NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3962 0.0000 0.0000 62.6637 33.4772 177.3817 2 R 3.8476 8.1088 118.7223 56.8258 29.7333 174.4184 3 R 4.4440 7.4582 111.6890 57.4352 32.5637 176.0829 4 R 4.1393 7.6286 124.5680 54.9025 27.6909 176.4134 5 V 3.9628 7.6464 116.7229 61.3059 33.0450 175.2865 6 I 4.2313 7.7028 113.6106 60.5559 38.7019 172.8505 7 G 4.1473 8.0117 105.3970 43.9296 0.0000 172.1282 8 Q 5.0918 7.8713 122.9664 54.7707 30.5046 174.4864 9 R 4.0373 8.4313 118.1509 56.3994 30.0287 175.8760 10 K 4.6776 8.3139 118.5562 54.6369 34.8283 175.6052 11 I 4.6733 7.5396 113.0115 58.4810 40.3285 175.5361 12 L 3.9897 8.5373 122.0943 54.4362 41.9570 175.8510 13 P 4.5274 0.0000 0.0000 62.4501 31.8384 174.7383 14 D 4.5383 8.5497 118.3997 53.4898 41.0898 175.4038 15 P 4.5647 0.0000 0.0000 65.0200 31.2865 176.6719 16 K 4.5018 8.7459 118.3258 55.6968 33.0300 175.5075 17 F 4.6380 8.3902 114.3372 58.0645 45.4910 175.7173 18 G 3.9914 8.9312 106.9791 45.3001 0.0000 172.6253 19 S 4.6557 7.8774 113.9129 56.6499 63.9756 174.8826 20 E 3.9627 8.7862 127.0400 59.8603 29.2826 178.9360 21 L 3.9110 7.9416 118.3053 58.1380 41.5743 179.0401 22 L 3.6291 7.7190 119.4632 58.0774 42.0764 179.2200 23 A 3.9630 7.9364 120.1472 55.1767 18.4113 179.2040 24 K 3.7965 8.3148 117.1914 59.8378 32.0795 179.1272 25 F 4.3681 8.7553 120.8896 61.5073 39.2362 177.5846 26 V 3.2937 8.1218 112.2846 64.2524 31.0962 178.0581 27 N 4.2061 7.6737 114.7303 56.7211 38.5444 176.8229 28 I 3.7072 7.3048 119.3523 64.4101 37.2560 177.3970 29 L 4.1401 7.0374 119.3409 55.7413 42.3657 176.2870 30 M 4.0655 7.2208 118.4827 55.9147 32.8168 175.0938 31 V 4.1838 8.2182 117.2376 62.0206 33.4202 172.1812 32 D 4.4050 9.9429 119.2343 54.9484 38.4992 173.7895 33 G 3.8570 8.0120 104.0480 47.4476 0.0000 176.2732 34 K 4.4024 7.8744 120.4089 54.5673 30.0129 176.2262 35 K 3.9531 7.8795 123.8332 59.2530 32.5078 177.5202 36 S 4.1358 8.1733 114.3589 62.4519 62.8955 176.6543 37 T 4.0560 7.8658 111.1548 64.3637 68.7173 176.2581 38 A 3.9731 7.8007 123.9394 55.1604 18.4798 179.3821 39 E 3.6154 8.0673 115.5530 59.6682 29.2044 179.4630 40 S 4.3132 7.8953 115.8378 60.9441 62.5661 175.8429 41 I 4.0585 7.7605 121.2679 62.0368 37.3504 178.0963 42 V 3.4821 7.2879 119.4243 65.9411 31.6337 177.2337 43 Y 4.3336 7.4338 116.2530 61.4289 37.4699 178.6530 44 S 4.2027 7.8542 113.5936 61.2263 62.2992 175.8402 45 A 4.3566 7.5796 124.2256 53.3979 18.9254 178.4935 46 L 4.2270 8.2688 117.1341 56.4060 42.1169 178.1073 47 E 4.2479 8.2212 119.3488 59.8199 30.1606 178.0032 48 T 4.0056 7.6230 108.9272 64.2053 68.3792 175.8237 49 L 4.1397 7.9177 122.8078 57.5950 42.5090 178.0956 50 A 4.1642 7.6522 120.8302 55.2482 18.1987 179.4082 51 Q 3.8530 8.0742 117.7516 59.4050 29.1261 178.2340 52 R 4.0419 7.6272 117.7584 58.2093 30.2491 176.7069 53 S 4.4885 7.9253 112.4296 57.9149 64.7757 177.3088 54 G 4.0712 8.5781 107.9195 46.4486 0.0000 174.9131 55 K 4.2641 7.9707 120.2482 56.9487 29.8496 177.9535 56 S 3.6763 7.8451 115.1677 58.5292 62.4831 170.0045 57 E 4.6784 8.5391 111.8997 58.0487 33.9712 178.2160 58 L 4.0055 8.2580 118.4957 57.8623 41.8851 178.3247 59 E 4.3847 8.1123 113.7001 56.4322 29.8868 177.8291 60 A 3.9815 7.6627 122.4364 55.2346 18.2969 179.8846 61 F 3.7221 7.7817 119.3135 61.5639 39.5832 176.4614 62 E 3.9410 8.5378 118.1861 59.7569 29.0189 178.6129 63 V 3.5347 7.9487 117.4791 66.3634 31.8498 177.9773 64 A 4.0399 7.3982 120.3420 54.8324 18.1442 179.1747 65 L 3.7737 7.7303 118.7041 57.3577 41.9029 177.8070 66 E 4.2488 7.8025 117.2150 57.4089 29.7633 177.2699 67 N 4.5600 7.5444 115.4920 56.4514 39.0090 177.1223 68 V 3.9251 8.0442 118.4578 65.3738 31.9501 176.1248 69 R 3.6503 7.0012 116.9440 54.6555 29.7766 173.2343 70 P 5.0219 0.0000 0.0000 62.0650 33.0633 175.2369 71 T 4.3586 8.6220 116.4360 65.2173 69.5920 174.8471 72 V 4.7002 7.3325 110.7424 59.9271 35.9587 174.2720 73 E 4.5794 9.3058 118.1258 56.0356 32.5768 174.1901 74 V 4.8620 8.4120 111.0202 59.9455 35.8713 175.4776 75 K 4.3925 9.2267 124.7225 54.2125 33.5399 175.8043 76 S 4.1759 8.7267 122.9020 59.4440 63.3130 174.2971 77 R 4.1897 8.7876 124.0643 58.4333 31.3350 176.9664 78 R 4.3976 7.8691 113.2546 56.2659 27.1406 175.6419 79 V 3.5763 6.9642 117.5090 63.0528 32.8406 175.6982 80 G 3.7769 7.4340 116.9356 44.0977 0.0000 173.3757 81 G 4.0429 8.8241 112.8849 45.5162 0.0000 172.0691 82 S 4.8625 7.6729 115.1964 56.7648 66.5443 175.4952 83 T 3.8320 8.8058 120.0891 65.6735 68.8115 174.7199 84 Y 3.5144 7.9553 118.5373 58.6022 35.3390 172.9714 85 Q 4.0924 7.5492 119.6322 55.8899 29.3885 175.4886 86 V 4.2023 7.9268 124.2650 60.7039 33.2598 173.3258 87 P 4.9922 0.0000 0.0000 62.9771 32.0266 175.8220 88 V 4.5887 8.9461 122.4282 59.8250 35.3436 174.4277 89 E 4.6852 8.7131 121.9292 55.0955 29.8599 176.8290 90 V 3.8079 7.9447 124.3377 62.0777 32.2495 176.3959 91 R 4.4268 8.4225 121.0159 54.8043 31.8856 175.0909 92 P 5.0845 0.0000 0.0000 60.4552 29.3874 175.5154 93 V 4.3142 6.9673 118.0207 60.5383 36.0295 174.3301 94 R 4.1686 7.5589 119.0971 59.1323 30.2700 177.3066 95 R 3.4696 8.1235 115.6622 59.1965 29.9713 177.3510 96 N 4.0725 8.1585 115.3719 56.6748 37.3231 176.2778 97 A 4.1288 8.0724 122.6976 54.7248 18.1983 178.9431 98 L 3.2175 7.6710 115.6520 57.7416 41.6671 179.6560 99 A 3.9347 7.2329 119.9797 55.6586 18.1759 179.5762 100 M 3.9906 8.6395 117.9514 58.4767 31.8532 178.9226 101 R 3.8736 8.3679 119.1276 59.2987 30.2720 178.3372 102 W 4.5587 8.3833 119.2490 60.0240 28.9701 178.3682 103 I 3.7698 8.1413 119.6966 64.6134 36.6694 178.7138 104 V 3.6585 8.4731 119.2420 65.9778 31.2673 177.2759 105 E 4.1968 9.8394 116.1182 57.6976 29.9782 177.4028 106 A 4.3970 8.2418 120.1280 54.5703 19.5760 179.0843 107 A 3.9603 7.8436 119.3006 55.2888 18.2346 179.5040 108 R 3.9649 7.7137 116.1626 59.3810 30.0430 177.7719 109 K 4.3862 7.4947 114.9356 55.3740 32.6216 176.4441 110 R 4.3413 7.7686 120.6093 55.5049 31.5019 177.0959 111 G 4.1642 8.3132 112.9794 44.4618 0.0000 172.7260 112 D 4.9470 7.2410 123.6659 54.3811 40.1340 177.9484 113 K 4.3888 8.1855 124.7293 57.7176 35.0250 176.5303 114 S 4.4302 7.9009 112.9838 58.2157 65.2184 174.4937 115 M 4.1052 8.5489 125.2495 58.6997 31.9704 177.9162 116 A 4.1064 8.1004 120.4035 55.4081 18.4714 179.1046 117 L 3.9481 7.9330 115.7326 58.2711 41.9211 180.1801 118 R 4.1119 8.5567 117.9724 58.9108 29.8192 179.0538 119 L 4.0543 8.6268 120.7463 58.2236 42.2493 178.7114 120 A 3.8186 8.3604 121.1223 55.4638 18.0663 179.2982 121 N 4.6404 8.2626 113.5958 55.7161 39.0005 176.8902 122 E 4.2696 7.6713 118.8214 58.5041 29.9995 178.0608 123 L 3.9315 8.6578 121.4525 58.4673 42.1168 179.1605 124 S 4.1503 8.6859 113.1959 61.0163 62.0443 175.3725 125 D 4.4775 7.7383 118.9790 56.3052 40.8621 177.5855 126 A 4.0896 7.9353 121.0414 54.2815 18.5186 178.9705 127 A 3.9390 7.2115 117.8965 54.6944 18.8325 179.1404 128 E 4.3516 8.5924 113.5017 61.7963 30.1937 178.8692 129 N 3.9310 8.0514 115.2436 54.9930 34.7093 174.3394 130 K 4.4426 8.4160 121.3520 58.2064 34.4498 177.1613 131 G 4.1122 7.7136 109.9152 45.5586 0.0000 174.2123 132 T 4.0157 8.6651 114.4391 66.4346 68.4771 176.7755 133 A 3.9944 7.8535 122.1321 55.4280 18.2737 179.9118 134 V 3.5392 7.8549 110.3036 64.4307 31.5257 178.5298 135 K 3.9339 7.6705 119.2811 58.9343 31.9875 178.7668 136 K 3.6353 7.9256 120.3454 59.0261 31.8367 178.7526 137 R 3.8593 7.3727 118.8355 58.7698 29.7208 176.7108 138 E 4.7670 7.6928 117.0548 56.5713 30.8811 176.9797 139 D 4.5701 7.7917 117.6971 55.2784 45.4873 178.4210 140 V 3.5199 7.9006 118.2434 66.3130 31.2987 177.7457 141 H 4.2293 8.0208 113.5745 58.0839 28.6101 177.2721 142 R 4.1687 7.6351 119.2434 58.8321 30.5784 177.9073 143 M 4.1195 8.4524 118.2050 58.4146 32.5214 176.3909 144 A 4.5657 8.2234 120.5204 51.6471 21.3050 176.9356 145 E 3.6235 8.7815 117.3003 57.0735 28.5422 173.7715 146 A 4.5476 7.5228 117.3752 54.5455 21.1782 177.7931 147 N 4.5750 8.4362 108.5170 54.0444 38.3811 177.2187 148 K 4.0132 7.9335 120.2299 58.4827 32.2751 177.6091 149 A 4.1953 8.1065 120.0401 54.4260 18.6090 177.3369 150 F 4.6043 8.2170 115.3436 56.9665 39.4940 175.9281 151 A 4.2234 8.0312 128.2623 52.6052 18.1621 178.1503 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 P 0.00 4.40 0.00 2.19 2.25 0.00 3.74 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 1.88 1.96 0.00 2 R 8.11 3.85 0.00 1.87 2.00 0.00 3.18 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 3 R 7.46 4.44 0.00 1.89 1.87 0.00 3.09 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 4 R 7.63 4.14 0.00 1.77 1.91 0.00 3.30 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 5 V 7.65 3.96 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 0.85 0.00 0.00 0.93 0.00 0.00 6 I 7.70 4.23 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 1.35 0.39 0.96 0.00 0.00 7 G 8.01 4.15 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 0.00 0.00 0.00 8 Q 7.87 5.09 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.93 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 9 R 8.43 4.04 0.00 1.94 1.98 0.00 2.99 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 10 K 8.31 4.68 0.00 1.74 1.74 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.38 7.81 11 I 7.54 4.67 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 1.30 0.66 0.91 0.00 0.00 12 L 8.54 3.99 0.00 1.67 1.68 0.93 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 13 P 0.00 4.53 0.00 2.15 2.19 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 14 D 8.55 4.54 0.00 2.95 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 15 P 0.00 4.56 0.00 2.30 2.25 0.00 3.90 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 2.28 2.09 0.00 16 K 8.75 4.50 0.00 1.33 1.30 0.00 1.35 0.00 0.00 0.62 0.00 0.00 2.67 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.68 0.96 7.81 17 F 8.39 4.64 0.00 3.32 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 18 G 8.93 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 0.00 0.00 0.00 19 S 7.88 4.66 0.00 3.82 3.65 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 20 E 8.79 3.96 0.00 2.01 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 2.34 0.00 21 L 7.94 3.91 0.00 1.54 1.45 1.01 0.55 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 22 L 7.72 3.63 0.00 1.27 1.53 0.51 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.94 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.31 3.80 0.00 2.01 1.93 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.70 7.81 25 F 8.76 4.37 0.00 3.12 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 26 V 8.12 3.29 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 0.64 0.00 0.00 0.97 0.00 0.00 27 N 7.67 4.21 0.00 2.86 2.86 0.00 0.00 7.08 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 28 I 7.30 3.71 1.97 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 1.62 0.78 0.88 0.00 0.00 29 L 7.04 4.14 0.00 1.15 1.48 0.74 0.81 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 30 M 7.22 4.07 0.00 2.02 2.00 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 2.67 2.47 0.00 31 V 8.22 4.18 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 0.77 0.00 0.00 0.91 0.00 0.00 32 D 9.94 4.41 0.00 2.78 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 33 G 8.01 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 0.00 0.00 0.00 34 K 7.87 4.40 0.00 1.88 1.74 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.40 7.81 35 K 7.88 3.95 0.00 1.81 1.80 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.51 7.81 36 S 8.17 4.14 0.00 3.88 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 37 T 7.87 4.06 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 38 A 7.80 3.97 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 39 E 8.07 3.62 0.00 2.34 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 0.00 2.65 2.50 0.00 40 S 7.90 4.31 0.00 4.06 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 41 I 7.76 4.06 1.82 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 1.41 1.20 0.92 0.00 0.00 42 V 7.29 3.48 1.57 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 1.18 0.00 0.00 0.73 0.00 0.00 43 Y 7.43 4.33 0.00 3.16 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.85 4.20 0.00 3.98 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 45 A 7.58 4.36 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 46 L 8.27 4.23 0.00 2.08 1.91 1.04 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.22 4.25 0.00 2.50 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 48 T 7.62 4.01 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 1.31 0.00 0.00 49 L 7.92 4.14 0.00 1.95 1.84 0.94 1.06 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 50 A 7.65 4.16 1.56 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 51 Q 8.07 3.85 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 52 R 7.63 4.04 0.00 2.02 1.96 0.00 3.28 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 53 S 7.93 4.49 0.00 4.01 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.58 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 0.00 0.00 0.00 55 K 7.97 4.26 0.00 1.74 1.81 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.72 1.53 7.81 56 S 7.85 3.68 0.00 4.00 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 57 E 8.54 4.68 0.00 2.12 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 2.56 2.60 0.00 58 L 8.26 4.01 0.00 1.78 1.73 0.97 1.06 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 59 E 8.11 4.38 0.00 2.16 2.19 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 2.35 2.32 0.00 60 A 7.66 3.98 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 61 F 7.78 3.72 0.00 2.88 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 62 E 8.54 3.94 0.00 2.12 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 2.45 2.38 0.00 63 V 7.95 3.53 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 0.85 0.00 0.00 0.95 0.00 0.00 64 A 7.40 4.04 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 65 L 7.73 3.77 0.00 1.12 1.60 0.58 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.80 4.25 0.00 2.31 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 2.31 2.34 0.00 67 N 7.54 4.56 0.00 2.89 2.84 0.00 0.00 6.89 8.80 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 68 V 8.04 3.93 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 1.22 0.00 0.00 0.98 0.00 0.00 69 R 7.00 3.65 0.00 1.97 1.84 0.00 3.35 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 70 P 0.00 5.02 0.00 2.40 2.52 0.00 3.85 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 71 T 8.62 4.36 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 1.26 0.00 0.00 72 V 7.33 4.70 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 0.77 0.00 0.00 0.96 0.00 0.00 73 E 9.31 4.58 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 74 V 8.41 4.86 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 0.67 0.00 0.00 0.91 0.00 0.00 75 K 9.23 4.39 0.00 1.69 1.65 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.37 7.81 76 S 8.73 4.18 0.00 3.89 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 77 R 8.79 4.19 0.00 2.10 2.03 0.00 3.57 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 78 R 7.87 4.40 0.00 1.89 1.94 0.00 3.43 0.00 0.00 3.02 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 79 V 6.96 3.58 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 0.65 0.00 0.00 0.88 0.00 0.00 80 G 7.43 3.78 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 0.00 0.00 0.00 81 G 8.82 4.04 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 0.00 0.00 0.00 82 S 7.67 4.86 0.00 4.13 4.06 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 83 T 8.81 3.83 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 1.20 0.00 0.00 84 Y 7.96 3.51 0.00 3.00 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 85 Q 7.55 4.09 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 86 V 7.93 4.20 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 1.10 0.00 0.00 1.18 0.00 0.00 87 P 0.00 4.99 0.00 2.14 2.05 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 88 V 8.95 4.59 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 0.81 0.00 0.00 0.95 0.00 0.00 89 E 8.71 4.69 0.00 1.87 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 2.30 2.38 0.00 90 V 7.94 3.81 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 0.76 0.00 0.00 0.93 0.00 0.00 91 R 8.42 4.43 0.00 1.89 1.87 0.00 3.13 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 92 P 0.00 5.08 0.00 2.04 2.03 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 93 V 6.97 4.31 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 0.58 0.00 0.00 0.93 0.00 0.00 94 R 7.56 4.17 0.00 1.84 1.88 0.00 3.19 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 95 R 8.12 3.47 0.00 2.10 1.79 0.00 3.20 0.00 0.00 3.26 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 96 N 8.16 4.07 0.00 2.96 3.11 0.00 0.00 5.84 7.46 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 97 A 8.07 4.13 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 98 L 7.67 3.22 0.00 1.21 0.13 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.23 3.93 1.39 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 0.00 0.00 0.00 100 M 8.64 3.99 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.58 0.00 101 R 8.37 3.87 0.00 1.70 1.76 0.00 3.05 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 102 W 8.38 4.56 0.00 3.47 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 0.00 103 I 8.14 3.77 2.19 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.71 0.93 0.00 0.00 104 V 8.47 3.66 2.27 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 0.93 0.00 0.00 0.99 0.00 0.00 105 E 9.84 4.20 0.00 2.06 2.29 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 2.38 2.53 0.00 106 A 8.24 4.40 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 0.00 107 A 7.84 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.71 3.96 0.00 2.00 2.18 0.00 3.29 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 109 K 7.49 4.39 0.00 1.92 1.81 0.00 1.77 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.66 1.59 7.81 110 R 7.77 4.34 0.00 1.73 2.00 0.00 3.43 0.00 0.00 3.60 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 111 G 8.31 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 7.24 4.95 0.00 2.68 1.76 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 0.00 113 K 8.19 4.39 0.00 1.69 1.60 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.33 7.81 114 S 7.90 4.43 0.00 3.90 3.73 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 0.00 115 M 8.55 4.11 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 116 A 8.10 4.11 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 0.00 117 L 7.93 3.95 0.00 1.71 1.77 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.56 4.11 0.00 1.98 1.99 0.00 3.17 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 119 L 8.63 4.05 0.00 1.92 1.86 1.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.36 3.82 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 0.00 121 N 8.26 4.64 0.00 2.73 2.91 0.00 0.00 7.04 7.23 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 0.00 122 E 7.67 4.27 0.00 2.22 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 2.31 2.58 0.00 123 L 8.66 3.93 0.00 1.83 1.64 0.71 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.69 4.15 0.00 3.88 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 0.00 125 D 7.74 4.48 0.00 3.22 2.68 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 0.00 126 A 7.94 4.09 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.21 3.94 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 0.00 128 E 8.59 4.35 0.00 2.07 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 2.19 2.26 0.00 129 N 8.05 3.93 0.00 2.87 3.20 0.00 0.00 6.60 7.31 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 0.00 130 K 8.42 4.44 0.00 1.82 1.84 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.32 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.48 7.81 131 G 7.71 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 T 8.67 4.02 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 1.18 0.00 0.00 133 A 7.85 3.99 1.44 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 0.00 0.00 134 V 7.85 3.54 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 0.86 0.00 0.00 0.98 0.00 0.00 135 K 7.67 3.93 0.00 1.95 1.90 0.00 1.47 0.00 0.00 1.53 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.39 7.81 136 K 7.93 3.64 0.00 1.32 0.95 0.00 1.17 0.00 0.00 1.16 0.00 0.00 2.71 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.21 7.81 137 R 7.37 3.86 0.00 1.92 2.10 0.00 3.15 0.00 0.00 3.41 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 138 E 7.69 4.77 0.00 2.05 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 0.00 2.50 2.44 0.00 139 D 7.79 4.57 0.00 2.64 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 0.00 0.00 0.00 0.00 140 V 7.90 3.52 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 1.15 0.00 0.00 0.71 0.00 0.00 141 H 8.02 4.23 0.00 3.27 3.34 0.00 5.94 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 7.64 4.17 0.00 1.86 1.95 0.00 3.35 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 143 M 8.45 4.12 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 144 A 8.22 4.57 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 0.00 145 E 8.78 3.62 0.00 2.12 2.19 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 2.20 2.30 0.00 146 A 7.52 4.55 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 0.00 147 N 8.44 4.57 0.00 2.87 2.77 0.00 0.00 6.81 7.69 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 0.00 148 K 7.93 4.01 0.00 1.85 1.87 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.43 7.81 149 A 8.11 4.20 1.27 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 0.00 0.00 150 F 8.22 4.60 0.00 3.08 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 0.00 151 A 8.03 4.22 1.26 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