NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2771 8.3344 116.7715 58.3495 64.2293 174.2555 5 V 3.4987 8.5632 130.0623 62.3599 32.0299 169.4481 6 V 4.2020 8.9625 128.6850 61.5513 33.9732 174.6440 7 K 4.7572 8.1244 124.3060 54.3625 35.4986 177.3192 8 S 4.1955 8.8505 118.2768 61.9857 62.7933 176.4608 9 E 4.3758 8.2015 113.9202 57.7976 29.4285 176.5841 10 D 4.6579 8.0112 119.6210 54.3414 41.1037 177.7038 11 Y 4.0762 7.6058 119.1044 59.8520 37.7705 177.4532 12 A 4.1023 6.8818 120.7284 52.8179 19.0174 176.7905 13 L 4.6844 7.3484 115.7717 51.7592 43.7713 174.8199 14 P 4.3111 0.0000 0.0000 62.9848 31.6950 175.9047 15 S 4.8457 8.3658 115.7287 56.4351 66.0402 172.2277 16 Y 4.5168 8.3221 120.9186 56.5294 39.7082 174.8168 17 V 4.3129 6.9480 117.6230 60.0467 35.6896 174.2309 18 D 4.6830 8.4666 123.4247 52.7798 41.2537 176.1160 19 R 4.5532 7.8521 122.5661 54.0670 34.2415 176.7071 20 R 3.5471 8.6773 121.7953 59.3241 30.1172 177.3912 21 D 4.6969 7.9695 113.5735 54.1345 40.0902 175.5524 22 Y 4.7788 7.8677 120.9980 55.2374 38.7446 173.5531 23 P 4.5906 0.0000 0.0000 65.2558 31.7221 176.8347 24 L 4.6394 6.7002 119.4620 51.5571 41.2430 174.3187 25 P 4.6820 0.0000 0.0000 62.2419 32.0254 176.8013 26 D 4.5615 8.7985 119.2952 56.8229 40.9278 176.9972 27 V 4.5513 7.4610 109.4563 58.9965 35.6087 174.6875 28 A 4.3706 8.2676 123.7699 51.7533 19.2810 177.2294 29 H 3.5582 8.7700 122.0453 58.2365 29.9028 175.8833 30 V 4.1437 7.7244 119.1760 60.7858 32.8745 174.7083 31 K 4.2352 8.5506 126.3683 58.0688 33.7972 176.7274 32 N 4.6478 7.8943 116.6468 52.1050 39.3890 174.1733 33 L 4.7226 8.2093 122.5652 52.7300 44.6824 177.2416 34 S 4.5337 8.2066 116.9189 57.1742 66.0749 174.8080 35 A 3.9800 8.4119 122.4163 55.5962 17.9308 179.9083 36 S 4.1149 7.9786 112.2421 61.5728 63.2315 176.4897 37 Q 3.9575 7.7821 120.6979 58.6749 28.4824 178.8034 38 K 3.9043 8.2660 119.3303 59.5194 32.0102 179.2480 39 A 4.0247 7.7627 120.9475 54.8862 18.1705 179.4963 40 L 3.8971 8.1516 119.2247 58.3345 41.9944 179.3682 41 K 3.9705 8.0554 117.3778 59.4073 32.1871 178.9707 42 E 4.1328 8.1079 118.9693 59.3238 29.4591 179.2516 43 K 4.0272 8.2818 119.7985 59.3485 31.9951 178.3363 44 E 4.2674 8.2900 118.9952 58.7837 29.5956 178.3722 45 K 4.2344 7.9998 116.9871 57.9052 32.4378 176.5162 46 A 4.4844 7.6381 122.1635 49.9779 21.2122 176.3154 47 S 3.9628 8.3520 112.2841 58.7854 62.7509 175.3401 48 W 4.7434 8.4433 126.3437 58.9497 29.3162 178.5461 49 S 4.2866 7.9691 114.5115 61.4920 62.2951 175.6634 50 S 4.3719 7.8644 114.2154 59.8174 62.8951 174.3821 51 L 4.5384 7.5944 121.5142 54.0243 42.3433 177.5094 52 S 4.5399 8.6710 118.0371 57.4845 65.4332 175.5222 53 I 3.6655 8.2649 123.4282 65.0695 36.8863 178.3188 54 D 4.3619 8.1255 118.7837 57.5387 40.6353 178.7032 55 E 4.0508 8.0542 118.6169 59.1196 29.4221 179.4998 56 K 3.9619 8.3322 118.9631 59.4005 32.1379 179.5914 57 V 3.6316 8.0754 118.8059 65.9324 31.1852 177.7466 58 E 4.0240 7.9640 118.4582 59.0808 29.6386 178.4937 59 L 4.0990 8.0510 119.3080 57.7039 41.6669 178.6940 60 Y 4.0448 8.2199 119.5615 60.9292 38.6192 178.4447 61 R 4.4297 8.0166 118.2444 58.0551 30.3147 178.4973 62 L 4.1123 7.5712 119.1973 56.9305 41.7349 179.0785 63 K 3.5295 7.5665 119.0735 57.6605 32.0394 176.3446 64 F 5.3417 7.3028 116.9712 55.5211 41.8095 175.8061 65 K 3.7859 9.3537 124.4243 58.0776 32.4582 176.6079 66 E 5.0268 8.2212 117.7042 54.2113 32.3936 176.8535 67 S 5.3570 8.5447 118.3353 57.1424 65.6359 175.5661 68 F 3.9191 9.0041 119.9471 60.5907 38.3869 177.5918 69 A 4.0695 8.1238 118.8224 55.3223 18.1686 179.1703 70 E 4.0955 8.0648 117.0954 59.8157 29.4311 179.5510 71 M 4.1357 8.0995 115.5348 57.6620 31.3128 177.2186 72 N 4.7393 7.8170 115.7545 51.8986 39.3500 175.3294 73 R 4.0608 7.0941 118.0231 56.0781 30.0786 176.7872 74 S 4.5566 8.3689 115.3745 57.8814 64.3872 172.4749 75 T 4.7445 8.0053 109.9735 60.5131 71.8618 173.2024 76 N 4.7490 8.4749 115.8931 53.2313 39.0374 176.5883 77 E 3.9259 8.1843 121.8347 59.2463 29.4114 178.8150 78 W 4.3428 8.3723 116.1939 59.5663 27.8837 178.2847 79 K 3.1246 6.7891 118.8847 59.2599 31.3789 179.4292 80 T 3.7707 7.5409 115.3749 66.4529 68.4396 176.7643 81 V 3.6019 7.9097 120.1088 66.0592 31.6812 178.2142 82 V 3.7936 8.3642 118.4742 65.9930 31.4601 178.1747 83 G 3.6316 8.3767 105.4385 47.8680 0.0000 175.5437 84 A 4.1934 8.3277 123.3257 54.6646 18.3600 179.5525 85 A 4.1476 8.3353 119.3570 55.8659 18.4719 179.8487 86 M 4.0834 8.3184 117.1561 58.3633 31.9211 178.8656 87 F 3.9996 8.3384 120.9661 61.3397 39.5931 177.3316 88 F 4.0076 8.5336 117.4561 60.3599 38.4482 177.8562 89 I 3.9655 8.0294 119.2933 64.0632 37.0800 178.3995 90 G 3.6070 8.1410 106.9933 47.6955 0.0000 175.5614 91 F 3.9373 8.0724 123.6149 61.1499 39.2430 177.2706 92 T 3.6530 7.8592 115.2703 66.5238 68.1740 176.3301 93 A 4.0007 7.7401 122.1833 55.0041 18.2146 179.7257 94 L 3.8633 7.4186 117.2701 57.8553 41.6485 179.6185 95 L 3.8682 7.2809 118.4676 57.7512 41.5434 179.4292 96 L 4.0908 7.8701 118.9801 57.6538 41.5279 179.6473 97 I 3.7246 7.9581 120.1420 63.9886 37.0541 178.1476 98 W 4.1944 8.4986 129.4748 60.4099 30.4714 177.4789 99 E 3.8829 8.5738 119.1670 59.3377 28.9068 178.6093 100 K 4.0183 7.9220 118.1540 59.8778 32.2696 177.8589 101 H 4.0642 7.9811 117.4087 58.7840 29.8955 176.0158 102 Y 4.2115 7.6254 116.3903 57.9198 38.6166 176.7621 103 V 3.9351 7.3748 118.5208 64.5406 32.5941 175.7876 104 Y 4.5613 7.5368 116.3643 57.8890 38.4219 176.0096 105 G 4.0975 8.3518 114.0186 43.4352 0.0000 171.2373 106 P 4.3460 0.0000 0.0000 62.3055 31.9771 176.1294 107 I 3.9988 7.8042 113.9931 59.1586 39.0789 173.7172 108 P 4.3453 0.0000 0.0000 62.8830 31.7603 177.5650 109 H 4.2764 8.5958 116.3234 58.2143 28.5083 177.0903 110 T 2.6205 7.0446 108.9210 62.7258 68.5231 174.6717 111 F 4.5142 7.6342 119.8576 57.7267 39.7368 176.6264 112 E 4.1767 8.0231 121.9964 56.1553 31.1953 177.1304 113 E 3.9730 8.9782 123.0992 59.7268 29.6486 179.1379 114 E 3.9460 8.2054 118.5554 58.9439 29.8503 178.2366 115 W 3.9514 8.3056 127.9790 60.6215 30.7345 177.8488 116 V 3.7648 8.3695 118.1102 66.0010 30.9652 177.8826 117 A 4.0208 7.9685 120.4617 55.0204 18.1399 179.8528 118 K 3.7987 8.0651 117.0683 59.4813 32.0298 179.3971 119 Q 3.7901 8.2519 120.2696 59.4506 28.9366 178.5050 120 T 3.9949 8.1793 116.9806 66.4060 68.5081 176.5876 121 K 3.6175 7.8669 121.4032 59.4260 32.1770 178.6944 122 R 3.8498 8.0775 119.1972 59.8345 29.8368 178.3099 123 M 4.0496 8.3639 118.6840 58.4715 32.0420 178.7938 124 L 4.1295 7.9559 119.1233 57.7161 41.4672 179.2567 125 D 4.4639 8.3606 119.0701 56.9384 40.8329 177.5865 126 M 4.2924 8.2347 115.1096 54.0442 32.4337 176.0482 127 K 4.0857 7.7673 117.0340 56.3353 30.4362 176.1641 128 V 3.4936 8.2390 118.3395 64.5436 32.8618 175.0480 129 A 4.0676 8.7354 128.3786 52.9554 15.5255 175.4102 130 P 4.5165 0.0000 0.0000 64.0627 32.7146 178.8023 131 I 4.1268 7.8279 119.4595 63.8531 37.6296 176.0528 132 Q 4.6653 7.9929 114.2381 57.3381 35.1581 176.2873 133 G 3.8162 8.4383 105.6626 48.1550 0.0000 172.8795 134 F 4.7589 8.2327 121.2452 59.0793 41.8216 176.7385 135 S 4.2658 9.3074 116.8490 61.4643 63.1012 176.7278 136 A 4.2544 8.2375 121.6659 54.2183 18.3969 177.8453 137 K 4.5188 8.4950 114.9996 55.7933 32.5001 175.4592 138 W 4.5572 8.0193 129.7038 55.2713 32.5080 174.8616 139 D 4.4435 7.7677 125.9602 52.8518 40.0201 176.4699 140 Y 4.1379 8.4493 125.6120 60.9691 38.3960 177.9695 141 D 4.4749 8.2943 118.8233 57.4152 41.0911 177.6480 142 K 3.9953 8.2063 115.0355 56.2240 32.6020 176.2846 143 N 4.0300 7.4237 116.7237 53.4673 37.7208 172.1958 144 E 3.5924 5.9000 113.4622 54.2977 33.4499 175.4800 145 W 4.3941 7.8648 120.5540 56.3710 29.6895 176.5922 146 K 3.9022 8.7468 124.5156 56.4966 32.2879 177.3640 147 K 4.1439 8.5113 122.3360 56.8070 32.0347 176.9192 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 S 8.33 4.28 0.00 3.81 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.56 3.50 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 0.73 0.00 0.00 0.92 0.00 0.00 6 V 8.96 4.20 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 0.91 0.00 0.00 1.03 0.00 0.00 7 K 8.12 4.76 0.00 1.82 1.83 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.85 4.20 0.00 3.92 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 9 E 8.20 4.38 0.00 2.08 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 2.27 2.27 0.00 10 D 8.01 4.66 0.00 3.08 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 7.61 4.08 0.00 3.03 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 6.88 4.10 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.35 4.68 0.00 1.70 1.56 0.87 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.31 0.00 2.06 2.03 0.00 3.61 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 2.04 2.09 0.00 15 S 8.37 4.85 0.00 3.99 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 16 Y 8.32 4.52 0.00 3.00 2.95 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 17 V 6.95 4.31 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 0.68 0.00 0.00 0.82 0.00 0.00 18 D 8.47 4.68 0.00 2.66 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 19 R 7.85 4.55 0.00 1.82 1.90 0.00 3.08 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 20 R 8.68 3.55 0.00 1.80 2.09 0.00 3.25 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.47 0.00 21 D 7.97 4.70 0.00 2.85 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 22 Y 7.87 4.78 0.00 2.96 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 23 P 0.00 4.59 0.00 2.25 2.43 0.00 3.74 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 24 L 6.70 4.64 0.00 1.69 1.65 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.68 0.00 2.16 1.75 0.00 3.91 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.09 0.00 26 D 8.80 4.56 0.00 2.75 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 27 V 7.46 4.55 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 0.76 0.00 0.00 1.09 0.00 0.00 28 A 8.27 4.37 1.17 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 0.00 0.00 29 H 8.77 3.56 0.00 2.18 3.25 0.00 5.89 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.72 4.14 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 0.81 0.00 0.00 0.64 0.00 0.00 31 K 8.55 4.24 0.00 1.86 1.87 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.41 7.81 32 N 7.89 4.65 0.00 2.70 2.76 0.00 0.00 6.72 7.85 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 33 L 8.21 4.72 0.00 1.57 1.52 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.21 4.53 0.00 4.03 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 35 A 8.41 3.98 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 36 S 7.98 4.11 0.00 4.06 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 37 Q 7.78 3.96 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 38 K 8.27 3.90 0.00 1.98 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.68 7.81 39 A 7.76 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.15 3.90 0.00 1.86 1.90 0.93 1.17 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 41 K 8.06 3.97 0.00 1.94 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.71 1.61 7.81 42 E 8.11 4.13 0.00 2.23 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 2.49 2.47 0.00 43 K 8.28 4.03 0.00 1.94 2.01 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.29 4.27 0.00 2.16 2.23 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 2.65 2.45 0.00 45 K 8.00 4.23 0.00 1.92 1.87 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.37 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.73 7.81 46 A 7.64 4.48 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 47 S 8.35 3.96 0.00 3.81 3.76 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 48 W 8.44 4.74 0.00 3.53 3.10 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 0.00 0.00 0.00 0.00 49 S 7.97 4.29 0.00 3.93 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 50 S 7.86 4.37 0.00 4.11 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 51 L 7.59 4.54 0.00 1.99 1.63 1.00 1.07 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 52 S 8.67 4.54 0.00 4.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.26 3.67 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 1.64 0.86 0.90 0.00 0.00 54 D 8.13 4.36 0.00 2.72 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 55 E 8.05 4.05 0.00 2.21 2.00 0.00 0.00 0.00 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 2.36 0.00 56 K 8.33 3.96 0.00 1.94 1.82 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.39 1.56 7.81 57 V 8.08 3.63 2.24 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 1.02 0.00 0.00 0.91 0.00 0.00 58 E 7.96 4.02 0.00 2.14 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 0.00 2.32 2.36 0.00 59 L 8.05 4.10 0.00 1.88 1.62 0.81 0.64 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 60 Y 8.22 4.04 0.00 3.15 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 8.02 4.43 0.00 1.91 2.05 0.00 3.45 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.76 0.00 62 L 7.57 4.11 0.00 1.73 1.60 0.88 1.20 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 63 K 7.57 3.53 0.00 1.40 0.95 0.00 1.17 0.00 0.00 1.49 0.00 0.00 2.82 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.63 0.21 7.81 64 F 7.30 5.34 0.00 2.65 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 K 9.35 3.79 0.00 1.05 2.10 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.14 7.81 66 E 8.22 5.03 0.00 2.05 1.87 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 2.28 2.25 0.00 67 S 8.54 5.36 0.00 4.11 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 68 F 9.00 3.92 0.00 3.05 3.21 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 69 A 8.12 4.07 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 70 E 8.06 4.10 0.00 2.17 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 2.35 2.34 0.00 71 M 8.10 4.14 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 72 N 7.82 4.74 0.00 2.81 2.88 0.00 0.00 7.02 7.11 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 73 R 7.09 4.06 0.00 1.93 1.95 0.00 3.07 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.59 0.00 74 S 8.37 4.56 0.00 4.06 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 75 T 8.01 4.74 4.27 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 0.00 0.00 0.00 1.24 0.00 0.00 76 N 8.47 4.75 0.00 2.71 2.70 0.00 0.00 6.44 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 77 E 8.18 3.93 0.00 2.10 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 2.35 2.35 0.00 78 W 8.37 4.34 0.00 3.65 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 6.79 3.12 0.00 1.47 1.39 0.00 1.30 0.00 0.00 1.26 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.54 3.77 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 81 V 7.91 3.60 2.31 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 1.07 0.00 0.00 0.98 0.00 0.00 82 V 8.36 3.79 2.31 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 1.10 0.00 0.00 1.23 0.00 0.00 83 G 8.38 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 84 A 8.33 4.19 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.34 4.15 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 86 M 8.32 4.08 0.00 2.15 2.36 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.61 0.00 87 F 8.34 4.00 0.00 3.14 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 88 F 8.53 4.01 0.00 3.26 3.13 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 89 I 8.03 3.97 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.68 0.93 0.00 0.00 90 G 8.14 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.07 3.94 0.00 2.47 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 92 T 7.86 3.65 4.41 0.00 0.00 0.00 0.00 0.00 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 93 A 7.74 4.00 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 94 L 7.42 3.86 0.00 1.47 1.57 0.94 0.42 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 95 L 7.28 3.87 0.00 1.72 1.60 0.84 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.87 4.09 0.00 1.87 1.73 0.92 0.79 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 97 I 7.96 3.72 2.04 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.00 0.91 0.00 0.00 98 W 8.50 4.19 0.00 3.49 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 99 E 8.57 3.88 0.00 2.33 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 0.00 1.62 2.10 0.00 100 K 7.92 4.02 0.00 1.85 1.99 0.00 1.89 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.50 7.81 101 H 7.98 4.06 0.00 2.99 2.99 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.63 4.21 0.00 1.49 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.37 3.94 1.82 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 0.63 0.00 0.00 0.81 0.00 0.00 104 Y 7.54 4.56 0.00 3.11 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 0.00 105 G 8.35 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 4.35 0.00 2.16 2.03 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 107 I 7.80 4.00 1.51 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.59 0.00 0.00 108 P 0.00 4.35 0.00 2.31 1.94 0.00 3.69 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 2.20 2.08 0.00 109 H 8.60 4.28 0.00 3.42 3.47 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.04 2.62 3.51 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 0.09 0.00 0.00 111 F 7.63 4.51 0.00 3.13 3.10 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 0.00 0.00 0.00 0.00 112 E 8.02 4.18 0.00 2.27 1.99 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 2.39 2.41 0.00 113 E 8.98 3.97 0.00 2.09 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 0.00 2.44 2.45 0.00 114 E 8.21 3.95 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 2.38 2.38 0.00 115 W 8.31 3.95 0.00 3.59 3.19 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 0.00 116 V 8.37 3.76 2.31 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 1.12 0.00 0.00 1.13 0.00 0.00 117 A 7.97 4.02 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 0.00 118 K 8.07 3.80 0.00 1.60 1.56 0.00 1.45 0.00 0.00 1.34 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.46 7.81 119 Q 8.25 3.79 0.00 2.06 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 120 T 8.18 3.99 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 1.49 0.00 0.00 121 K 7.87 3.62 0.00 1.69 1.81 0.00 1.52 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.23 7.81 122 R 8.08 3.85 0.00 1.79 1.98 0.00 3.06 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 123 M 8.36 4.05 0.00 1.94 2.31 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.43 0.00 124 L 7.96 4.13 0.00 1.52 1.26 -0.82 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.36 4.46 0.00 2.72 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 0.00 126 M 8.23 4.29 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.83 0.00 127 K 7.77 4.09 0.00 1.93 1.91 0.00 1.51 0.00 0.00 1.17 0.00 0.00 2.48 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.53 1.25 7.81 128 V 8.24 3.49 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 0.92 0.00 0.00 0.91 0.00 0.00 129 A 8.74 4.07 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 0.00 130 P 0.00 4.52 0.00 2.24 2.38 0.00 3.82 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 131 I 7.83 4.13 1.91 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 1.44 0.46 0.94 0.00 0.00 132 Q 7.99 4.67 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.44 3.82 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 0.00 0.00 0.00 134 F 8.23 4.76 0.00 3.13 3.27 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 0.00 0.00 0.00 0.00 135 S 9.31 4.27 0.00 4.22 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 0.00 136 A 8.24 4.25 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 0.00 137 K 8.49 4.52 0.00 2.09 1.94 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.44 7.81 138 W 8.02 4.56 0.00 2.81 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 0.00 139 D 7.77 4.44 0.00 2.36 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 0.00 140 Y 8.45 4.14 0.00 3.10 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.29 4.47 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 0.00 142 K 8.21 4.00 0.00 1.53 1.69 0.00 1.84 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.28 7.81 143 N 7.42 4.03 0.00 2.84 2.77 0.00 0.00 6.93 7.44 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 0.00 144 E 5.90 3.59 0.00 1.73 1.66 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 1.87 1.95 0.00 145 W 7.86 4.39 0.00 3.17 3.12 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 0.00 146 K 8.75 3.90 0.00 1.67 1.75 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.35 7.81 147 K 8.51 4.14 0.00 1.71 1.71 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.45 7.81