NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3067 8.3344 115.4123 57.8747 64.2035 173.5150 2 M 3.9400 8.3537 121.1854 55.4927 30.4562 174.8448 3 Q 3.9346 8.4600 124.6400 57.6040 30.3605 175.9243 4 D 4.7152 7.6565 123.2844 51.8781 41.2488 174.4814 5 P 4.4084 0.0000 0.0000 65.6213 32.2443 178.7264 6 I 3.6355 8.1497 120.0225 64.1913 36.9078 177.7429 7 A 3.9277 7.8093 120.2876 55.5791 18.0318 179.0161 8 D 4.3223 7.6441 116.2770 57.1970 40.6858 178.3270 9 M 3.9942 8.0954 118.5077 58.5020 32.1662 178.2000 10 L 4.0036 7.6626 119.0995 57.4127 41.4530 179.3239 11 T 3.7592 8.0372 109.9399 65.0196 68.9355 176.6946 12 R 3.9148 8.1753 122.1920 58.9321 30.1216 179.1143 13 I 3.6837 7.3824 118.3167 64.2136 37.2605 178.5763 14 R 3.7766 7.7730 119.4649 59.6469 29.8333 178.4106 15 N 4.6000 9.2523 115.1082 55.6481 38.6606 177.6498 16 G 3.7190 8.1311 107.6516 47.9294 0.0000 175.8529 17 Q 4.1568 7.9326 119.0484 57.2907 28.7633 177.8392 18 A 4.5064 7.4187 119.2264 52.3103 19.7613 177.4417 19 A 4.5480 8.3188 120.1328 51.3713 19.3372 177.1297 20 N 4.3952 8.4848 111.6227 53.6833 35.2974 174.6613 21 K 3.8364 7.8180 117.8816 56.8864 32.7428 177.9145 22 A 4.3105 8.7915 126.2217 55.1614 18.9417 176.0299 23 A 5.1084 6.7836 114.3383 53.6999 22.9080 175.9890 24 V 4.2332 7.9444 110.9929 61.8266 34.9171 171.9406 25 T 5.1403 8.3644 117.0287 60.4442 69.7937 173.0319 26 M 4.4636 7.5823 121.4626 53.7861 34.6590 172.7713 27 P 4.7463 0.0000 0.0000 63.1810 31.8344 176.2816 28 S 4.5870 9.1795 120.8348 57.8148 64.4260 173.6483 29 S 4.6982 8.5605 112.1104 57.4424 65.3104 178.9260 30 K 4.4581 7.3240 123.7849 58.8001 33.1574 177.7716 31 L 3.8715 7.7809 119.9381 58.2878 42.1522 178.8394 32 K 3.8091 7.3537 115.7188 59.6653 32.1237 179.1234 33 V 3.6238 8.1966 118.3264 65.7692 31.7757 177.6073 34 A 3.9659 8.1162 120.6402 55.6702 18.1620 179.5934 35 I 3.5832 8.1346 118.0504 64.4398 37.1328 178.2540 36 A 3.6165 7.8169 121.7794 55.0339 17.7848 178.7338 37 N 4.2510 7.8187 115.1504 57.3261 38.5789 177.4016 38 V 3.6627 7.6726 119.5853 64.8430 31.0980 178.0763 39 L 4.3080 8.0219 119.6801 57.3506 40.8803 179.2962 40 K 4.1580 8.6907 119.9038 59.0795 32.1091 177.8955 41 E 4.4282 8.3824 116.0470 56.8355 29.5189 176.8128 42 E 4.2598 7.3578 116.2596 55.2940 30.9566 175.8333 43 G 3.5522 7.5221 105.2549 46.5289 0.0000 173.9775 44 F 5.2959 7.9831 112.2757 56.9410 41.9735 177.0544 45 I 4.6157 7.6921 110.4241 59.4727 39.7837 174.7843 46 E 4.1378 9.0050 125.3031 58.9037 29.9447 176.2905 47 D 4.6772 8.3043 116.4191 55.1226 46.6361 174.1230 48 F 5.3792 8.3598 112.1367 56.7106 40.8284 173.3878 49 K 4.2649 9.1342 118.4390 55.4868 36.1531 174.3301 50 V 4.5705 8.4912 127.5598 59.8688 32.1168 175.0047 51 E 4.5525 8.7098 130.7851 55.9803 32.1276 175.4386 52 G 4.6467 9.1142 117.3179 45.7542 0.0000 173.8032 53 D 4.5543 8.5026 122.5794 54.0889 37.5909 179.3827 54 T 3.7730 6.0203 115.4147 63.4453 67.9277 173.4932 55 K 4.3883 7.4954 121.6616 53.6365 31.9640 171.2370 56 P 5.3305 0.0000 0.0000 62.5242 32.0841 176.2339 57 E 4.1903 8.5292 126.6402 56.4284 32.7144 175.7156 58 L 4.7798 7.9845 118.0108 54.8484 44.4684 174.0514 59 E 4.3299 9.4924 124.5864 56.0686 31.0641 175.5591 60 L 5.1862 8.7906 125.9898 53.5642 45.5603 175.0300 61 T 4.8269 8.8650 118.1857 60.8590 70.2643 174.9948 62 L 4.6147 8.6618 126.7027 54.3866 43.0251 176.1643 63 K 4.7910 8.1789 120.2449 55.1792 34.6782 174.8968 64 Y 4.9923 8.9319 123.3226 56.3234 42.6165 175.6494 65 F 5.2638 7.9582 123.3828 57.9487 39.3788 176.5916 66 Q 3.0809 8.3526 111.6598 58.6998 28.3647 177.1048 67 G 3.9202 8.3175 108.0730 47.5267 0.0000 174.2326 68 K 4.4769 7.7417 118.9738 54.5520 34.1033 177.7054 69 A 4.4236 8.2633 123.7555 52.2715 17.6087 178.6083 70 V 4.3520 8.0864 104.4389 61.6298 34.0185 176.1621 71 V 4.0472 7.4762 112.7059 59.1875 30.6639 174.7497 72 E 4.0149 8.6899 126.0229 58.4809 29.6228 177.6001 73 S 4.3095 7.0358 106.8280 57.4437 64.9354 175.2830 74 I 4.3648 8.0533 127.1790 57.9408 38.7053 173.5402 75 Q 4.6126 7.4463 129.4192 53.5371 32.0700 174.5050 76 R 4.0206 8.4145 123.9164 56.7091 30.5609 175.9486 77 V 4.2247 8.7998 121.7827 64.2095 33.6356 176.5944 78 S 4.6613 7.6823 112.3157 57.4029 62.6877 173.9179 79 R 3.9743 8.0277 114.5801 55.1645 29.1844 173.8864 80 P 4.4183 0.0000 0.0000 62.8379 32.0898 176.0251 81 G 4.6246 8.6055 103.2925 44.9629 0.0000 173.5805 82 L 5.7106 6.7736 130.4030 55.1603 45.8241 174.3409 83 R 4.1528 7.9593 116.9408 56.6121 30.9374 176.6189 84 I 4.7089 7.7952 122.3316 59.7902 39.6186 174.6745 85 Y 4.8271 8.5081 120.4780 56.4826 41.7330 174.2470 86 K 4.6670 8.3202 119.0541 55.6684 36.5512 175.7352 87 R 4.6563 7.8557 117.8403 54.1369 32.2124 177.8186 88 K 4.1193 8.9013 120.3255 58.7461 32.2022 176.8114 89 D 4.8124 7.7375 116.5517 52.8244 40.2284 176.5850 90 E 4.6591 7.9735 118.7144 56.8155 31.2344 173.7533 91 L 4.9044 7.9245 123.3174 51.6491 45.9879 174.4351 92 P 4.5194 0.0000 0.0000 62.8326 32.1146 175.7014 93 K 4.1336 8.2216 117.6904 56.0264 34.2458 172.6584 94 V 2.9662 7.8392 126.1852 63.3642 31.6482 171.3248 95 M 3.2889 9.5582 125.6680 56.0227 29.6272 176.4571 96 A 3.6461 9.0819 116.7595 53.7900 16.1962 178.3713 97 G 4.2626 8.6234 110.9648 47.8325 0.0000 177.1331 98 L 3.7512 7.9920 118.4627 56.6439 41.7368 177.1256 99 G 4.8148 7.4376 105.6674 44.5094 0.0000 171.6774 100 I 4.7898 7.8819 108.9341 58.8812 41.5078 174.7713 101 A 5.2896 8.3003 122.9602 48.7677 20.9902 176.0108 102 V 3.7010 8.4609 114.2800 63.2894 32.8472 175.8393 103 V 4.5667 8.2566 124.3642 60.8034 33.9438 175.1712 104 S 4.2902 9.0564 124.9485 58.9411 63.0214 173.5981 105 T 4.8956 8.9858 118.9871 59.9395 71.0046 175.7995 106 S 4.2377 8.7992 115.3521 60.2707 62.4664 174.4415 107 K 4.3951 8.6520 117.9269 55.7245 32.4535 174.9245 108 G 4.0134 7.0807 106.1675 43.4596 0.0000 174.2802 109 V 4.2524 7.7585 120.3889 61.8782 30.5238 176.1974 110 M 4.5067 7.8640 127.1731 54.3490 34.5859 173.5231 111 T 5.1342 7.9693 110.4805 60.7631 71.4165 172.5492 112 D 4.3506 8.3648 118.9024 57.5227 39.0735 178.2294 113 R 3.9811 7.7947 119.4356 58.2680 30.4046 178.1889 114 A 3.9706 7.8471 120.1588 55.3591 18.1196 179.5845 115 A 3.9225 7.9227 118.3617 55.3894 18.3464 179.6582 116 R 3.8452 7.2519 113.7902 59.6747 30.3084 178.3366 117 Q 4.0988 8.1389 117.7281 59.5961 29.0410 178.6365 118 A 4.1859 7.4737 120.1078 53.9518 18.4381 178.4515 119 G 3.9496 8.2436 104.0863 45.4341 0.0000 173.2641 120 L 4.5908 7.7086 120.2995 53.7661 43.5006 177.7057 121 G 4.0100 8.6190 105.5521 46.6209 0.0000 175.4738 122 G 3.6330 7.2187 101.6519 47.9121 0.0000 174.4813 123 E 4.3353 8.0728 117.4874 54.5169 32.4587 175.1425 124 I 4.1202 8.4307 127.0036 61.5124 38.8366 175.2232 125 I 4.3089 8.6543 124.9645 61.5177 39.8702 175.3781 126 C 5.0596 6.8914 113.6243 58.1114 31.2248 171.3459 127 Y 5.3380 7.3988 116.4998 55.3918 40.1630 174.6684 128 V 4.6317 8.6131 112.3166 58.7937 37.0230 175.8132 129 A 4.3402 8.1197 121.4760 52.6504 18.4122 177.7200 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 S 8.33 4.31 0.00 3.99 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 2 M 8.35 3.94 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 3 Q 8.46 3.93 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.64 0.00 0.00 0.00 0.00 0.00 2.53 2.29 0.00 4 D 7.66 4.72 0.00 2.61 2.57 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 5 P 0.00 4.41 0.00 2.24 2.27 0.00 3.74 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 2.05 1.97 0.00 6 I 8.15 3.64 2.01 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 1.40 0.45 0.86 0.00 0.00 7 A 7.81 3.93 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 8 D 7.64 4.32 0.00 2.85 2.67 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 0.00 0.00 0.00 0.00 9 M 8.10 3.99 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 10 L 7.66 4.00 0.00 1.79 1.73 0.79 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.04 3.76 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 1.26 0.00 0.00 12 R 8.18 3.91 0.00 1.88 2.03 0.00 3.11 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 13 I 7.38 3.68 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.90 0.80 0.00 0.00 14 R 7.77 3.78 0.00 1.79 2.06 0.00 3.05 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 15 N 9.25 4.60 0.00 2.83 2.86 0.00 0.00 7.10 7.53 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 16 G 8.13 3.72 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 0.00 0.00 0.00 17 Q 7.93 4.16 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 18 A 7.42 4.51 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.32 4.55 1.32 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 0.00 0.00 20 N 8.48 4.40 0.00 2.86 2.84 0.00 0.00 7.28 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 21 K 7.82 3.84 0.00 1.90 2.03 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.67 1.60 7.81 22 A 8.79 4.31 1.32 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 0.00 0.00 23 A 6.78 5.11 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 24 V 7.94 4.23 2.10 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 0.57 0.00 0.00 0.94 0.00 0.00 25 T 8.36 5.14 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 1.22 0.00 0.00 26 M 7.58 4.46 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 27 P 0.00 4.75 0.00 2.10 2.13 0.00 3.77 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 1.98 1.97 0.00 28 S 9.18 4.59 0.00 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 0.00 29 S 8.56 4.70 0.00 4.13 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 30 K 7.32 4.46 0.00 1.83 1.74 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.51 1.50 7.81 31 L 7.78 3.87 0.00 1.77 1.61 0.89 0.58 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 32 K 7.35 3.81 0.00 2.03 1.85 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.45 7.81 33 V 8.20 3.62 2.25 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 1.24 0.00 0.00 1.03 0.00 0.00 34 A 8.12 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 3.58 1.76 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 1.40 0.82 0.83 0.00 0.00 36 A 7.82 3.62 -0.03 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 0.00 0.00 37 N 7.82 4.25 0.00 2.95 2.88 0.00 0.00 6.95 6.99 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 38 V 7.67 3.66 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 0.87 0.00 0.00 0.98 0.00 0.00 39 L 8.02 4.31 0.00 1.89 1.79 0.86 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.69 4.16 0.00 1.99 2.17 0.00 1.88 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.76 7.81 41 E 8.38 4.43 0.00 2.06 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 0.00 2.37 2.55 0.00 42 E 7.36 4.26 0.00 1.95 1.50 0.00 0.00 0.00 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 2.41 0.00 43 G 7.52 3.55 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 0.00 44 F 7.98 5.30 0.00 3.15 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 45 I 7.69 4.62 2.03 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 1.48 0.56 0.96 0.00 0.00 46 E 9.01 4.14 0.00 2.11 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 0.00 2.52 2.49 0.00 47 D 8.30 4.68 0.00 2.77 2.51 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 48 F 8.36 5.38 0.00 3.21 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 49 K 9.13 4.26 0.00 1.68 1.61 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.27 7.81 50 V 8.49 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 1.01 0.00 0.00 1.01 0.00 0.00 51 E 8.71 4.55 0.00 1.99 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 2.32 2.35 0.00 52 G 9.11 4.65 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 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.50 4.55 0.00 2.87 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 54 T 6.02 3.77 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 55 K 7.50 4.39 0.00 1.65 1.71 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.48 7.81 56 P 0.00 5.33 0.00 2.13 2.23 0.00 3.88 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.85 0.00 57 E 8.53 4.19 0.00 1.97 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 0.00 2.40 2.31 0.00 58 L 7.98 4.78 0.00 1.79 1.67 0.94 1.13 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 59 E 9.49 4.33 0.00 2.10 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 2.63 0.00 60 L 8.79 5.19 0.00 1.80 1.67 1.04 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.86 4.83 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 1.26 0.00 0.00 62 L 8.66 4.61 0.00 2.00 1.80 0.95 0.83 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 63 K 8.18 4.79 0.00 1.73 1.75 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.53 7.81 64 Y 8.93 4.99 0.00 3.08 2.87 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 65 F 7.96 5.26 0.00 2.84 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 0.00 0.00 0.00 0.00 66 Q 8.35 3.08 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.16 2.44 0.00 67 G 8.32 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 0.00 0.00 0.00 68 K 7.74 4.48 0.00 1.96 1.85 0.00 1.62 0.00 0.00 1.86 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.56 7.81 69 A 8.26 4.42 0.98 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 70 V 8.09 4.35 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 0.84 0.00 0.00 1.03 0.00 0.00 71 V 7.48 4.05 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 0.53 0.00 0.00 0.81 0.00 0.00 72 E 8.69 4.01 0.00 1.95 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 2.33 2.31 0.00 73 S 7.04 4.31 0.00 3.81 3.68 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 74 I 8.05 4.36 1.50 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 2.04 0.74 0.00 0.00 75 Q 7.45 4.61 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 76 R 8.41 4.02 0.00 1.79 1.78 0.00 3.31 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 77 V 8.80 4.22 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 0.83 0.00 0.00 1.01 0.00 0.00 78 S 7.68 4.66 0.00 3.93 3.72 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 79 R 8.03 3.97 0.00 1.94 1.94 0.00 3.09 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 80 P 0.00 4.42 0.00 2.24 2.24 0.00 3.83 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 81 G 8.61 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 6.77 5.71 0.00 1.65 1.69 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 83 R 7.96 4.15 0.00 2.18 1.92 0.00 3.28 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 84 I 7.80 4.71 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.82 0.94 0.00 0.00 85 Y 8.51 4.83 0.00 2.81 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 86 K 8.32 4.67 0.00 1.71 1.98 0.00 1.94 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.42 7.81 87 R 7.86 4.66 0.00 1.95 1.83 0.00 3.14 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 88 K 8.90 4.12 0.00 1.89 1.85 0.00 1.61 0.00 0.00 0.61 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.35 7.81 89 D 7.74 4.81 0.00 2.80 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 90 E 7.97 4.66 0.00 1.98 1.83 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 2.16 2.22 0.00 91 L 7.92 4.90 0.00 1.61 1.49 0.98 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.52 0.00 2.15 2.06 0.00 3.70 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 93 K 8.22 4.13 0.00 1.65 1.78 0.00 1.79 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.47 7.81 94 V 7.84 2.97 2.25 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 1.06 0.00 0.00 0.93 0.00 0.00 95 M 9.56 3.29 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 96 A 9.08 3.65 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 97 G 8.62 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 0.00 0.00 0.00 0.00 98 L 7.99 3.75 0.00 1.67 1.79 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.44 4.81 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 0.00 0.00 0.00 100 I 7.88 4.79 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.89 1.08 0.00 0.00 101 A 8.30 5.29 1.28 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 0.00 102 V 8.46 3.70 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 0.70 0.00 0.00 0.90 0.00 0.00 103 V 8.26 4.57 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 0.78 0.00 0.00 0.97 0.00 0.00 104 S 9.06 4.29 0.00 3.90 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 0.00 105 T 8.99 4.90 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 1.30 0.00 0.00 106 S 8.80 4.24 0.00 3.87 3.95 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 0.00 107 K 8.65 4.40 0.00 1.78 1.78 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.49 7.81 108 G 7.08 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 0.00 0.00 0.00 109 V 7.76 4.25 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 0.91 0.00 0.00 110 M 7.86 4.51 0.00 2.23 2.01 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 111 T 7.97 5.13 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 1.23 0.00 0.00 112 D 8.36 4.35 0.00 2.90 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 0.00 113 R 7.79 3.98 0.00 1.91 1.96 0.00 3.20 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 114 A 7.85 3.97 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 0.00 115 A 7.92 3.92 1.46 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 0.00 0.00 116 R 7.25 3.85 0.00 2.03 2.03 0.00 3.20 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 117 Q 8.14 4.10 0.00 2.10 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 118 A 7.47 4.19 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 0.00 119 G 8.24 3.95 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 0.00 0.00 0.00 120 L 7.71 4.59 0.00 1.69 1.63 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.62 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 0.00 0.00 0.00 122 G 7.22 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 0.00 0.00 0.00 123 E 8.07 4.34 0.00 1.64 1.58 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 1.89 1.47 0.00 124 I 8.43 4.12 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.77 0.89 0.00 0.00 125 I 8.65 4.31 1.82 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 1.45 0.70 0.85 0.00 0.00 126 C 6.89 5.06 0.00 3.10 3.05 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 0.00 127 Y 7.40 5.34 0.00 2.99 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 0.00 128 V 8.61 4.63 0.96 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 0.20 0.00 0.00 0.80 0.00 0.00 129 A 8.12 4.34 1.31 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 0.00 0.00 0.00