NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0001 8.3549 109.7361 45.5687 0.0000 173.8370 2 S 4.3285 8.3647 116.1087 57.4740 67.0181 172.3319 3 S 4.4990 7.8751 112.9616 58.3771 66.8700 175.1860 4 G 4.0722 8.4470 109.0619 44.3431 0.0000 174.8059 5 S 4.5302 8.2559 117.8997 57.8069 62.6235 173.7384 6 S 3.4801 8.9074 116.3307 61.5339 60.8609 173.2632 7 G 3.6402 7.8334 112.2945 46.1854 0.0000 167.7724 8 A 4.6710 7.8985 122.6365 51.8167 21.9784 173.5166 9 A 4.2955 8.3717 117.1848 53.4760 21.6700 177.2281 10 S 4.4730 8.7873 112.4701 59.6320 60.2821 171.5054 11 L 4.7094 8.4227 120.3387 51.7929 42.5559 176.6556 12 G 4.6821 6.3737 113.0516 45.4699 0.0000 170.7976 13 S 4.7283 7.5720 114.4054 57.7605 66.9399 172.9867 14 Q 4.6430 8.4705 117.4259 55.7816 32.1797 174.4426 15 K 3.8040 8.7133 123.5272 55.7888 33.4871 178.3386 16 G 4.3394 8.2371 113.4069 43.8470 0.0000 177.1788 17 G 4.0386 7.8705 112.6677 46.2417 0.0000 169.2292 18 I 4.6135 8.4151 123.7047 61.2562 39.8755 174.1971 19 T 4.1039 7.8160 115.7183 62.4041 69.3452 171.7190 20 K 4.3921 7.3810 124.5823 56.4893 34.8705 172.6559 21 H 5.5351 7.5995 119.8020 53.7096 31.6370 172.6895 22 G 4.4196 7.9010 108.4116 46.3239 0.0000 171.0006 23 W 5.2484 9.1481 120.4396 56.0851 29.9961 176.3285 24 L 4.9200 9.5326 125.7388 53.3446 45.0645 175.1579 25 Y 5.2284 8.2976 116.4552 55.1045 39.3041 175.4689 26 K 4.5824 7.6048 125.1250 55.6773 34.0518 175.6807 27 G 4.4195 7.9010 111.1758 45.1204 0.0000 170.7455 28 N 4.6558 9.0211 115.9551 53.3509 40.2146 171.8018 29 M 3.2710 9.0788 126.0650 54.9260 32.7994 175.6735 30 N 4.4126 8.3374 118.9371 52.7580 42.9829 173.7716 31 S 3.7817 8.3501 114.5479 61.7533 63.0023 176.7824 32 A 4.0703 7.9850 123.6334 53.0573 19.4595 178.4682 33 I 3.8628 8.2176 116.9823 64.1570 38.4421 177.6874 34 S 4.1251 8.1131 115.5525 61.2023 62.2968 176.7364 35 V 3.8766 7.5376 120.2689 64.1237 32.1934 177.4561 36 T 3.9773 7.5219 114.1771 65.0025 66.8712 175.2935 37 M 4.2407 8.0779 116.9546 55.7044 32.6236 176.6252 38 R 3.6410 8.6718 117.4082 57.3260 28.5947 175.6695 39 S 3.7415 7.9299 112.7338 57.9236 59.0418 169.0153 40 F 4.2484 8.3451 117.5104 58.3675 39.6549 175.6589 41 K 4.4629 8.4973 122.9125 54.7441 34.6690 175.4394 42 R 4.7523 8.0341 122.6802 54.9257 31.8403 175.1352 43 R 4.6538 9.1497 124.9315 54.8701 34.6069 173.7192 44 F 4.5117 8.3501 126.3747 57.3405 40.0865 174.5586 45 F 4.5199 9.0637 127.2571 56.7549 40.0235 174.4708 46 H 5.1042 9.6613 125.3955 54.2121 32.2609 172.5783 47 L 5.0942 8.3912 127.7246 53.7454 43.6180 175.3620 48 I 4.4504 8.3270 124.9009 59.2704 42.1025 173.3771 49 Q 4.4668 8.1948 129.3313 54.4921 29.7799 175.2167 50 L 4.0279 8.7117 127.2732 54.2233 43.1168 178.0195 51 G 4.2309 8.0302 109.0549 42.9326 0.0000 171.4351 52 D 4.6488 7.0671 120.1057 54.1504 47.3800 176.2224 53 G 4.8780 7.2023 116.5725 47.0236 0.0000 172.8818 54 S 4.6022 7.6410 115.3375 58.6033 65.2605 172.6868 55 Y 5.3034 8.6942 116.8443 56.3187 40.9287 174.5524 56 N 5.3865 9.4587 120.6813 51.3867 42.5312 173.2912 57 L 4.7407 8.6465 126.0490 54.1647 43.3136 174.6008 58 N 5.2019 9.1987 125.4856 51.1737 41.2035 173.9123 59 F 5.1624 7.2370 118.3452 55.2277 40.7110 174.4100 60 Y 4.9649 9.3092 119.5257 55.6118 41.1160 176.9212 61 K 4.0945 8.7594 118.9296 59.7090 33.2243 176.2331 62 D 4.2495 7.3576 116.9022 53.2460 43.9923 174.1235 63 E 2.0000 8.5131 118.0153 58.9250 29.6544 176.6929 64 K 3.9539 7.6592 117.5054 56.7479 31.8120 176.7099 65 I 3.4917 7.4363 125.3006 62.6114 37.1567 176.2626 66 S 4.5469 8.8984 114.6298 58.4680 61.5831 170.1030 67 K 4.3402 7.5128 116.1177 55.5571 33.2002 175.5442 68 E 3.9796 8.5457 120.0463 55.9837 29.4162 175.5031 69 P 3.6249 0.0000 0.0000 61.3313 32.2747 176.5633 70 K 3.7688 7.7999 118.2056 58.6831 32.2665 177.3810 71 G 3.6340 5.3800 104.3006 45.6748 0.0000 172.2268 72 S 4.8889 8.0398 113.5245 56.4310 66.3022 173.4619 73 I 3.8248 8.8503 125.0624 59.5454 38.0282 176.3345 74 F 5.3972 7.8672 127.3065 55.5128 37.0164 175.6515 75 L 4.5413 8.1461 123.9150 57.8510 42.1661 179.5536 76 D 4.4916 8.4061 116.6365 56.6587 41.2302 176.9222 77 S 5.2658 9.2673 113.3938 58.7663 64.2822 174.3478 78 C 3.8001 7.6308 119.0037 60.3415 31.6513 173.5444 79 M 4.2387 9.5237 127.8121 56.9809 32.1949 176.5359 80 G 4.1009 7.3036 104.3618 46.2038 0.0000 171.6816 81 V 4.9421 8.3927 120.6696 61.4836 32.7533 175.8316 82 V 4.4436 9.1012 121.2316 60.0571 34.9570 174.6078 83 Q 4.3790 8.4257 120.2503 54.9504 29.7029 175.1794 84 N 4.3195 9.1291 124.9615 50.8815 37.4295 174.8956 85 N 5.4486 8.5275 121.6795 55.3518 38.8108 175.8696 86 K 3.7918 7.6532 115.0300 59.6383 31.7974 177.9472 87 V 3.2516 7.1466 117.1962 65.6413 32.0911 176.4113 88 R 4.6507 7.2095 115.0633 53.7795 34.2816 176.9957 89 R 3.6140 8.4052 117.8141 58.9497 30.4298 177.6885 90 F 5.2240 7.5171 116.0665 55.2993 39.0799 173.2267 91 A 5.3512 8.0999 121.7788 49.8699 22.9198 175.2532 92 F 5.3463 8.7212 117.4412 54.9680 41.5364 173.6330 93 E 4.9832 8.7295 122.3265 54.9132 31.9620 174.6171 94 L 4.8807 9.1545 127.2641 53.4221 43.4365 176.2790 95 K 4.6047 8.9205 125.6338 55.7407 32.1255 177.3723 96 M 4.5384 8.3750 125.5890 54.7510 33.2857 176.3426 97 Q 4.5632 8.5016 114.9159 56.5349 30.3364 175.2558 98 D 4.6004 8.0618 117.9329 54.9613 41.5670 175.9701 99 K 3.5977 8.2181 116.8522 56.4427 29.0960 174.7072 100 S 5.0093 7.2245 117.4225 57.8800 64.3831 174.8007 101 S 5.2030 7.1972 114.0262 58.5923 64.9587 174.1337 102 Y 4.6229 8.2202 119.9502 56.5911 40.6673 174.6143 103 L 4.5429 8.3921 124.9521 53.8439 43.2083 175.0108 104 L 4.3583 8.4202 126.5339 52.4801 44.3400 175.7580 105 A 4.8968 7.5015 119.8591 51.1798 22.5780 175.7685 106 A 4.9869 8.7111 123.9856 50.3070 21.3159 176.5945 107 D 4.3765 8.7682 117.7562 56.4849 41.8016 176.7719 108 S 4.2528 7.4818 113.2001 55.0808 67.8760 174.3975 109 E 3.5089 7.2431 122.0237 59.9569 28.6953 179.2996 110 V 3.6490 7.5976 119.5690 64.7427 30.3291 177.7473 111 E 3.5046 8.1019 119.5919 58.5049 29.1917 178.7962 112 M 4.5158 7.9024 118.1024 57.5156 32.4680 177.8254 113 E 3.8873 8.7287 118.9521 59.0023 29.9789 178.4042 114 E 3.7784 8.9609 120.6261 59.1116 29.5630 179.3272 115 W 4.3725 7.3324 118.6433 60.1958 29.2999 178.5322 116 I 3.7430 7.0183 119.4477 64.7242 36.3312 178.2766 117 T 4.1833 7.9689 116.2798 66.2574 68.5527 176.7660 118 I 3.7701 8.4670 122.9677 63.8042 37.0337 178.0002 119 L 4.1384 8.8968 119.8346 58.4703 41.0982 179.4627 120 N 4.2955 7.8175 114.4825 56.6856 37.9750 177.0725 121 K 3.8720 8.1497 119.6254 59.9971 32.1331 179.2544 122 I 3.8987 8.2052 119.6989 64.3394 36.8276 178.6208 123 L 4.0944 8.4877 120.1135 58.0805 41.9939 179.2635 124 Q 4.2145 9.4907 118.1110 59.0706 28.6123 178.9188 125 L 4.0615 9.2483 120.5873 57.7952 41.7333 179.1537 126 N 4.0196 8.7720 116.9974 56.2896 38.4040 177.2232 127 F 3.9857 8.1360 121.7200 61.3447 39.5638 177.1157 128 E 4.3282 8.3188 117.1954 58.8017 29.3256 178.8760 129 A 4.0262 8.8274 122.1525 54.7288 18.4143 179.4195 130 A 4.0338 7.8933 118.9443 55.8415 18.0963 179.9487 131 M 4.3506 7.7351 115.3377 58.2049 31.7062 179.0275 132 Q 3.8955 7.7421 117.8811 58.6962 29.1078 177.8479 133 E 4.1241 8.8384 119.8756 58.8990 29.6093 178.5210 134 K 3.9551 8.2265 119.3738 59.0868 33.2540 178.4762 135 R 4.8099 6.9508 116.5918 53.1443 28.2024 177.6392 136 N 4.3174 7.4523 112.9054 53.6053 40.8241 173.1551 137 G 3.7909 8.7151 114.1004 47.2237 0.0000 172.0767 138 D 4.3581 7.8013 123.5408 54.6472 40.8560 176.5009 139 S 4.6942 7.9512 115.5971 57.8015 65.9428 174.2068 140 H 5.2150 8.5477 120.9858 54.8057 33.4552 171.9050 141 E 5.1553 8.2854 122.5616 55.4812 34.8269 173.7723 142 D 4.4498 8.2189 117.8135 52.7000 41.8074 174.6678 143 D 4.6085 8.2267 122.5805 51.4151 42.2538 174.5714 144 E 4.8211 8.2337 117.5869 55.9167 31.0153 174.8852 145 S 4.3572 8.4776 120.2301 57.5612 65.3081 173.5102 146 G 3.8795 8.8852 112.3979 45.9273 0.0000 171.0781 147 P 4.2967 0.0000 0.0000 63.5575 31.9220 177.2222 148 S 4.6088 7.3871 111.2600 57.8467 64.4943 175.6033 149 S 4.3785 8.8906 112.8171 58.5030 64.8052 174.9601 150 G 4.3589 8.8135 114.1553 46.1589 0.0000 173.0597 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 G 8.35 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 0.00 0.00 0.00 2 S 8.36 4.33 0.00 3.88 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 3 S 7.88 4.50 0.00 3.80 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 4 G 8.45 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 5 S 8.26 4.53 0.00 3.94 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 6 S 8.91 3.48 0.00 3.92 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 7 G 7.83 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.90 4.67 1.21 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 9 A 8.37 4.30 1.23 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 0.00 0.00 10 S 8.79 4.47 0.00 4.04 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 11 L 8.42 4.71 0.00 1.47 1.60 0.92 0.88 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 12 G 6.37 4.68 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 0.00 0.00 0.00 13 S 7.57 4.73 0.00 3.86 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 14 Q 8.47 4.64 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.16 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 15 K 8.71 3.80 0.00 1.86 1.79 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.43 7.81 16 G 8.24 4.34 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 0.00 17 G 7.87 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 18 I 8.42 4.61 1.96 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.47 0.93 0.00 0.00 19 T 7.82 4.10 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 1.27 0.00 0.00 20 K 7.38 4.39 0.00 1.44 1.04 0.00 1.10 0.00 0.00 0.61 0.00 0.00 2.69 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.34 7.81 21 H 7.60 5.54 0.00 3.03 3.22 0.00 5.32 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 22 G 7.90 4.42 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 0.00 23 W 9.15 5.25 0.00 3.34 3.45 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 24 L 9.53 4.92 0.00 0.62 0.66 -0.73 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.30 5.23 0.00 2.82 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.60 4.58 0.00 1.80 1.42 0.00 0.94 0.00 0.00 0.66 0.00 0.00 2.52 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.14 7.81 27 G 7.90 4.42 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 0.00 28 N 9.02 4.66 0.00 2.69 2.99 0.00 0.00 6.92 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 29 M 9.08 3.27 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 30 N 8.34 4.41 0.00 2.68 2.70 0.00 0.00 7.07 7.57 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 31 S 8.35 3.78 0.00 3.85 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 32 A 7.99 4.07 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 33 I 8.22 3.86 1.84 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 1.56 1.15 0.87 0.00 0.00 34 S 8.11 4.13 0.00 3.89 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 35 V 7.54 3.88 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 0.77 0.00 0.00 0.94 0.00 0.00 36 T 7.52 3.98 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 37 M 8.08 4.24 0.00 1.70 2.04 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 38 R 8.67 3.64 0.00 2.02 2.13 0.00 3.26 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 39 S 7.93 3.74 0.00 4.09 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 40 F 8.35 4.25 0.00 2.86 3.28 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 41 K 8.50 4.46 0.00 1.58 1.61 0.00 1.64 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.49 7.81 42 R 8.03 4.75 0.00 0.92 1.74 0.00 3.45 0.00 0.00 3.54 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 43 R 9.15 4.65 0.00 1.89 1.61 0.00 3.18 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 44 F 8.35 4.51 0.00 1.75 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 45 F 9.06 4.52 0.00 2.73 2.46 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 46 H 9.66 5.10 0.00 3.08 3.34 0.00 5.58 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 47 L 8.39 5.09 0.00 1.98 1.83 1.16 1.29 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 48 I 8.33 4.45 1.75 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 1.04 1.18 0.80 0.00 0.00 49 Q 8.19 4.47 0.00 1.57 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.89 0.00 0.00 0.00 0.00 0.00 2.40 3.01 0.00 50 L 8.71 4.03 0.00 1.66 1.63 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.03 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 0.00 0.00 0.00 0.00 52 D 7.07 4.65 0.00 2.59 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.20 4.88 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 0.00 0.00 0.00 54 S 7.64 4.60 0.00 4.02 4.09 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 55 Y 8.69 5.30 0.00 2.91 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 56 N 9.46 5.39 0.00 2.65 2.90 0.00 0.00 6.46 6.87 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 57 L 8.65 4.74 0.00 1.90 1.58 1.04 0.39 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 58 N 9.20 5.20 0.00 2.64 2.28 0.00 0.00 6.26 7.75 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 59 F 7.24 5.16 0.00 2.20 1.45 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 60 Y 9.31 4.96 0.00 3.06 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.76 4.09 0.00 1.90 1.95 0.00 1.55 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.50 7.81 62 D 7.36 4.25 0.00 2.56 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 63 E 8.51 2.00 0.00 1.64 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 1.85 2.26 0.00 64 K 7.66 3.95 0.00 1.67 1.73 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.37 7.81 65 I 7.44 3.49 0.56 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.33 0.10 0.00 0.00 66 S 8.90 4.55 0.00 3.97 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 67 K 7.51 4.34 0.00 1.86 1.81 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.48 7.81 68 E 8.55 3.98 0.00 1.90 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 69 P 0.00 3.62 0.00 1.27 0.49 0.00 3.49 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 70 K 7.80 3.77 0.00 1.64 1.90 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.27 1.48 7.81 71 G 5.38 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 72 S 8.04 4.89 0.00 3.70 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.85 3.82 1.75 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.51 0.99 0.00 0.00 74 F 7.87 5.40 0.00 3.14 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 75 L 8.15 4.54 0.00 1.99 1.90 1.13 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.41 4.49 0.00 2.69 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 77 S 9.27 5.27 0.00 4.22 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 78 C 7.63 3.80 0.00 3.03 3.16 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 79 M 9.52 4.24 0.00 2.07 2.23 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 2.84 2.70 0.00 80 G 7.30 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 81 V 8.39 4.94 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 0.99 0.00 0.00 1.11 0.00 0.00 82 V 9.10 4.44 2.14 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 0.83 0.00 0.00 1.05 0.00 0.00 83 Q 8.43 4.38 0.00 1.95 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.20 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 84 N 9.13 4.32 0.00 2.82 2.73 0.00 0.00 7.25 8.21 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 85 N 8.53 5.45 0.00 2.81 3.10 0.00 0.00 7.30 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.65 3.79 0.00 1.76 1.80 0.00 1.82 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.38 7.81 87 V 7.15 3.25 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 -0.05 0.00 0.00 0.89 0.00 0.00 88 R 7.21 4.65 0.00 1.81 1.74 0.00 3.14 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 89 R 8.41 3.61 0.00 1.12 0.66 0.00 2.97 0.00 0.00 2.89 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.24 0.00 90 F 7.52 5.22 0.00 2.99 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 91 A 8.10 5.35 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 92 F 8.72 5.35 0.00 3.17 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 93 E 8.73 4.98 0.00 2.08 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 2.26 2.29 0.00 94 L 9.15 4.88 0.00 1.81 1.79 1.13 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.92 4.60 0.00 1.84 1.80 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.60 7.81 96 M 8.38 4.54 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.76 0.00 97 Q 8.50 4.56 0.00 2.23 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.40 7.19 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 98 D 8.06 4.60 0.00 2.76 2.75 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 99 K 8.22 3.60 0.00 1.90 1.80 0.00 1.95 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.35 7.81 100 S 7.22 5.01 0.00 3.84 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 S 7.20 5.20 0.00 3.91 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 0.00 102 Y 8.22 4.62 0.00 2.86 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 0.00 103 L 8.39 4.54 0.00 1.74 1.52 1.29 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.42 4.36 0.00 0.68 0.13 0.62 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.50 4.90 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 0.00 106 A 8.71 4.99 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 0.00 107 D 8.77 4.38 0.00 2.71 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 0.00 108 S 7.48 4.25 0.00 3.70 3.42 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 0.00 109 E 7.24 3.51 0.00 2.12 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 2.09 2.25 0.00 110 V 7.60 3.65 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 0.73 0.00 0.00 0.85 0.00 0.00 111 E 8.10 3.50 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 2.49 2.39 0.00 112 M 7.90 4.52 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.09 2.47 0.00 113 E 8.73 3.89 0.00 2.11 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 0.00 2.33 2.26 0.00 114 E 8.96 3.78 0.00 1.56 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 2.20 2.27 0.00 115 W 7.33 4.37 0.00 3.30 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 0.00 116 I 7.02 3.74 1.85 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 -0.06 0.85 0.00 0.00 117 T 7.97 4.18 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 1.16 0.00 0.00 118 I 8.47 3.77 2.01 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.44 1.23 0.00 0.00 119 L 8.90 4.14 0.00 1.79 1.90 1.08 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 120 N 7.82 4.30 0.00 3.05 2.90 0.00 0.00 7.06 7.57 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 0.00 121 K 8.15 3.87 0.00 2.03 1.81 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.55 7.81 122 I 8.21 3.90 1.97 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.36 1.00 0.00 0.00 123 L 8.49 4.09 0.00 1.75 1.81 1.15 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 9.49 4.21 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 125 L 9.25 4.06 0.00 1.81 1.67 0.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 126 N 8.77 4.02 0.00 2.97 2.93 0.00 0.00 6.73 8.87 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 0.00 127 F 8.14 3.99 0.00 3.14 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 0.00 128 E 8.32 4.33 0.00 2.10 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 2.46 2.62 0.00 129 A 8.83 4.03 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 0.00 130 A 7.89 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 7.74 4.35 0.00 2.14 2.20 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 2.77 0.00 132 Q 7.74 3.90 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 133 E 8.84 4.12 0.00 2.00 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 2.36 2.41 0.00 134 K 8.23 3.96 0.00 1.92 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.50 7.81 135 R 6.95 4.81 0.00 1.73 1.89 0.00 3.42 0.00 0.00 3.15 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 136 N 7.45 4.32 0.00 2.76 2.69 0.00 0.00 7.15 8.14 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 0.00 137 G 8.72 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 D 7.80 4.36 0.00 2.68 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 S 7.95 4.69 0.00 3.84 3.96 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 0.00 140 H 8.55 5.21 0.00 3.18 3.14 0.00 5.64 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.29 5.16 0.00 1.81 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 142 D 8.22 4.45 0.00 2.70 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 0.00 143 D 8.23 4.61 0.00 2.71 2.61 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 0.00 144 E 8.23 4.82 0.00 1.86 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 2.04 2.18 0.00 145 S 8.48 4.36 0.00 3.80 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 0.00 146 G 8.89 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 0.00 0.00 0.00 147 P 0.00 4.30 0.00 2.19 2.18 0.00 3.83 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 1.98 1.94 0.00 148 S 7.39 4.61 0.00 3.95 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 S 8.89 4.38 0.00 3.79 3.71 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 0.00 150 G 8.81 4.36 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 0.00