NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.1363 8.0427 120.6380 55.8524 42.4734 179.7177 5 M 2.5500 7.2156 118.0635 56.5675 35.3077 175.9795 6 F 4.2936 8.2428 129.8028 57.7902 39.1371 173.9819 7 D 4.7150 8.6456 126.4097 54.9750 43.2199 175.9331 8 S 5.2991 8.0327 113.5043 56.6143 65.7946 173.4976 9 I 5.0769 8.9669 124.8838 59.3658 40.6987 174.0833 10 L 4.5066 9.0816 129.4250 53.1735 44.2463 175.0846 11 V 4.5245 8.6593 128.0809 61.9817 33.2306 174.6269 12 I 5.6391 9.2603 128.8949 58.3453 40.2882 173.3787 13 C 4.5863 8.4332 122.3977 58.9722 32.9030 174.2014 14 T 4.1619 8.6975 108.8284 65.4245 69.3260 177.1551 15 G 3.3191 7.9414 108.0547 46.2924 0.0000 172.6497 16 N 4.7297 8.4228 116.7336 53.6156 37.3930 174.1489 17 I 4.5992 7.5819 107.2119 59.7160 38.4745 174.4783 18 C 4.9539 7.1621 116.1282 61.3099 31.8165 176.2883 19 R 3.7332 7.8066 118.3874 59.6533 30.3449 179.2955 20 S 3.9658 7.8334 113.4769 60.9415 62.8458 174.4567 21 P 4.1926 0.0000 0.0000 65.3036 31.1340 178.6246 22 I 3.9246 7.3851 118.5995 64.1346 37.1139 178.6704 23 G 3.3771 8.1797 107.0065 47.5735 0.0000 175.2242 24 E 4.0095 8.4134 122.1813 59.3632 29.5810 179.2805 25 R 4.0752 7.8288 117.9098 58.8610 29.6998 179.0717 26 L 4.0301 7.8704 118.5744 57.7846 41.6810 179.4433 27 L 4.0631 8.1000 118.8785 58.0012 41.1139 179.8065 28 R 4.0921 8.2401 118.0085 59.3064 29.7331 179.1293 29 R 3.9728 7.8260 117.4473 58.6283 30.1407 177.6286 30 L 4.5655 7.4511 116.4455 54.3266 44.1596 176.6357 31 L 4.8720 8.1774 118.5222 52.2222 41.8532 175.1770 32 P 4.4897 0.0000 0.0000 64.9422 31.9075 178.3833 33 S 4.3688 7.9777 109.6336 59.2626 63.5310 173.8274 34 K 4.7086 7.6602 121.3127 55.1179 33.6673 176.6584 35 K 4.2337 8.4165 125.0801 56.4440 32.8702 175.5809 36 I 5.1708 8.3977 128.4456 59.8193 39.9348 174.7112 37 N 5.7073 9.2754 123.6672 50.6357 43.3726 173.0159 38 S 5.1825 8.3161 112.2565 57.6585 66.6686 172.6058 39 A 4.7616 7.9574 120.8070 52.3351 23.2987 175.3155 40 G 4.4527 8.7909 105.3072 44.7713 0.0000 174.2581 41 V 4.2025 8.4050 114.8328 61.8430 32.3326 176.6034 42 G 4.3283 8.1106 108.5232 45.3466 0.0000 173.2803 43 A 4.2798 8.3584 121.0166 51.9731 19.7354 179.2248 44 L 4.1993 8.4760 121.7555 52.8117 40.7752 175.4845 45 V 3.9243 7.7880 122.7582 63.8917 31.9561 176.1578 46 D 4.7531 9.0597 126.6399 54.5739 39.5135 174.0835 47 H 4.5314 7.9612 117.6033 55.5253 29.9025 175.2710 48 T 4.5190 8.4819 116.8473 61.5024 68.3051 173.4649 49 A 4.3647 8.5576 126.0487 51.6411 19.3349 177.1686 50 D 4.4305 9.5745 121.0324 54.3845 42.1960 177.2951 51 E 3.9157 8.9675 126.0297 59.7789 29.6236 179.4792 52 S 3.7794 8.5305 114.9770 60.7893 62.6192 176.6080 53 A 4.1562 7.6688 123.4185 55.1433 18.3066 179.3237 54 I 3.6448 8.0899 118.8244 64.5230 37.1747 178.4100 55 R 3.8146 8.0300 119.6205 59.6161 29.7361 179.0685 56 V 3.5655 7.5431 117.2248 64.3575 31.6060 178.0140 57 A 3.9313 8.0452 121.6163 55.1101 18.4897 178.9479 58 E 3.8514 8.3212 117.9558 59.5163 29.3985 178.9890 59 K 4.0189 7.9134 118.2375 58.3799 32.1408 176.8882 60 N 4.7596 8.0370 114.7904 52.6834 39.0212 174.7132 61 G 3.8438 8.0240 105.2344 46.1453 0.0000 173.2848 62 L 4.6480 7.9053 120.6923 52.8059 43.8235 174.8200 63 C 4.6795 8.6786 125.9885 57.9148 33.2412 172.9373 64 L 4.5968 8.3206 125.1619 54.1982 41.9206 176.3142 65 K 4.1435 7.8048 119.2705 58.0331 32.2868 177.1116 66 G 4.0467 8.9595 111.1867 45.2307 0.0000 173.1371 67 H 4.4324 7.7548 120.0058 56.0773 30.4949 174.5517 68 R 4.5034 8.0771 125.0680 53.9597 32.9940 174.8693 69 G 3.9180 8.9688 114.4997 46.8994 0.0000 172.3505 70 T 5.0429 9.4625 114.6394 59.5155 72.3599 173.0361 71 K 4.3800 8.6595 126.4176 56.0595 33.1453 175.9158 72 F 4.5372 9.1537 131.1845 58.2485 40.0243 174.6399 73 T 4.3756 7.2844 114.3494 58.6131 72.0948 174.3082 74 S 3.8884 8.6913 116.9687 61.8042 61.9278 176.4369 75 A 3.9640 7.7878 120.9552 55.2630 18.4070 178.8671 76 L 4.0444 7.9450 118.5619 58.2517 42.0973 179.0067 77 A 4.1934 7.9601 120.7659 55.2064 18.0721 179.7125 78 R 3.9514 7.6116 115.6668 58.7087 30.1656 177.9290 79 Q 4.1665 7.8702 117.3933 55.6702 29.6443 174.5990 80 Y 4.6880 7.5484 116.2792 57.0575 41.0222 175.2585 81 D 4.7410 8.8251 122.5467 56.0584 42.3606 176.7011 82 L 4.9927 8.3997 120.2045 53.2880 45.9106 175.0294 83 L 5.1246 8.7608 125.8892 52.9741 44.4401 175.2498 84 L 5.6818 8.7024 123.7490 52.3858 44.1826 176.1654 85 V 5.0173 8.1215 116.6596 59.3041 34.4392 176.8622 86 M 4.0502 8.5676 121.8789 57.4121 33.3489 176.4968 87 E 4.8118 8.0541 116.1482 54.0814 33.7360 175.9419 88 Y 4.2493 9.1229 120.3344 61.6701 38.2373 179.6401 89 S 4.2515 8.0709 114.0546 61.4682 63.1253 176.0463 90 H 4.6220 8.0480 121.4574 57.9399 28.2890 177.5120 91 L 3.9488 7.6865 120.6350 58.0215 41.4528 179.3185 92 E 3.9932 8.1955 117.7593 59.5720 29.2708 179.4019 93 Q 4.0059 7.7913 118.1227 59.0782 28.7240 178.8024 94 I 3.7420 8.1552 121.2295 64.4499 37.1243 178.6859 95 S 4.1564 8.1958 116.0424 61.9772 62.4306 176.5058 96 R 4.0544 8.1203 120.1393 59.5068 29.8910 178.8838 97 I 4.0283 8.7614 120.5567 63.4014 38.8418 176.9758 98 A 4.7676 8.3678 121.9563 49.7042 18.9887 174.4210 99 P 4.3990 0.0000 0.0000 64.0585 32.0759 178.2334 100 E 4.4237 8.2037 112.8374 56.4607 30.0099 176.4481 101 A 4.6452 8.1696 122.6725 52.4355 20.8549 179.0220 102 R 3.9432 7.8513 115.7869 59.2650 30.1783 178.7500 103 G 3.8347 8.1806 105.3799 47.3499 0.0000 173.6145 104 K 4.7518 8.3400 119.3253 56.8411 34.0104 175.2656 105 T 5.1269 7.9093 117.2198 62.9602 70.1715 173.8690 106 M 4.9366 9.0198 124.9079 53.1034 37.2500 174.5460 107 L 4.4632 8.3156 119.9288 54.6363 42.5351 178.0234 108 F 3.8793 9.5926 127.2203 61.5114 39.5805 176.3056 109 G 4.3173 8.1828 106.7751 45.1321 0.0000 174.3701 110 H 3.7976 7.9795 122.2809 58.5699 29.5947 175.8929 111 W 4.5605 7.5386 115.7020 56.3719 29.0441 175.8047 112 L 4.6226 7.7646 119.5965 53.1349 42.9071 176.7688 113 D 4.3878 8.7614 119.8547 57.0550 40.8246 177.0564 114 S 4.7053 7.7263 113.2064 56.1414 63.6270 173.7715 115 K 4.2717 8.6228 127.9948 59.2879 32.2426 177.2296 116 E 4.2060 7.8484 117.5595 56.2663 30.2724 177.1045 117 I 4.1835 8.2132 125.4503 59.2720 37.5464 174.0867 118 P 4.2961 0.0000 0.0000 62.7337 32.1353 175.8944 119 D 4.4603 8.5331 122.7195 53.1312 41.5257 174.4040 120 P 4.2341 0.0000 0.0000 62.9886 32.1127 175.1432 121 Y 4.5065 8.3233 121.6595 59.7204 38.8084 176.5077 122 R 3.8056 8.7324 124.5170 56.4446 27.7937 175.7245 123 M 4.4488 7.9813 118.1455 53.5886 33.8571 175.3813 124 S 4.6368 8.1764 114.8224 57.4333 64.8549 174.7691 125 D 4.4430 8.6341 119.2375 57.6267 40.2762 178.8279 126 E 4.0187 8.3002 118.4977 59.3051 29.4883 178.9329 127 A 4.0000 7.9150 121.0144 55.3511 18.4524 179.7537 128 F 4.0473 8.3308 115.7282 60.4259 39.1518 177.4167 129 D 4.4895 8.9756 119.4512 57.7667 40.7012 179.3125 130 S 4.1821 8.3041 115.4142 61.6497 62.8304 176.9772 131 V 3.6115 7.8585 120.9432 65.7324 31.1534 177.5448 132 Y 3.8889 8.1792 119.5790 60.7177 38.6861 177.6390 133 Q 4.0927 8.1070 120.0195 59.3187 29.1150 178.3600 134 L 4.0098 8.0426 119.9157 57.7418 41.5851 179.4850 135 L 3.9685 8.0636 119.1611 57.5863 41.4704 179.1660 136 E 3.8000 8.3595 119.6140 59.3337 29.7512 178.6566 137 Q 3.9535 8.2971 119.4396 59.1440 29.1357 177.9644 138 A 4.1441 8.3194 121.8428 55.3521 18.3647 179.8128 139 S 4.1717 8.5899 113.7132 61.8086 62.9617 177.0217 140 K 3.9631 8.2702 121.1829 59.6813 31.7997 179.6699 141 R 3.8066 7.9791 117.9088 58.6807 29.9302 179.1506 142 W 4.0350 8.2922 118.6929 59.6397 28.8513 178.3096 143 A 4.0438 8.1481 119.7632 55.1365 17.8891 178.8526 144 E 3.9455 7.8246 116.5906 59.5702 29.7791 179.1002 145 K 3.8253 7.6716 116.8799 58.3528 32.0219 177.6183 146 L 4.5096 7.7099 123.1911 54.7769 41.9869 176.1141 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 4 L 8.04 4.14 0.00 1.83 1.84 1.19 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 5 M 7.22 2.55 0.00 1.53 1.98 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.89 0.00 6 F 8.24 4.29 0.00 3.22 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 7 D 8.65 4.71 0.00 2.72 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 8 S 8.03 5.30 0.00 3.95 3.50 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 9 I 8.97 5.08 1.87 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.71 0.73 0.00 0.00 10 L 9.08 4.51 0.00 0.66 1.31 0.38 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.66 4.52 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 0.92 0.00 0.00 1.03 0.00 0.00 12 I 9.26 5.64 1.61 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.35 0.59 0.00 0.00 13 C 8.43 4.59 0.00 2.85 2.71 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 0.00 0.00 0.00 0.00 14 T 8.70 4.16 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 1.19 0.00 0.00 15 G 7.94 3.32 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 0.00 16 N 8.42 4.73 0.00 2.81 2.86 0.00 0.00 7.11 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 17 I 7.58 4.60 1.90 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.65 1.02 0.00 0.00 18 C 7.16 4.95 0.00 2.97 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 19 R 7.81 3.73 0.00 1.72 1.75 0.00 3.01 0.00 0.00 3.54 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 20 S 7.83 3.97 0.00 4.10 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 0.00 21 P 0.00 4.19 0.00 2.05 1.72 0.00 3.59 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 1.85 1.96 0.00 22 I 7.39 3.92 1.96 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.18 0.91 0.00 0.00 23 G 8.18 3.38 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 0.00 24 E 8.41 4.01 0.00 2.07 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 0.00 2.34 2.39 0.00 25 R 7.83 4.08 0.00 1.88 2.00 0.00 3.38 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.98 0.00 26 L 7.87 4.03 0.00 1.93 1.76 0.70 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.10 4.06 0.00 1.99 1.74 0.80 0.69 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 28 R 8.24 4.09 0.00 2.03 2.02 0.00 3.16 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 29 R 7.83 3.97 0.00 1.99 2.17 0.00 3.28 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 30 L 7.45 4.57 0.00 1.69 1.72 0.96 0.84 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 31 L 8.18 4.87 0.00 1.72 1.58 0.95 1.04 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 32 P 0.00 4.49 0.00 2.05 2.14 0.00 3.74 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 33 S 7.98 4.37 0.00 3.99 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 0.00 34 K 7.66 4.71 0.00 1.82 1.96 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.41 7.81 35 K 8.42 4.23 0.00 1.86 1.70 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.60 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.49 1.48 7.81 36 I 8.40 5.17 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 1.39 1.02 0.94 0.00 0.00 37 N 9.28 5.71 0.00 2.62 2.70 0.00 0.00 6.35 7.73 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 38 S 8.32 5.18 0.00 3.86 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 39 A 7.96 4.76 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 40 G 8.79 4.45 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 0.00 41 V 8.40 4.20 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 0.44 0.00 0.00 1.00 0.00 0.00 42 G 8.11 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 43 A 8.36 4.28 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 44 L 8.48 4.20 0.00 1.61 1.27 0.76 0.51 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 45 V 7.79 3.92 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 0.83 0.00 0.00 0.92 0.00 0.00 46 D 9.06 4.75 0.00 2.90 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 47 H 7.96 4.53 0.00 3.34 3.23 0.00 5.64 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 48 T 8.48 4.52 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 1.23 0.00 0.00 49 A 8.56 4.36 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 50 D 9.57 4.43 0.00 2.92 2.72 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 51 E 8.97 3.92 0.00 2.05 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 2.31 2.37 0.00 52 S 8.53 3.78 0.00 2.73 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 53 A 7.67 4.16 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 54 I 8.09 3.64 1.99 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 1.42 0.74 0.89 0.00 0.00 55 R 8.03 3.81 0.00 1.86 1.98 0.00 3.08 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 1.55 1.58 0.00 56 V 7.54 3.57 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 1.05 0.00 0.00 0.95 0.00 0.00 57 A 8.05 3.93 1.52 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 0.00 0.00 58 E 8.32 3.85 0.00 2.26 1.94 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 2.29 2.36 0.00 59 K 7.91 4.02 0.00 1.80 1.88 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.42 7.81 60 N 8.04 4.76 0.00 2.29 2.73 0.00 0.00 7.01 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 61 G 8.02 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 62 L 7.91 4.65 0.00 1.75 1.81 1.01 1.18 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 63 C 8.68 4.68 0.00 2.97 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 64 L 8.32 4.60 0.00 1.76 1.66 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.80 4.14 0.00 1.76 1.77 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.46 7.81 66 G 8.96 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 67 H 7.75 4.43 0.00 3.28 3.29 0.00 5.89 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.08 4.50 0.00 1.76 1.67 0.00 3.28 0.00 0.00 3.46 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 69 G 8.97 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 70 T 9.46 5.04 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 1.24 0.00 0.00 71 K 8.66 4.38 0.00 1.77 1.74 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.50 7.81 72 F 9.15 4.54 0.00 2.97 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 73 T 7.28 4.38 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 1.16 0.00 0.00 74 S 8.69 3.89 0.00 3.98 3.86 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 75 A 7.79 3.96 1.25 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 0.00 0.00 76 L 7.95 4.04 0.00 1.65 1.57 1.06 1.06 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 77 A 7.96 4.19 1.43 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 0.00 0.00 78 R 7.61 3.95 0.00 1.98 2.01 0.00 3.15 0.00 0.00 3.15 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 79 Q 7.87 4.17 0.00 2.01 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.61 0.00 0.00 0.00 0.00 0.00 1.62 1.98 0.00 80 Y 7.55 4.69 0.00 3.02 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 81 D 8.83 4.74 0.00 2.83 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 82 L 8.40 4.99 0.00 1.88 1.43 0.75 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.76 5.12 0.00 1.66 1.47 1.04 0.36 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 84 L 8.70 5.68 0.00 1.46 1.43 -0.24 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.12 5.02 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 1.07 0.00 0.00 0.94 0.00 0.00 86 M 8.57 4.05 0.00 1.88 2.12 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 87 E 8.05 4.81 0.00 1.70 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 2.20 2.21 0.00 88 Y 9.12 4.25 0.00 3.06 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 89 S 8.07 4.25 0.00 4.02 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 90 H 8.05 4.62 0.00 3.32 3.25 0.00 5.66 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 91 L 7.69 3.95 0.00 1.90 1.75 1.07 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.20 3.99 0.00 2.13 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 0.00 2.41 2.36 0.00 93 Q 7.79 4.01 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 94 I 8.16 3.74 1.92 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.12 0.95 0.00 0.00 95 S 8.20 4.16 0.00 4.09 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 96 R 8.12 4.05 0.00 1.99 1.97 0.00 3.35 0.00 0.00 3.24 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.83 0.00 97 I 8.76 4.03 2.15 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 1.54 0.62 1.03 0.00 0.00 98 A 8.37 4.77 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 99 P 0.00 4.40 0.00 2.21 2.15 0.00 3.90 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.33 0.00 100 E 8.20 4.42 0.00 2.09 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 0.00 2.29 2.26 0.00 101 A 8.17 4.65 1.48 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 0.00 102 R 7.85 3.94 0.00 1.98 1.98 0.00 3.17 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 103 G 8.18 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 0.00 104 K 8.34 4.75 0.00 2.11 2.07 0.00 1.52 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.46 7.81 105 T 7.91 5.13 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 1.21 0.00 0.00 106 M 9.02 4.94 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 107 L 8.32 4.46 0.00 1.57 1.51 0.46 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.59 3.88 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 0.00 109 G 8.18 4.32 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 0.00 110 H 7.98 3.80 0.00 3.07 2.70 0.00 5.94 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 7.54 4.56 0.00 3.04 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 L 7.76 4.62 0.00 1.78 1.61 1.04 1.08 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 0.00 113 D 8.76 4.39 0.00 2.67 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 0.00 114 S 7.73 4.71 0.00 3.81 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 0.00 115 K 8.62 4.27 0.00 1.66 1.61 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.43 7.81 116 E 7.85 4.21 0.00 1.82 1.81 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 1.83 2.35 0.00 117 I 8.21 4.18 1.77 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 1.23 0.67 0.78 0.00 0.00 118 P 0.00 4.30 0.00 1.86 1.96 0.00 3.62 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 119 D 8.53 4.46 0.00 2.59 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 0.00 120 P 0.00 4.23 0.00 0.49 1.43 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 121 Y 8.32 4.51 0.00 2.87 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 0.00 122 R 8.73 3.81 0.00 1.87 1.95 0.00 3.13 0.00 0.00 3.07 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.50 0.00 123 M 7.98 4.45 0.00 2.03 2.17 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 2.76 2.46 0.00 124 S 8.18 4.64 0.00 4.03 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 0.00 125 D 8.63 4.44 0.00 2.72 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 0.00 126 E 8.30 4.02 0.00 2.09 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 2.42 2.46 0.00 127 A 7.91 4.00 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 0.00 128 F 8.33 4.05 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 0.00 129 D 8.98 4.49 0.00 2.90 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 0.00 130 S 8.30 4.18 0.00 4.00 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 0.00 131 V 7.86 3.61 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 0.95 0.00 0.00 0.86 0.00 0.00 132 Y 8.18 3.89 0.00 3.31 3.15 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 0.00 0.00 0.00 133 Q 8.11 4.09 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 134 L 8.04 4.01 0.00 1.88 1.70 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.06 3.97 0.00 1.62 1.47 0.78 0.34 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 0.00 136 E 8.36 3.80 0.00 1.74 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 2.32 2.30 0.00 137 Q 8.30 3.95 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 138 A 8.32 4.14 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 0.00 0.00 0.00 0.00 0.00 139 S 8.59 4.17 0.00 4.19 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 0.00 140 K 8.27 3.96 0.00 1.95 1.86 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.69 7.81 141 R 7.98 3.81 0.00 1.83 1.68 0.00 3.15 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.74 0.00 142 W 8.29 4.03 0.00 3.51 3.07 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 0.00 143 A 8.15 4.04 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 0.00 144 E 7.82 3.95 0.00 1.98 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 2.15 2.25 0.00 145 K 7.67 3.83 0.00 1.53 1.56 0.00 0.91 0.00 0.00 1.14 0.00 0.00 2.14 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.39 0.21 7.81 146 L 7.71 4.51 0.00 1.71 1.66 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00