NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4769 8.3049 120.3224 55.8272 32.6779 175.2617 2 T 4.3216 7.5828 122.0638 62.0902 69.3481 174.2414 3 T 3.8860 7.8081 118.0147 64.2515 69.7478 173.4250 4 F 4.7812 8.3752 120.4377 54.6722 41.1075 174.4007 5 R 4.1770 7.6138 119.4155 54.2963 33.4146 174.7263 6 F 5.1496 7.9641 119.6448 55.4432 41.7906 175.2280 7 C 3.1807 8.3331 121.5647 59.7648 32.0355 174.9080 8 R 3.8287 6.9794 124.7953 59.5387 29.5648 177.1108 9 D 4.4528 7.3073 117.2172 56.4691 41.0117 176.7545 10 C 4.1790 8.0752 121.7627 59.2272 30.8640 173.6013 11 N 4.2554 7.8378 116.7369 54.4931 36.8645 172.9442 12 N 4.9740 7.7777 114.6313 51.7329 41.9641 173.7167 13 M 4.7343 8.6906 118.9558 55.4947 33.2961 175.7854 14 L 4.9626 7.9556 124.5964 53.9083 43.1494 175.6368 15 Y 5.0764 9.2506 120.5104 55.3085 41.3911 173.3235 16 P 3.9064 0.0000 0.0000 62.7538 32.0723 175.8496 17 R 4.6892 8.5116 121.7690 54.2662 34.6339 173.6259 18 E 4.6786 8.5657 122.3587 54.9555 31.3685 175.9025 19 D 4.5781 9.1347 127.2710 52.9736 40.0612 176.4531 20 K 3.8498 8.6153 125.4000 59.4255 32.0247 178.4836 21 E 4.0308 7.7927 116.7357 59.4991 29.6524 177.5388 22 N 4.5037 8.3240 115.4304 53.2520 39.3888 175.1261 23 N 4.1877 7.9200 115.7579 53.5431 36.0584 172.1502 24 R 4.6453 7.1949 115.8519 55.0132 34.4921 174.5776 25 L 4.8825 8.4301 120.7551 53.7129 43.8307 175.8040 26 L 4.8198 9.0156 127.7095 54.1637 44.7106 176.5326 27 F 5.4390 8.5738 117.4431 56.6188 41.3936 174.3790 28 E 4.4651 8.9747 120.8345 56.3012 31.1420 176.2624 29 C 5.0264 8.9665 121.9028 58.5128 33.0108 173.3469 30 R 4.5947 8.7387 117.5967 56.1881 28.7541 176.1471 31 T 4.2929 7.1841 112.9442 65.4821 70.7595 177.4648 32 C 4.5137 7.7442 120.6277 58.5118 31.4762 173.8416 33 S 4.6479 8.4550 114.6531 58.6120 62.8786 173.8528 34 Y 4.3590 7.8502 122.9362 58.5996 39.5269 175.4290 35 V 5.2485 7.3206 122.8797 60.5174 34.4364 173.1338 36 E 4.8912 8.9463 120.5311 54.0540 33.1413 174.8094 37 E 4.4271 8.9562 119.2764 56.7715 30.3135 176.3391 38 A 4.3000 9.0376 124.2287 53.2657 19.3212 176.6718 39 G 3.5251 9.2168 111.5831 47.0261 0.0000 175.9033 40 S 4.4209 9.0049 112.9663 57.4190 64.6476 173.1081 41 P 4.5313 0.0000 0.0000 62.6718 31.4907 175.6186 42 L 4.2038 7.3973 121.6627 54.9739 41.6302 176.2521 43 V 4.1661 8.4188 126.5153 64.4693 32.3172 175.2671 44 Y 4.9216 7.6070 118.0100 56.0656 41.7350 173.6997 45 R 4.1445 7.2277 124.4314 54.9667 33.1024 173.7619 46 H 4.4720 8.2638 124.1574 54.2884 30.8391 173.0449 47 E 4.2447 8.3984 127.6705 54.8889 28.4093 177.0171 48 L 3.8776 8.3247 123.4827 57.3142 41.8623 178.8388 49 I 4.2057 7.3573 124.4259 60.0134 36.5151 175.6325 50 T 4.4296 8.0014 121.5763 62.8127 70.1135 174.2207 51 N 4.7987 8.1614 115.1349 54.8982 40.6575 175.2721 52 I 3.7591 7.8216 117.3384 62.4046 37.9756 174.4325 53 G 3.8497 9.1069 116.2462 46.0070 0.0000 175.5386 54 E 4.0160 8.4397 120.5175 59.2941 29.7429 179.1895 55 T 3.9138 7.8283 114.6465 65.1309 69.1905 174.4040 56 A 3.8456 7.0619 124.0829 53.4340 18.3308 176.0697 57 G 3.2617 8.8696 113.0861 45.7169 0.0000 173.8055 58 V 3.6348 7.2788 119.9739 63.0905 30.7596 175.0696 59 V 4.4417 7.8074 126.4232 60.3602 34.0243 176.1895 60 Q 4.1177 8.6874 124.3085 58.3662 28.9627 176.7585 61 D 4.8644 7.7907 115.1617 54.0676 42.5939 177.5495 62 I 3.4370 7.6430 120.0113 64.3283 37.5905 177.2872 63 G 3.8325 8.0252 105.0486 47.0022 0.0000 175.5367 64 S 4.5111 8.6477 116.4720 60.0698 63.4791 173.3707 65 D 4.3385 7.6255 120.8496 53.7755 40.2377 174.7593 66 P 4.3697 0.0000 0.0000 65.3472 31.7382 178.1049 67 T 4.0093 7.8807 108.1317 63.6011 69.1608 174.9457 68 L 4.0441 7.4137 122.6351 53.8657 42.3109 174.9136 69 P 4.4358 0.0000 0.0000 62.5019 33.0869 175.1008 70 R 5.2684 8.6677 119.7916 53.6220 33.0179 174.9817 71 S 5.1092 9.2099 118.5857 56.0538 66.8741 173.3712 72 D 5.6259 8.2669 117.2450 53.1199 39.4413 176.0393 73 R 4.1708 7.9783 118.5944 57.0516 31.2373 175.1214 74 E 4.5404 8.0990 118.3976 54.4405 31.3872 175.9331 75 C 2.8661 8.1115 118.9777 56.7006 30.2602 174.1243 76 P 4.4724 0.0000 0.0000 61.8361 30.4732 177.1926 77 K 4.4472 8.6583 117.0845 57.6498 37.1539 177.2928 78 C 4.6495 7.4229 109.0491 56.9019 30.7045 174.4063 79 H 4.0179 8.1579 115.0100 56.3985 26.3313 174.7980 80 S 4.3126 7.7165 115.3917 58.4709 63.2726 174.6245 81 R 4.6157 8.3914 123.0976 56.1891 30.5377 177.3022 82 E 4.5670 7.7248 119.3694 54.9985 28.1213 174.9289 83 N 6.0004 8.9043 120.1200 50.5286 43.0676 174.4547 84 V 4.8178 8.3325 119.7926 60.4499 34.2092 173.8029 85 F 5.1610 8.7700 121.5487 54.7763 39.9481 174.8792 86 F 4.9998 8.0099 115.4416 55.3285 41.7820 173.7688 87 Q 4.8226 8.7336 118.2338 54.7968 29.5885 175.5497 88 S 3.6874 8.4230 115.4325 59.1980 62.5923 175.5720 89 Q 4.0922 8.2454 126.0906 58.0904 28.8190 177.1163 90 Q 4.0895 6.9865 113.5225 56.6775 29.3324 177.1923 91 R 4.6658 8.1776 118.8483 55.7801 30.9028 176.5672 92 R 4.3761 7.2423 115.5501 55.3622 31.6406 177.8798 93 K 4.1658 8.6414 120.0399 59.8907 32.2446 180.4160 94 D 4.8836 7.8746 116.9137 53.6312 39.0571 176.1220 95 T 4.4480 7.8147 116.4716 63.3464 69.9511 175.3184 96 S 4.5299 8.3152 119.0843 58.2757 64.3175 173.4379 97 M 4.4228 8.3110 117.3093 55.2024 31.7312 176.4842 98 V 3.5448 7.8321 119.5682 63.9918 32.4601 175.1132 99 L 4.5137 9.0168 128.1456 54.0313 43.4944 175.6371 100 F 4.7254 9.0163 121.1419 55.5060 41.9877 174.5072 101 F 4.9451 8.6765 121.6085 55.4357 42.3804 174.4754 102 V 4.8500 8.1650 121.5320 60.9799 34.1326 174.2737 103 C 4.6991 9.5545 129.6770 59.8052 32.1578 173.5300 104 L 4.4469 9.0206 125.9191 55.6205 41.4081 177.7637 105 S 4.5178 8.2750 115.4327 60.1994 63.7664 174.8881 106 C 4.7120 8.0636 110.9151 56.7625 29.7918 173.3919 107 S 4.3878 7.9184 111.9968 58.6717 61.7199 171.2805 108 H 4.9569 8.1338 119.2646 56.1223 31.6511 173.6061 109 I 5.2722 8.6669 127.0029 60.1930 38.0613 174.8924 110 F 4.9402 8.1902 120.9949 55.2624 41.9108 173.4182 111 T 4.8896 8.2526 113.7164 61.8934 71.6061 174.7736 112 S 4.4579 8.6864 118.6354 59.6332 64.2500 173.8967 113 D 4.2572 8.0166 120.2107 55.0867 40.8337 175.9755 114 Q 4.2524 8.6726 124.8666 56.9708 29.5667 176.3850 115 K 4.5121 7.7990 118.8799 55.4918 32.0829 177.2104 116 N 4.4793 8.1358 116.3129 53.9023 39.0035 175.2961 117 K 4.3674 8.7511 122.6073 57.1643 34.1812 177.0924 118 R 4.3729 7.7311 116.0353 55.5236 31.5543 175.7984 119 T 4.0983 8.0152 114.5507 64.5329 69.9628 175.8646 120 Q 4.2025 7.5308 118.4848 55.1560 29.9701 177.0846 121 F 4.1962 7.7408 113.5330 57.7631 37.0137 175.0526 122 S 4.4083 7.7281 119.7501 58.5710 62.9462 173.9637 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.48 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 T 7.58 4.32 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 1.31 0.00 0.00 3 T 7.81 3.89 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 1.10 0.00 0.00 4 F 8.38 4.78 0.00 2.82 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 5 R 7.61 4.18 0.00 1.40 1.57 0.00 2.96 0.00 0.00 3.36 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.23 0.00 6 F 7.96 5.15 0.00 2.79 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 7 C 8.33 3.18 0.00 2.78 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 8 R 6.98 3.83 0.00 1.90 2.09 0.00 3.38 0.00 0.00 3.40 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 9 D 7.31 4.45 0.00 2.75 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 C 8.08 4.18 0.00 3.09 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 11 N 7.84 4.26 0.00 2.77 2.85 0.00 0.00 7.30 7.79 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 12 N 7.78 4.97 0.00 2.80 2.89 0.00 0.00 6.61 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 13 M 8.69 4.73 0.00 1.86 2.11 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.27 0.00 14 L 7.96 4.96 0.00 1.56 1.77 0.84 1.14 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 15 Y 9.25 5.08 0.00 2.94 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 16 P 0.00 3.91 0.00 1.72 1.17 0.00 3.87 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.98 0.00 17 R 8.51 4.69 0.00 1.67 1.78 0.00 3.25 0.00 0.00 3.11 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.90 0.00 18 E 8.57 4.68 0.00 1.93 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 0.00 2.30 2.27 0.00 19 D 9.13 4.58 0.00 2.71 2.55 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 20 K 8.62 3.85 0.00 1.77 1.87 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.47 7.81 21 E 7.79 4.03 0.00 1.95 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 0.00 2.31 2.33 0.00 22 N 8.32 4.50 0.00 2.95 2.85 0.00 0.00 7.26 7.89 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 23 N 7.92 4.19 0.00 2.87 2.83 0.00 0.00 6.70 7.77 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 24 R 7.19 4.65 0.00 1.83 2.00 0.00 2.94 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 25 L 8.43 4.88 0.00 1.74 1.57 0.76 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 L 9.02 4.82 0.00 1.72 1.63 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.57 5.44 0.00 3.23 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 28 E 8.97 4.47 0.00 2.19 2.17 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 2.60 2.40 0.00 29 C 8.97 5.03 0.00 3.17 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.74 4.59 0.00 1.88 1.92 0.00 2.21 0.00 0.00 2.82 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 31 T 7.18 4.29 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 32 C 7.74 4.51 0.00 3.16 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 33 S 8.46 4.65 0.00 3.92 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 34 Y 7.85 4.36 0.00 3.15 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 35 V 7.32 5.25 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 0.74 0.00 0.00 0.95 0.00 0.00 36 E 8.95 4.89 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.42 0.00 37 E 8.96 4.43 0.00 2.04 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 2.32 2.38 0.00 38 A 9.04 4.30 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 39 G 9.22 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 40 S 9.00 4.42 0.00 4.02 3.92 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 0.00 0.00 0.00 0.00 41 P 0.00 4.53 0.00 2.22 2.21 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 42 L 7.40 4.20 0.00 1.78 1.69 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.42 4.17 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 0.90 0.00 0.00 0.93 0.00 0.00 44 Y 7.61 4.92 0.00 2.84 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 45 R 7.23 4.14 0.00 1.60 1.53 0.00 3.21 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 46 H 8.26 4.47 0.00 2.87 3.14 0.00 5.97 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 47 E 8.40 4.24 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 48 L 8.32 3.88 0.00 1.58 1.68 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.36 4.21 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 1.41 0.54 0.92 0.00 0.00 50 T 8.00 4.43 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 1.25 0.00 0.00 51 N 8.16 4.80 0.00 2.83 2.88 0.00 0.00 6.99 7.27 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 52 I 7.82 3.76 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.63 0.92 0.00 0.00 53 G 9.11 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 54 E 8.44 4.02 0.00 2.07 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 2.32 2.56 0.00 55 T 7.83 3.91 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 1.29 0.00 0.00 56 A 7.06 3.85 1.24 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 0.00 0.00 0.00 57 G 8.87 3.26 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 0.00 58 V 7.28 3.63 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 0.84 0.00 0.00 1.21 0.00 0.00 59 V 7.81 4.44 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 0.95 0.00 0.00 0.94 0.00 0.00 60 Q 8.69 4.12 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 61 D 7.79 4.86 0.00 2.70 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 62 I 7.64 3.44 1.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.28 1.04 0.00 0.00 63 G 8.03 3.83 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 0.00 64 S 8.65 4.51 0.00 3.99 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 65 D 7.63 4.34 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 66 P 0.00 4.37 0.00 2.20 2.15 0.00 3.79 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 67 T 7.88 4.01 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 1.18 0.00 0.00 68 L 7.41 4.04 0.00 1.87 1.57 1.01 0.88 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 69 P 0.00 4.44 0.00 0.97 1.77 0.00 3.40 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.22 0.00 70 R 8.67 5.27 0.00 1.71 1.99 0.00 3.23 0.00 0.00 2.25 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 71 S 9.21 5.11 0.00 3.96 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 0.00 72 D 8.27 5.63 0.00 2.78 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 73 R 7.98 4.17 0.00 1.70 1.73 0.00 2.46 0.00 0.00 2.91 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.51 0.00 74 E 8.10 4.54 0.00 1.81 1.77 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 2.26 2.20 0.00 75 C 8.11 2.87 0.00 2.88 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 76 P 0.00 4.47 0.00 2.00 2.03 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.88 0.00 77 K 8.66 4.45 0.00 1.46 1.66 0.00 1.33 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.10 7.81 78 C 7.42 4.65 0.00 3.03 3.06 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 79 H 8.16 4.02 0.00 3.29 3.49 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.72 4.31 0.00 4.06 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 81 R 8.39 4.62 0.00 1.84 2.01 0.00 3.28 0.00 0.00 2.25 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 82 E 7.72 4.57 0.00 1.96 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 0.00 2.31 2.46 0.00 83 N 8.90 6.00 0.00 3.09 2.94 0.00 0.00 6.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.33 4.82 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 0.91 0.00 0.00 0.98 0.00 0.00 85 F 8.77 5.16 0.00 2.05 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 86 F 8.01 5.00 0.00 2.99 3.02 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 87 Q 8.73 4.82 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.89 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 88 S 8.42 3.69 0.00 4.07 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 89 Q 8.25 4.09 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.56 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 90 Q 6.99 4.09 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.42 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 91 R 8.18 4.67 0.00 1.75 1.88 0.00 3.35 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 92 R 7.24 4.38 0.00 1.94 2.02 0.00 3.18 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 93 K 8.64 4.17 0.00 1.82 1.86 0.00 1.67 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.43 7.81 94 D 7.87 4.88 0.00 2.79 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 95 T 7.81 4.45 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 96 S 8.32 4.53 0.00 4.00 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 97 M 8.31 4.42 0.00 2.04 2.12 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 2.57 2.53 0.00 98 V 7.83 3.54 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 0.87 0.00 0.00 0.91 0.00 0.00 99 L 9.02 4.51 0.00 0.96 0.80 0.44 0.89 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 0.00 100 F 9.02 4.73 0.00 1.94 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 0.00 0.00 0.00 0.00 101 F 8.68 4.95 0.00 1.51 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 0.00 102 V 8.16 4.85 2.21 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 1.05 0.00 0.00 1.17 0.00 0.00 103 C 9.55 4.70 0.00 3.29 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 0.00 104 L 9.02 4.45 0.00 1.67 1.74 0.97 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.28 4.52 0.00 3.89 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 0.00 106 C 8.06 4.71 0.00 3.08 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 0.00 107 S 7.92 4.39 0.00 4.17 4.08 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 0.00 108 H 8.13 4.96 0.00 3.36 3.36 0.00 5.85 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.67 5.27 1.96 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.70 1.02 0.00 0.00 110 F 8.19 4.94 0.00 3.03 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 0.00 111 T 8.25 4.89 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 112 S 8.69 4.46 0.00 3.94 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 0.00 113 D 8.02 4.26 0.00 2.52 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 0.00 114 Q 8.67 4.25 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.31 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 115 K 7.80 4.51 0.00 1.91 1.81 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.39 7.81 116 N 8.14 4.48 0.00 2.77 2.90 0.00 0.00 7.06 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.75 4.37 0.00 1.74 1.84 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.36 1.59 7.81 118 R 7.73 4.37 0.00 1.72 1.69 0.00 3.20 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 119 T 8.02 4.10 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 1.13 0.00 0.00 120 Q 7.53 4.20 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.06 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 121 F 7.74 4.20 0.00 3.39 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 0.00 122 S 7.73 4.41 0.00 4.06 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