NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2201 8.3049 118.1946 53.7238 32.7907 174.0581 2 L 3.2681 8.1406 118.7304 54.0257 38.9338 172.8234 3 T 3.9558 8.6227 115.6121 63.7658 70.1485 174.4276 4 D 4.5990 7.6290 120.9726 50.3434 42.8161 173.5471 5 P 4.2031 0.0000 0.0000 65.8467 31.5455 177.4991 6 I 3.6228 8.0562 117.2522 64.9661 37.0544 177.8621 7 A 4.1560 9.0415 121.4196 55.2949 18.1147 179.3601 8 D 4.1895 7.8468 116.2380 57.7419 41.4739 178.0763 9 M 4.0377 8.4439 119.0716 58.5873 32.1874 178.0216 10 L 4.0192 8.3486 119.5285 58.0762 41.6881 179.7315 11 T 3.7713 7.7892 115.4442 66.7523 68.2429 176.9519 12 R 3.9470 8.5295 119.4162 58.2481 29.9637 178.9205 13 I 3.8214 7.1934 118.8308 63.9709 37.6767 177.6260 14 R 3.7755 7.7376 119.5971 59.2888 29.7283 177.9572 15 N 4.1606 8.3139 116.7390 56.3017 38.9017 176.5426 16 A 4.3098 7.4930 121.4872 54.1226 19.3991 179.4088 17 T 4.3587 7.8401 107.1184 64.3226 68.8212 176.0717 18 R 3.9192 7.6181 118.5303 57.3216 30.3818 177.0085 19 V 4.1937 7.3788 112.1290 61.1863 32.6342 175.5446 20 Y 3.0227 7.0344 113.8104 58.1460 36.0977 171.0153 21 K 3.8688 7.4555 119.1096 57.1444 32.8705 176.3519 22 E 4.4685 9.0165 126.5138 59.1102 30.6602 176.0214 23 S 4.8068 7.5403 110.3013 57.5001 66.8344 172.4753 24 T 4.2494 8.1352 110.8713 61.5102 70.8060 172.1236 25 D 5.3345 8.5057 127.1028 53.6191 43.0807 176.1030 26 V 4.5835 8.8812 118.5088 60.0893 34.9757 171.4355 27 P 4.1463 0.0000 0.0000 62.5361 32.0082 175.3568 28 A 4.6069 8.0613 124.7388 51.4497 20.3794 177.4162 29 S 4.6734 8.0544 114.6872 55.9680 66.8857 175.6589 30 R 4.1527 8.5755 125.6259 59.0078 30.2088 178.3145 31 F 4.3915 8.2311 119.8920 61.2502 39.4587 176.7924 32 K 3.5600 8.3945 118.3222 59.8576 31.4236 178.8471 33 E 3.3520 7.9197 119.1282 59.2574 29.1285 179.1464 34 E 3.8194 7.6727 117.8493 59.3900 29.8440 178.5351 35 I 3.6272 7.2670 119.5556 64.6735 37.1171 177.8884 36 L 3.8608 7.7626 118.5887 58.3920 41.3421 179.5302 37 R 4.0860 7.5536 117.9432 59.8476 29.8837 178.2316 38 I 3.9131 8.0186 119.3933 63.9928 37.4509 178.1668 39 L 4.1669 7.9812 119.1374 57.7697 41.4385 179.0991 40 A 4.2955 8.4030 122.3943 54.7698 18.2780 179.4829 41 R 4.0977 7.7788 115.0367 58.1118 30.2477 177.2979 42 E 4.4191 8.2409 116.7179 56.4052 29.5778 176.6161 43 G 3.8719 8.4427 109.8145 45.1731 0.0000 175.9245 44 F 4.6064 7.5659 117.9743 59.7966 38.9309 175.0209 45 I 4.7574 7.2375 109.3777 59.0180 40.5122 175.7714 46 K 4.1667 8.3173 119.0987 56.5106 32.3332 176.2874 47 G 4.0547 7.7115 105.1170 43.6899 0.0000 171.6664 48 Y 6.0996 7.8453 117.2985 54.3545 41.4789 174.5869 49 E 4.7387 8.4562 112.9757 55.4017 32.3439 175.3120 50 R 4.6207 8.9172 122.3310 56.9018 30.6551 176.2417 51 V 4.6988 8.7493 117.7357 60.8756 35.9800 173.9035 52 D 4.6889 8.5118 117.6411 54.2466 43.9102 175.4515 53 V 4.4284 8.1163 123.9828 62.8633 34.3449 174.2485 54 D 4.4871 9.4683 126.2491 55.2585 37.7450 176.5514 55 G 4.1310 8.4930 108.0755 45.7417 0.0000 174.4946 56 K 4.2336 7.7938 120.4413 54.2812 32.1216 173.9850 57 P 4.4674 0.0000 0.0000 63.6295 31.5697 174.9571 58 Y 5.0915 8.5908 117.5392 57.1601 43.2350 173.3270 59 L 5.2206 9.3640 121.6604 53.1110 45.0642 175.5216 60 R 4.7424 8.7511 123.9604 54.6818 32.0838 174.9233 61 V 4.5232 8.6503 127.9760 62.4475 33.1409 174.1820 62 Y 4.7001 9.3302 126.5221 56.9096 39.1749 175.8142 63 L 4.5915 8.1646 125.2367 54.1588 43.2070 176.1901 64 K 4.6150 7.7576 119.9381 55.2970 35.3230 174.5365 65 Y 4.9399 8.4984 122.6418 56.3082 43.0607 174.5767 66 G 4.4593 8.8728 109.0205 44.4542 0.0000 171.9207 67 P 4.5127 0.0000 0.0000 62.6453 31.7459 176.1969 68 R 4.1094 8.5186 122.3736 56.9233 30.6768 175.3285 69 R 4.7127 8.4841 118.4681 54.4728 34.2119 174.8803 70 Q 4.2150 8.3133 119.2313 55.9599 29.9525 174.4948 71 G 3.6642 8.5609 105.9211 43.5252 0.0000 171.4566 72 P 4.4095 0.0000 0.0000 62.1992 32.3002 176.0320 73 D 4.3268 8.3976 117.3058 54.9996 38.8697 171.2299 74 P 4.4061 0.0000 0.0000 63.9233 32.5411 177.0856 75 R 3.2889 7.2375 117.0932 52.1327 28.7597 173.7859 76 P 4.2945 0.0000 0.0000 63.1521 31.9427 174.9554 77 E 4.6563 8.5882 119.8978 55.1877 31.4567 175.1877 78 Q 4.6905 8.6135 123.4575 55.9274 29.2478 176.4929 79 V 3.8711 8.5032 121.3935 64.7726 32.1340 176.5528 80 I 4.2322 7.1673 120.8300 59.5357 36.1029 174.5693 81 H 4.3067 8.3010 120.9750 58.5321 29.5723 175.7928 82 H 4.4497 7.9769 118.6312 54.5727 33.3390 172.5323 83 I 4.7274 7.5415 124.8618 58.9992 40.4773 173.8414 84 R 4.5160 8.0936 128.0888 54.9359 33.6631 173.4477 85 R 4.1000 8.5109 126.9475 56.6742 30.2941 175.4389 86 I 4.0715 8.5029 128.9160 63.5228 37.3769 175.7035 87 S 4.3907 8.0081 115.2764 57.8061 63.4503 173.1118 88 K 4.8973 8.4226 125.0122 53.4513 35.5699 175.4352 89 P 4.3851 0.0000 0.0000 65.3287 31.4304 178.3384 90 G 3.5624 8.0810 107.9519 47.9068 0.0000 174.1501 91 R 4.3274 7.6819 125.1306 53.8824 31.6241 174.7542 92 R 4.7183 8.3443 123.7304 55.7193 31.0439 176.4145 93 V 4.2646 7.2838 118.0883 61.3908 34.7562 173.5573 94 Y 5.4433 8.5317 124.4123 56.3938 41.3020 175.2254 95 V 4.5815 9.1323 116.7340 59.5587 36.2658 175.3676 96 G 4.3272 8.6835 110.6243 44.8456 0.0000 175.0712 97 V 3.7623 8.6960 120.6186 64.5882 31.0925 178.9108 98 K 3.7785 7.9906 117.9337 58.8051 32.7516 177.6164 99 E 4.2334 8.5337 118.8823 58.0538 29.9788 176.8843 100 I 3.5582 6.9670 117.7606 60.6741 37.6073 173.8441 101 P 4.6312 0.0000 0.0000 62.5610 32.1198 177.0554 102 R 4.5278 7.8703 117.6965 53.1702 30.3785 174.4690 103 V 3.3556 8.1459 119.3670 64.8497 32.4216 175.1452 104 R 3.2133 8.9268 120.2380 58.9668 27.8630 177.2924 105 R 3.3241 7.2891 127.3512 57.2266 28.3297 174.6832 106 G 4.2065 7.8571 107.9146 46.2439 0.0000 174.8682 107 L 4.0877 8.4257 119.2492 57.5197 41.7520 177.8828 108 G 4.1825 7.7302 103.8824 45.6074 0.0000 173.1406 109 I 4.6481 8.7382 122.9333 60.2115 40.6934 174.9550 110 A 4.6860 8.6030 125.4844 51.0336 21.5108 175.7372 111 I 4.2153 7.9721 120.1116 62.5017 38.7792 175.6425 112 L 4.9384 8.7931 125.0333 54.6971 44.2898 174.1423 113 S 4.9427 9.4676 118.6651 58.0651 63.8099 172.9767 114 T 5.2882 8.6929 116.6576 59.4732 72.5843 174.7106 115 S 4.3921 8.8382 113.6261 59.4763 63.4570 174.3282 116 K 4.5174 7.4735 119.3154 55.5273 32.5090 176.2585 117 G 3.8738 7.6690 109.7720 44.7654 0.0000 170.6355 118 V 4.3694 8.2226 118.9936 62.0847 32.2781 175.8596 119 L 5.0613 8.6210 126.6257 53.4727 46.9807 175.2469 120 T 4.5546 8.1896 109.7408 60.2276 71.5398 174.0990 121 D 4.2148 8.6787 119.4641 57.0217 38.4434 178.9516 122 R 3.9162 8.0253 120.8264 59.5163 31.0380 177.6596 123 E 3.7708 8.1104 116.4151 60.8045 29.4667 178.9096 124 A 4.2056 8.4522 120.6977 54.2427 18.7313 179.3849 125 R 3.9333 8.1509 117.8406 58.8053 29.9666 178.1766 126 K 4.1342 7.8464 118.8269 58.6600 32.3241 178.0211 127 L 4.3430 7.8180 116.9302 54.2111 42.6467 176.0034 128 G 3.7505 7.9342 104.9496 46.3940 0.0000 173.6176 129 V 4.5330 7.9959 109.8231 59.3627 35.9775 175.1643 130 G 4.3115 8.2094 109.6053 43.9037 0.0000 171.8095 131 G 4.0496 7.7400 103.7208 45.8326 0.0000 171.4187 132 E 4.5743 8.3207 122.3377 55.8813 31.2771 176.9577 133 L 4.5210 8.5251 129.5312 54.9960 43.1392 177.0982 134 I 4.0348 8.5072 127.4055 63.1966 37.9709 175.3115 135 C 5.1344 7.4318 113.7561 58.8017 33.1206 171.6547 136 E 4.9720 7.5300 114.6310 56.0861 33.2042 174.4145 137 V 4.6262 8.9221 120.2604 61.3158 35.6893 174.7092 138 W 4.9060 8.3344 123.2301 57.2042 28.1767 174.1472 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 4.22 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 8.14 3.27 0.00 1.86 1.74 0.94 0.73 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 3 T 8.62 3.96 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 4 D 7.63 4.60 0.00 2.74 2.54 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 5 P 0.00 4.20 0.00 2.25 2.16 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 6 I 8.06 3.62 2.08 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.50 0.93 0.00 0.00 7 A 9.04 4.16 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 8 D 7.85 4.19 0.00 2.78 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 8.44 4.04 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 10 L 8.35 4.02 0.00 1.79 1.62 0.87 0.63 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 11 T 7.79 3.77 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 12 R 8.53 3.95 0.00 1.76 1.93 0.00 3.17 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 13 I 7.19 3.82 2.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.82 0.00 0.00 14 R 7.74 3.78 0.00 1.90 1.95 0.00 3.05 0.00 0.00 3.08 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 15 N 8.31 4.16 0.00 2.66 2.86 0.00 0.00 7.10 8.03 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 16 A 7.49 4.31 1.29 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 0.00 0.00 0.00 17 T 7.84 4.36 4.72 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 1.18 0.00 0.00 18 R 7.62 3.92 0.00 1.89 1.88 0.00 3.05 0.00 0.00 3.32 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 19 V 7.38 4.19 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 0.77 0.00 0.00 0.95 0.00 0.00 20 Y 7.03 3.02 0.00 2.95 2.54 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 21 K 7.46 3.87 0.00 1.80 1.77 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.41 7.81 22 E 9.02 4.47 0.00 2.18 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 0.00 2.48 2.45 0.00 23 S 7.54 4.81 0.00 3.27 3.44 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 24 T 8.14 4.25 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 1.13 0.00 0.00 25 D 8.51 5.33 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.88 4.58 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 0.83 0.00 0.00 0.97 0.00 0.00 27 P 0.00 4.15 0.00 2.11 2.04 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.47 0.00 28 A 8.06 4.61 1.22 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 0.00 0.00 29 S 8.05 4.67 0.00 4.08 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 30 R 8.58 4.15 0.00 1.86 2.07 0.00 3.09 0.00 0.00 2.85 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 31 F 8.23 4.39 0.00 3.05 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 32 K 8.39 3.56 0.00 1.93 1.75 0.00 1.92 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.51 7.81 33 E 7.92 3.35 0.00 2.17 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 0.00 2.18 2.17 0.00 34 E 7.67 3.82 0.00 2.00 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 2.30 2.49 0.00 35 I 7.27 3.63 1.73 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.66 0.78 0.00 0.00 36 L 7.76 3.86 0.00 1.32 1.62 0.76 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.55 4.09 0.00 2.03 2.14 0.00 3.13 0.00 0.00 3.51 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.87 0.00 38 I 8.02 3.91 2.06 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 1.53 0.71 0.96 0.00 0.00 39 L 7.98 4.17 0.00 1.73 1.88 1.03 0.79 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 40 A 8.40 4.30 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 0.00 0.00 0.00 0.00 0.00 41 R 7.78 4.10 0.00 1.79 2.19 0.00 3.26 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 42 E 8.24 4.42 0.00 2.11 1.68 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 2.40 2.50 0.00 43 G 8.44 3.87 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 0.00 0.00 0.00 44 F 7.57 4.61 0.00 3.29 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 45 I 7.24 4.76 2.16 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 1.36 1.12 0.96 0.00 0.00 46 K 8.32 4.17 0.00 1.81 1.90 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.53 7.81 47 G 7.71 4.05 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 0.00 48 Y 7.85 6.10 0.00 3.00 2.97 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 49 E 8.46 4.74 0.00 2.00 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 0.00 2.47 2.39 0.00 50 R 8.92 4.62 0.00 1.79 1.99 0.00 3.21 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 51 V 8.75 4.70 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 0.93 0.00 0.00 1.09 0.00 0.00 52 D 8.51 4.69 0.00 2.77 2.50 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 0.00 0.00 0.00 53 V 8.12 4.43 2.48 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 0.88 0.00 0.00 0.90 0.00 0.00 54 D 9.47 4.49 0.00 2.99 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 55 G 8.49 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.79 4.23 0.00 1.93 1.63 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.66 7.81 57 P 0.00 4.47 0.00 2.02 2.09 0.00 3.69 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.00 0.00 58 Y 8.59 5.09 0.00 2.99 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 9.36 5.22 0.00 1.59 1.65 0.84 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.75 4.74 0.00 1.87 1.88 0.00 3.13 0.00 0.00 2.81 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.10 0.00 61 V 8.65 4.52 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 0.90 0.00 0.00 0.93 0.00 0.00 62 Y 9.33 4.70 0.00 3.04 2.91 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 63 L 8.16 4.59 0.00 1.58 0.95 0.79 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.76 4.62 0.00 1.66 1.53 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.46 7.81 65 Y 8.50 4.94 0.00 3.01 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.87 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 0.00 0.00 0.00 0.00 67 P 0.00 4.51 0.00 2.09 2.09 0.00 3.82 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 2.01 1.99 0.00 68 R 8.52 4.11 0.00 1.77 1.86 0.00 3.10 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 69 R 8.48 4.71 0.00 1.86 1.72 0.00 3.17 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 70 Q 8.31 4.22 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.20 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 71 G 8.56 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.41 0.00 2.06 2.00 0.00 3.83 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 2.02 2.06 0.00 73 D 8.40 4.33 0.00 2.77 2.65 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 74 P 0.00 4.41 0.00 2.20 2.27 0.00 3.92 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.90 0.00 75 R 7.24 3.29 0.00 1.97 1.78 0.00 3.54 0.00 0.00 3.36 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 76 P 0.00 4.29 0.00 2.06 2.03 0.00 2.56 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.41 0.00 77 E 8.59 4.66 0.00 2.14 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 2.40 2.43 0.00 78 Q 8.61 4.69 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.84 0.00 0.00 0.00 0.00 0.00 2.50 2.32 0.00 79 V 8.50 3.87 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 1.06 0.00 0.00 0.99 0.00 0.00 80 I 7.17 4.23 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.82 0.65 0.00 0.00 81 H 8.30 4.31 0.00 3.14 3.31 0.00 5.90 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.98 4.45 0.00 1.87 1.38 0.00 5.75 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 83 I 7.54 4.73 1.61 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.48 0.72 0.00 0.00 84 R 8.09 4.52 0.00 1.68 1.54 0.00 3.21 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 85 R 8.51 4.10 0.00 1.83 1.79 0.00 3.29 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 86 I 8.50 4.07 1.76 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 1.11 0.95 0.89 0.00 0.00 87 S 8.01 4.39 0.00 4.00 3.69 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 88 K 8.42 4.90 0.00 1.83 1.63 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.42 7.81 89 P 0.00 4.39 0.00 2.16 2.17 0.00 3.75 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 1.98 1.96 0.00 90 G 8.08 3.56 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 0.00 0.00 0.00 91 R 7.68 4.33 0.00 1.83 1.75 0.00 3.09 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 92 R 8.34 4.72 0.00 1.68 1.62 0.00 3.58 0.00 0.00 3.83 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 93 V 7.28 4.26 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.89 0.00 0.00 94 Y 8.53 5.44 0.00 2.94 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 95 V 9.13 4.58 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 1.02 0.00 0.00 96 G 8.68 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 0.00 0.00 0.00 0.00 97 V 8.70 3.76 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 0.84 0.00 0.00 0.91 0.00 0.00 98 K 7.99 3.78 0.00 1.90 2.00 0.00 1.57 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.47 7.81 99 E 8.53 4.23 0.00 2.20 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 0.00 2.33 2.29 0.00 100 I 6.97 3.56 1.89 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 1.32 0.48 0.93 0.00 0.00 101 P 0.00 4.63 0.00 2.06 2.02 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 102 R 7.87 4.53 0.00 1.70 1.81 0.00 3.29 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 103 V 8.15 3.36 2.34 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 1.02 0.00 0.00 1.07 0.00 0.00 104 R 8.93 3.21 0.00 1.51 1.71 0.00 2.62 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.31 0.00 105 R 7.29 3.32 0.00 1.78 2.03 0.00 3.27 0.00 0.00 3.20 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 106 G 7.86 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 0.00 0.00 0.00 107 L 8.43 4.09 0.00 1.64 1.76 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.73 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 0.00 0.00 0.00 0.00 109 I 8.74 4.65 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.69 1.28 0.00 0.00 110 A 8.60 4.69 1.29 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 0.00 0.00 0.00 111 I 7.97 4.22 1.87 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 1.31 1.07 0.89 0.00 0.00 112 L 8.79 4.94 0.00 1.85 1.74 0.96 0.46 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 0.00 113 S 9.47 4.94 0.00 4.05 3.88 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 0.00 114 T 8.69 5.29 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 1.27 0.00 0.00 115 S 8.84 4.39 0.00 4.01 4.03 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 0.00 116 K 7.47 4.52 0.00 1.76 1.78 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.37 1.36 7.81 117 G 7.67 3.87 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 0.00 0.00 0.00 118 V 8.22 4.37 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 0.79 0.00 0.00 0.96 0.00 0.00 119 L 8.62 5.06 0.00 1.63 1.54 0.99 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.19 4.55 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 1.38 0.00 0.00 121 D 8.68 4.21 0.00 2.86 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 0.00 122 R 8.03 3.92 0.00 1.82 2.10 0.00 3.25 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 123 E 8.11 3.77 0.00 2.16 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 2.36 2.38 0.00 124 A 8.45 4.21 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 0.00 125 R 8.15 3.93 0.00 2.11 2.05 0.00 3.10 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 126 K 7.85 4.13 0.00 1.88 2.22 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.48 7.81 127 L 7.82 4.34 0.00 1.67 1.71 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 128 G 7.93 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 0.00 0.00 0.00 129 V 8.00 4.53 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 0.74 0.00 0.00 0.99 0.00 0.00 130 G 8.21 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 0.00 0.00 0.00 0.00 131 G 7.74 4.05 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 0.00 132 E 8.32 4.57 0.00 2.25 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 2.23 2.10 0.00 133 L 8.53 4.52 0.00 1.75 1.47 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.51 4.03 1.87 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 0.95 0.00 0.00 135 C 7.43 5.13 0.00 3.26 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 0.00 136 E 7.53 4.97 0.00 2.20 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 2.23 2.33 0.00 137 V 8.92 4.63 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 -0.21 0.00 0.00 0.71 0.00 0.00 138 W 8.33 4.91 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