 E 8.41 4.48 0.00 1.92 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 0.00 2.39 2.53 0.00 30 S 9.26 4.58 0.00 3.99 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 31 V 8.14 3.74 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 0.82 0.00 0.00 0.65 0.00 0.00 32 M 7.81 4.22 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.89 0.00 33 D 8.41 4.99 0.00 3.17 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 34 G 8.10 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 8.78 4.95 0.00 3.27 3.51 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 36 V 7.85 5.08 2.22 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 1.16 0.00 0.00 1.39 0.00 0.00 37 E 9.17 4.55 0.00 1.84 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 0.00 2.40 2.34 0.00 38 H 8.62 5.13 0.00 3.13 3.25 0.00 5.89 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.74 0.00 2.29 2.08 0.00 3.84 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 1.68 1.90 0.00 40 F 8.48 4.82 0.00 2.89 2.80 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 41 Y 8.82 5.30 0.00 2.78 2.74 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 42 T 9.24 4.95 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 1.33 0.00 0.00 43 A 9.05 5.30 1.20 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 0.00 0.00 0.00 44 T 8.78 5.17 4.34 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 1.23 0.00 0.00 45 L 9.32 4.70 0.00 1.58 1.42 0.65 0.61 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 46 N 9.93 4.30 0.00 2.97 2.91 0.00 0.00 7.11 7.65 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 47 G 8.57 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 0.00 0.00 0.00 48 Q 8.31 4.71 0.00 2.20 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.50 0.00 49 K 8.34 4.96 0.00 1.72 1.53 0.00 1.31 0.00 0.00 1.57 0.00 0.00 2.24 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.58 7.81 50 Y 9.05 5.23 0.00 2.83 2.80 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 51 V 8.37 4.09 0.67 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 0.11 0.00 0.00 0.48 0.00 0.00 52 V 9.33 4.60 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 0.73 0.00 0.00 0.84 0.00 0.00 53 M 8.55 4.57 0.00 1.76 1.10 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.00 0.00 54 K 8.28 5.01 0.00 1.66 1.73 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.31 7.81 55 T 8.29 4.80 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 0.26 0.00 0.00 56 K 9.01 4.61 0.00 1.82 1.79 0.00 2.01 0.00 0.00 1.87 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.47 7.81 57 D 8.68 4.96 0.00 3.03 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 58 D 8.62 4.56 0.00 2.68 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 59 S 8.42 4.34 0.00 4.13 4.09 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 60 Y 8.71 4.50 0.00 3.32 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 61 W 8.37 4.54 0.00 3.43 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 62 K 9.08 4.48 0.00 1.58 1.74 0.00 1.83 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.30 7.81 63 D 7.76 4.73 0.00 2.81 2.45 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 64 L 8.37 5.15 0.00 2.03 1.52 1.10 0.91 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 65 I 8.79 4.72 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 1.13 0.64 0.95 0.00 0.00 66 V 8.64 4.38 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 0.71 0.00 0.00 0.41 0.00 0.00 67 E 10.41 3.90 0.00 2.10 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 2.30 2.40 0.00 68 G 8.69 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 0.00 0.00 0.00 69 K 8.10 4.53 0.00 1.77 1.82 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.37 7.81 70 R 8.56 4.41 0.00 1.83 1.85 0.00 3.31 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 71 V 8.08 4.17 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 0.83 0.00 0.00 0.97 0.00 0.00 72 T 8.52 4.66 4.18 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 1.21 0.00 0.00 73 T 8.47 4.63 4.18 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 1.19 0.00 0.00 74 V 8.54 4.41 1.97 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 0.56 0.00 0.00 0.82 0.00 0.00 75 S 7.54 4.65 0.00 3.79 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.54 4.69 0.00 1.58 1.68 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.64 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.27 1.35 7.81 77 D 8.36 4.85 0.00 2.66 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 78 P 0.00 4.33 0.00 2.08 2.12 0.00 3.72 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 2.02 2.08 0.00 79 K 7.80 4.15 0.00 1.75 2.00 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.55 7.81 80 N 8.04 4.82 0.00 2.83 2.77 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 81 N 7.98 4.01 0.00 2.87 2.96 0.00 0.00 6.44 7.21 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 82 S 7.02 5.24 0.00 4.01 3.63 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 83 R 8.02 4.68 0.00 1.82 1.68 0.00 3.00 0.00 0.00 3.05 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.60 0.00 84 T 8.67 4.97 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 1.11 0.00 0.00 85 L 8.63 5.32 0.00 1.76 1.60 0.89 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.97 5.60 1.79 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.13 0.73 0.00 0.00 87 F 7.97 5.54 0.00 3.20 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 88 P 0.00 4.18 0.00 2.15 2.13 0.00 4.12 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.16 0.00 89 Y 8.64 4.67 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 90 I 8.36 4.59 1.69 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.19 0.86 0.00 0.00 91 P 0.00 4.65 0.00 2.26 2.25 0.00 3.97 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 92 D 8.94 4.36 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 93 K 7.67 4.18 0.00 1.61 1.50 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.61 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.84 1.04 7.81 94 A 8.56 4.14 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 95 V 7.63 4.52 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.93 0.00 0.00 96 Y 9.20 4.66 0.00 3.08 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 9.42 4.99 0.00 2.78 2.77 0.00 0.00 6.40 7.07 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 98 A 9.21 5.13 1.18 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 0.00 0.00 99 I 8.70 4.90 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.91 0.83 0.00 0.00 100 V 8.91 4.89 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 0.48 0.00 0.00 0.99 0.00 0.00 101 K 8.90 4.95 0.00 1.75 1.54 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.26 1.34 7.81 102 V 7.98 4.42 0.67 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 -0.18 0.00 0.00 0.75 0.00 0.00 103 V 7.31 4.22 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 0.46 0.00 0.00 0.96 0.00 0.00 104 V 8.21 4.60 2.37 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 0.91 0.00 0.00 1.37 0.00 0.00 105 A 8.44 4.20 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 0.00 106 N 8.30 4.49 0.00 2.72 2.93 0.00 0.00 6.73 7.94 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 0.00 107 I 8.18 4.60 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 1.50 0.93 0.95 0.00 0.00 108 G 8.01 4.48 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 0.00 109 Y 7.35 4.77 0.00 2.93 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 7.61 4.12 0.00 1.73 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 1.98 2.19 0.00 111 G 8.00 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 0.00 0.00 0.00 112 Q 8.07 4.93 0.00 1.87 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.62 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 113 Y 9.17 4.80 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 0.00 114 H 9.06 5.06 0.00 3.03 3.31 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 9.06 4.72 2.31 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 0.83 0.00 0.00 1.06 0.00 0.00 116 R 8.97 5.00 0.00 1.87 1.91 0.00 3.19 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 117 I 8.94 4.70 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.81 1.26 0.00 0.00 118 I 8.56 4.68 1.40 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.45 0.73 0.00 0.00 119 N 9.00 3.14 0.00 2.41 2.65 0.00 0.00 6.87 6.72 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 0.00 120 Q 8.58 3.95 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.75 0.00 0.00 0.00 0.00 0.00 2.16 2.03 0.00 121 D 7.99 4.51 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 0.00 122 I 7.32 4.01 1.81 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.81 0.93 0.00 0.00