NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 H 4.8685 8.4449 117.8279 55.7928 30.1646 172.1283 -1 V 4.5093 8.1452 114.9386 57.5645 35.3161 173.3945 -1 K 4.7093 8.4052 116.1386 51.5645 35.5161 173.6945 2 P 4.2700 0.0000 0.0000 61.6450 32.7446 177.3602 3 P 4.2104 0.0000 0.0000 65.3537 31.5124 177.4352 4 Q 4.0355 7.9377 115.0611 56.9872 28.9654 175.5352 5 F 4.7881 7.4650 117.9332 55.8758 41.1168 176.2359 6 T 4.2191 8.7996 115.4513 60.7774 70.9313 176.0377 7 W 4.3406 8.6016 120.6279 60.0043 29.0414 178.6326 8 A 4.8259 8.1994 121.5732 54.9703 17.9646 179.5341 9 Q 4.0714 8.3686 116.6748 58.9240 28.7141 178.8684 10 W 4.1389 8.8362 129.7339 60.1194 30.6233 177.6914 11 F 3.9429 8.8255 121.1457 61.4076 38.7452 176.7377 12 E 4.0797 8.6880 118.7361 59.7159 29.2149 178.9223 13 T 3.8420 7.7287 114.6363 66.7278 68.5595 176.4064 14 Q 3.5305 7.3860 119.1073 57.7533 28.9259 176.5824 15 H 4.6958 7.8070 113.5978 54.0830 30.9056 174.7373 16 I 4.1874 7.7096 117.5142 62.9511 39.2318 176.5305 17 N 4.5314 8.1092 119.3459 52.2528 36.5496 173.3705 18 M 3.5498 7.6744 119.2368 54.3530 31.5668 176.6785 19 T 3.9510 7.9747 116.5964 63.0800 69.5767 174.6768 20 S 4.5803 7.0043 116.0219 56.4737 65.4803 173.7907 21 Q 4.0203 8.5636 123.4598 57.3596 28.9691 176.6288 22 Q 4.6099 7.6961 118.6537 54.4512 30.4032 175.5416 23 C 4.1844 9.2477 123.6616 60.5035 40.1498 176.4105 24 T 4.0235 7.9305 115.4756 66.8409 68.2462 175.9551 25 N 4.4615 8.0878 117.5018 56.2964 38.3121 177.2231 26 A 3.8814 8.0568 122.2813 55.4235 18.3317 179.5743 27 M 4.0267 8.3610 117.1745 57.9457 31.7745 178.7036 28 Q 4.0033 7.7944 119.0005 58.9721 28.8256 179.2019 29 V 3.5180 7.4905 118.4378 66.1346 31.5797 178.1415 30 I 3.8661 7.7477 118.9501 64.6686 36.9864 178.1425 31 N 4.7681 8.4680 118.8749 55.8233 38.1530 177.3106 32 N 4.3474 8.3798 117.6104 56.5040 38.6390 176.7815 33 Y 4.5166 7.8673 117.4309 61.0571 38.1982 177.6499 34 Q 4.1850 8.6166 116.9927 55.8320 29.2333 176.1447 35 R 3.9534 8.4345 118.1812 56.4761 28.1417 175.9029 36 R 4.5007 7.4876 110.5700 55.6617 31.7820 174.1313 37 C 4.9717 8.6483 117.0627 55.6553 40.6573 174.1988 38 K 4.3645 9.0880 125.6815 56.2994 32.4350 177.0968 39 N 4.6138 8.8597 121.5381 56.5227 40.0568 174.3057 40 Q 5.1784 7.9065 117.0188 54.9466 32.6455 173.4818 41 N 4.8279 9.1621 122.0535 52.8047 42.8158 172.9136 42 T 4.9788 8.3415 121.9090 61.9434 71.2977 173.1062 43 F 4.9847 8.9993 125.4164 55.7995 41.1582 174.8549 44 L 4.4087 8.6183 124.9673 53.6328 42.1876 178.2405 45 L 4.4608 8.4052 127.6500 53.4757 39.1926 175.0310 46 T 4.6745 7.3875 114.0822 59.7852 71.6378 173.0168 47 T 4.5782 8.0853 113.9694 60.2340 71.7593 175.3264 48 F 4.0523 8.8157 123.6905 61.5960 39.4314 177.1283 49 A 3.8870 8.2527 119.7772 55.3848 18.1640 179.2208 50 N 4.3099 8.0922 114.8526 56.4060 38.6288 177.8822 51 V 3.7040 7.6336 120.9984 65.3162 31.3804 177.9694 52 V 3.2376 7.1608 117.1562 66.2739 31.4913 177.5054 53 N 4.4319 8.1530 115.8715 56.2239 38.2453 177.5171 54 V 3.5581 7.8574 119.7184 66.1570 31.3244 177.3225 55 C 4.0320 7.9785 115.4667 59.2999 40.0427 175.4575 56 G 3.5801 7.7153 105.3124 44.8080 0.0000 173.5737 57 N 4.6825 7.5506 118.8146 51.7086 39.4265 173.0947 58 P 4.3791 0.0000 0.0000 62.8394 31.9025 176.4610 59 N 4.7192 8.5098 119.2328 53.8264 38.8419 174.0414 60 M 4.8742 8.9084 119.1040 53.6787 35.5708 174.2214 61 T 4.3142 8.3278 116.2691 63.6299 69.6995 175.2932 62 C 4.4549 9.0218 124.2416 56.0501 40.5081 173.1219 63 P 4.1050 0.0000 0.0000 65.2094 31.0734 177.5954 64 S 4.4737 8.5340 111.3426 59.3877 63.9746 174.5214 65 N 4.9942 7.9400 120.0424 51.8063 39.2968 174.4694 66 K 4.1041 8.1024 120.6262 59.2402 33.1751 178.8713 67 T 4.2199 7.8653 107.6080 61.9880 69.2013 174.1154 68 R 4.6301 8.0624 122.3643 54.7663 32.1454 176.2061 69 K 4.8987 8.5296 121.6873 56.2638 32.9964 175.3174 70 N 4.9246 8.1198 112.8842 52.6616 38.5889 174.8557 71 C 5.3401 7.7083 115.9598 56.8794 44.5090 172.5664 72 H 5.2499 8.6998 117.1211 54.8077 32.7611 172.3004 73 H 4.9854 8.8217 123.1525 55.1664 30.8342 176.0530 74 S 3.6541 8.2687 120.3635 60.0986 62.7650 175.0741 75 G 4.3410 8.1673 115.3251 44.9509 0.0000 173.4374 76 S 5.1238 7.4284 112.9455 55.6874 65.8059 173.3276 77 Q 3.9924 8.2577 119.5006 55.9460 29.4474 175.8855 78 V 4.6226 8.5841 114.7000 58.7267 36.1057 173.5371 79 P 5.0575 0.0000 0.0000 62.4308 32.7476 175.3572 80 L 4.9664 8.9497 122.6415 54.9497 44.8304 174.2355 81 I 5.0405 8.8392 119.3922 60.0093 41.1055 174.3412 82 H 5.2136 9.2641 124.9156 54.7723 30.7047 173.3913 83 C 5.4813 9.3840 121.3420 55.4281 40.7119 172.5686 84 N 5.6499 9.0414 120.5982 50.9811 41.9229 173.6710 85 L 3.4722 8.9415 127.0830 55.4310 41.9628 176.5206 86 T 4.3509 8.6299 116.4507 62.6264 71.1389 174.7170 87 T 4.4502 7.3806 117.7848 60.9776 71.2422 171.7099 88 P 4.5190 0.0000 0.0000 62.4282 32.4869 177.2729 89 S 4.7021 7.8865 114.0270 57.2566 63.2829 173.4657 90 P 4.3464 0.0000 0.0000 64.9494 31.8459 178.0484 91 Q 4.4016 7.9285 115.8780 56.2509 29.4960 175.7950 92 N 4.9505 8.0678 117.1037 51.5964 39.8381 174.2633 93 I 3.9206 8.1430 124.7509 63.6828 37.7181 178.6130 94 S 4.2270 8.0803 113.6252 60.6239 62.8583 174.4721 95 N 4.7409 8.1597 117.2752 53.2640 38.7477 174.5296 96 C 5.3022 7.9296 116.9857 56.7919 38.0126 173.4082 97 R 5.0121 8.4545 120.7600 54.6693 33.5716 174.1376 98 Y 5.0860 8.9167 118.4226 56.2474 41.8692 175.1569 99 A 4.6955 9.0572 124.1070 51.2243 21.2585 176.0334 100 Q 5.1176 8.4712 119.0574 54.7827 32.7803 174.7509 101 T 4.6869 8.9383 121.5502 61.0252 71.6760 171.6334 102 P 4.9797 0.0000 0.0000 62.9866 32.6371 175.2166 103 A 4.5602 8.6373 121.8888 51.4983 23.2494 174.7359 104 N 5.3888 8.5472 115.8128 52.0325 41.4309 174.0220 105 M 4.6134 8.6733 122.3121 53.6844 37.4288 174.7205 106 F 4.8771 8.7785 119.6232 57.7616 40.2657 174.1529 107 Y 5.4134 8.6063 117.8377 55.5456 42.2002 174.0189 108 I 5.0907 8.9764 120.7850 59.5320 40.6110 174.9890 109 V 4.9962 8.8418 126.4429 59.7626 34.5796 174.5056 110 A 5.0063 8.7876 125.4028 51.4877 20.0777 175.7029 111 C 5.4090 9.0095 119.3623 55.3784 44.2815 172.9877 112 D 4.9338 8.8970 120.0726 52.4074 45.6970 174.5446 113 N 4.9798 8.7637 117.3272 53.3302 39.0640 175.6805 114 R 4.2252 8.6918 119.5249 56.0397 30.8113 175.9375 115 D 4.4633 9.4948 120.9432 54.1339 41.6877 176.7257 116 Q 3.9700 8.9721 128.3240 59.3389 29.2937 177.4511 117 R 4.1358 8.1304 116.0950 58.2730 30.3608 176.7962 118 R 4.5487 8.2777 113.9815 55.9439 32.2924 175.7580 119 D 4.7803 7.8831 117.9349 52.3002 42.1478 174.5579 120 P 4.4450 0.0000 0.0000 61.8977 31.9420 175.6960 121 P 4.3921 0.0000 0.0000 64.7601 31.5491 176.9000 122 Q 3.8070 8.1392 120.1387 58.7734 28.0198 176.1364 123 Y 4.8780 7.6724 117.1176 55.1389 38.5915 174.0551 124 P 4.5367 0.0000 0.0000 64.6320 32.8171 176.3423 125 V 4.8553 7.3537 116.6906 61.0012 33.6406 175.4672 126 V 4.5732 8.7842 120.3536 58.5880 36.5163 173.1642 127 P 4.4587 0.0000 0.0000 63.0714 31.8219 177.0262 128 V 4.5666 8.6297 113.8140 61.5248 34.3316 175.5603 129 H 5.0456 7.8429 116.1597 54.2495 33.4757 172.6283 130 L 4.6717 8.6797 124.8455 54.2919 41.5321 175.4551 131 D 4.5773 9.0484 127.7438 57.0074 41.9055 176.4209 132 R 4.7036 7.7621 115.7886 55.3335 33.5441 173.3721 133 I 5.0395 8.4273 124.9773 59.6583 40.1884 175.6383 134 I 4.3632 8.7455 125.7578 61.6325 38.2670 175.1776 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 -2 H 8.44 4.87 0.00 3.29 3.61 0.00 5.80 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 -1 V 8.15 4.51 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 0.82 0.00 0.00 0.95 0.00 0.00 -1 K 8.41 4.71 0.00 1.87 1.48 0.00 1.10 0.00 0.00 1.73 0.00 0.00 2.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.06 7.81 2 P 0.00 4.27 0.00 2.40 1.97 0.00 2.20 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.85 0.00 3 P 0.00 4.21 0.00 2.10 2.10 0.00 3.72 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 1.93 1.90 0.00 4 Q 7.94 4.04 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 1.51 1.89 0.00 5 F 7.47 4.79 0.00 2.84 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 6 T 8.80 4.22 4.33 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 1.28 0.00 0.00 7 W 8.60 4.34 0.00 3.51 3.33 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 8 A 8.20 4.83 1.54 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 0.00 0.00 9 Q 8.37 4.07 0.00 2.59 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 10 W 8.84 4.14 0.00 3.17 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 8.83 3.94 0.00 3.29 3.40 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 12 E 8.69 4.08 0.00 2.31 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 0.00 2.32 2.45 0.00 13 T 7.73 3.84 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 1.15 0.00 0.00 14 Q 7.39 3.53 0.00 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 15 H 7.81 4.70 0.00 2.04 2.65 0.00 5.56 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.71 4.19 2.10 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 1.41 1.20 1.08 0.00 0.00 17 N 8.11 4.53 0.00 2.71 2.79 0.00 0.00 7.08 7.31 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 18 M 7.67 3.55 0.00 1.67 1.37 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 1.00 2.06 0.00 19 T 7.97 3.95 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 1.25 0.00 0.00 20 S 7.00 4.58 0.00 3.78 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 21 Q 8.56 4.02 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 22 Q 7.70 4.61 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 23 C 9.25 4.18 0.00 3.04 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 24 T 7.93 4.02 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 1.33 0.00 0.00 25 N 8.09 4.46 0.00 2.81 2.82 0.00 0.00 6.99 7.05 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 26 A 8.06 3.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.36 4.03 0.00 1.44 1.63 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.44 0.00 28 Q 7.79 4.00 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 29 V 7.49 3.52 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 1.24 0.00 0.00 0.94 0.00 0.00 30 I 7.75 3.87 1.84 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.48 0.88 0.00 0.00 31 N 8.47 4.77 0.00 2.86 2.99 0.00 0.00 6.58 7.75 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 32 N 8.38 4.35 0.00 2.74 2.72 0.00 0.00 7.09 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 33 Y 7.87 4.52 0.00 3.46 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.62 4.18 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.98 2.89 0.00 35 R 8.43 3.95 0.00 1.99 2.06 0.00 3.60 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 36 R 7.49 4.50 0.00 1.98 2.01 0.00 3.00 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 37 C 8.65 4.97 0.00 3.03 3.20 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 38 K 9.09 4.36 0.00 1.84 1.84 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.45 7.81 39 N 8.86 4.61 0.00 2.88 2.84 0.00 0.00 6.55 7.63 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 40 Q 7.91 5.18 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.41 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 41 N 9.16 4.83 0.00 2.67 2.30 0.00 0.00 7.12 6.75 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 42 T 8.34 4.98 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 43 F 9.00 4.98 0.00 2.84 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.62 4.41 0.00 1.36 1.43 0.05 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.41 4.46 0.00 1.61 1.63 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.39 4.67 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 1.20 0.00 0.00 47 T 8.09 4.58 4.33 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 1.26 0.00 0.00 48 F 8.82 4.05 0.00 3.18 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 49 A 8.25 3.89 1.47 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 0.00 0.00 50 N 8.09 4.31 0.00 3.00 2.93 0.00 0.00 6.66 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 51 V 7.63 3.70 1.89 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 0.97 0.00 0.00 1.04 0.00 0.00 52 V 7.16 3.24 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 0.83 0.00 0.00 -0.07 0.00 0.00 53 N 8.15 4.43 0.00 2.90 2.84 0.00 0.00 6.70 7.04 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 54 V 7.86 3.56 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 1.05 0.00 0.00 0.92 0.00 0.00 55 C 7.98 4.03 0.00 3.04 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 56 G 7.72 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 57 N 7.55 4.68 0.00 2.85 2.77 0.00 0.00 6.96 8.35 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 58 P 0.00 4.38 0.00 2.01 1.97 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 59 N 8.51 4.72 0.00 2.56 2.85 0.00 0.00 6.73 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 60 M 8.91 4.87 0.00 1.93 2.05 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 2.41 2.57 0.00 61 T 8.33 4.31 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 1.23 0.00 0.00 62 C 9.02 4.45 0.00 3.16 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 63 P 0.00 4.10 0.00 2.04 2.12 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 64 S 8.53 4.47 0.00 3.96 4.06 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 0.00 0.00 0.00 0.00 65 N 7.94 4.99 0.00 2.70 2.64 0.00 0.00 6.78 6.74 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 66 K 8.10 4.10 0.00 1.89 1.93 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.42 7.81 67 T 7.87 4.22 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 1.20 0.00 0.00 68 R 8.06 4.63 0.00 2.00 2.00 0.00 3.20 0.00 0.00 3.06 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 69 K 8.53 4.90 0.00 1.61 1.69 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.27 1.40 7.81 70 N 8.12 4.92 0.00 2.97 2.98 0.00 0.00 6.06 7.68 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 71 C 7.71 5.34 0.00 3.04 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 72 H 8.70 5.25 0.00 3.02 3.23 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 H 8.82 4.99 0.00 3.10 3.03 0.00 5.67 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.27 3.65 0.00 3.35 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 75 G 8.17 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 0.00 0.00 0.00 0.00 76 S 7.43 5.12 0.00 3.88 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 77 Q 8.26 3.99 0.00 1.67 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.82 0.00 0.00 0.00 0.00 0.00 1.16 1.23 0.00 78 V 8.58 4.62 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 0.92 0.00 0.00 1.17 0.00 0.00 79 P 0.00 5.06 0.00 2.06 1.95 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 80 L 8.95 4.97 0.00 1.78 1.69 0.70 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.84 5.04 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 1.22 0.80 0.96 0.00 0.00 82 H 9.26 5.21 0.00 3.09 3.21 0.00 5.59 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 9.38 5.48 0.00 2.88 2.99 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 84 N 9.04 5.65 0.00 2.75 2.70 0.00 0.00 6.28 6.68 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 85 L 8.94 3.47 0.00 1.61 1.59 0.43 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.63 4.35 4.19 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 0.00 0.00 0.00 1.26 0.00 0.00 87 T 7.38 4.45 4.17 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 1.18 0.00 0.00 88 P 0.00 4.52 0.00 1.91 1.96 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 89 S 7.89 4.70 0.00 3.80 3.70 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 P 0.00 4.35 0.00 2.23 2.18 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 91 Q 7.93 4.40 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.19 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 92 N 8.07 4.95 0.00 2.70 2.63 0.00 0.00 7.09 7.42 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 93 I 8.14 3.92 1.90 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 1.50 1.06 0.96 0.00 0.00 94 S 8.08 4.23 0.00 3.98 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 95 N 8.16 4.74 0.00 2.86 2.89 0.00 0.00 7.00 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 96 C 7.93 5.30 0.00 3.12 3.04 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 97 R 8.45 5.01 0.00 1.67 1.78 0.00 3.06 0.00 0.00 3.32 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 98 Y 8.92 5.09 0.00 2.90 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 99 A 9.06 4.70 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 0.00 100 Q 8.47 5.12 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 101 T 8.94 4.69 4.33 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 1.26 0.00 0.00 102 P 0.00 4.98 0.00 2.07 2.04 0.00 3.82 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 1.99 1.97 0.00 103 A 8.64 4.56 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 0.00 104 N 8.55 5.39 0.00 2.55 2.62 0.00 0.00 6.57 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 0.00 105 M 8.67 4.61 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 106 F 8.78 4.88 0.00 3.05 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 0.00 107 Y 8.61 5.41 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.98 5.09 1.92 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 0.72 0.93 0.00 0.00 109 V 8.84 5.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.82 0.00 0.00 110 A 8.79 5.01 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 0.00 111 C 9.01 5.41 0.00 2.75 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 0.00 112 D 8.90 4.93 0.00 2.52 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.76 4.98 0.00 2.64 2.79 0.00 0.00 6.92 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 0.00 114 R 8.69 4.23 0.00 2.02 2.19 0.00 3.33 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 115 D 9.49 4.46 0.00 2.84 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 0.00 116 Q 8.97 3.97 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 117 R 8.13 4.14 0.00 1.82 1.94 0.00 3.23 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 118 R 8.28 4.55 0.00 1.94 1.90 0.00 3.15 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 119 D 7.88 4.78 0.00 2.97 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 0.00 120 P 0.00 4.44 0.00 2.22 2.19 0.00 3.79 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 2.21 2.01 0.00 121 P 0.00 4.39 0.00 2.19 2.23 0.00 3.80 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 122 Q 8.14 3.81 0.00 1.82 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.04 0.00 0.00 0.00 0.00 0.00 1.16 1.94 0.00 123 Y 7.67 4.88 0.00 3.17 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 0.00 124 P 0.00 4.54 0.00 2.15 2.35 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 125 V 7.35 4.86 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 0.74 0.00 0.00 0.94 0.00 0.00 126 V 8.78 4.57 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 0.89 0.00 0.00 1.03 0.00 0.00 127 P 0.00 4.46 0.00 0.49 1.45 0.00 3.24 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.14 0.00 128 V 8.63 4.57 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.92 0.00 0.00 129 H 7.84 5.05 0.00 3.01 3.08 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.68 4.67 0.00 1.43 1.35 0.91 0.84 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 0.00 131 D 9.05 4.58 0.00 2.74 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 0.00 132 R 7.76 4.70 0.00 1.96 1.73 0.00 3.25 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 133 I 8.43 5.04 1.96 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 1.39 1.14 1.08 0.00 0.00 134 I 8.75 4.36 2.07 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 1.15 0.71 1.00 0.00 0.00