NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8377 8.1100 120.0855 55.2564 34.0724 173.7013 2 K 4.7736 8.4922 126.5188 54.8824 33.8171 173.5182 3 I 4.9149 8.7062 128.9989 59.4319 40.6999 173.8525 4 L 4.8583 8.8085 129.7622 53.7893 43.8759 175.1965 5 V 4.8234 8.8390 127.3421 61.6844 33.1720 174.1681 6 I 5.0835 8.8765 130.2641 59.8666 39.5019 174.8523 7 Q 4.8530 9.2134 126.5111 54.3027 31.2965 176.0860 8 G 4.2193 8.7694 116.4035 44.1089 0.0000 171.3597 9 P 4.4601 0.0000 0.0000 63.8582 32.0695 177.6131 10 N 4.3932 9.1765 115.9943 54.0558 38.3025 176.7630 11 L 3.9424 7.3724 118.3886 57.4174 41.7883 178.9743 12 N 4.4206 7.9449 114.6046 55.3245 37.6343 175.4897 13 M 4.3373 7.8863 118.0461 55.3234 32.1350 176.0032 14 L 4.0426 7.4858 120.5105 56.5160 42.1900 178.8417 15 G 4.0168 8.8429 110.5714 46.0937 0.0000 173.9180 16 H 4.7263 7.8237 115.1181 56.6091 29.7671 175.5105 17 R 4.5554 7.5809 115.8936 55.4886 34.6568 174.4439 18 D 4.3285 8.7273 116.5706 54.7029 39.3411 172.5113 19 P 4.7521 0.0000 0.0000 65.0491 32.0866 179.9098 20 R 3.9067 8.0430 117.1572 58.5389 30.3804 177.3783 21 L 3.9972 7.7370 118.3345 56.9833 42.3171 176.7968 22 Y 4.5584 7.7991 111.9541 57.2727 38.6170 176.5235 23 G 4.0248 8.2961 106.9138 45.7867 0.0000 174.0211 24 M 4.2959 8.1063 116.2796 55.4738 32.8639 177.2229 25 V 3.8581 7.6301 119.6992 62.6811 32.3562 176.3076 26 T 4.4887 8.9858 120.0662 59.9928 71.1828 175.7003 27 L 3.7082 8.1407 122.3177 58.3224 42.1851 178.4354 28 D 4.1630 7.9363 118.2594 57.6165 40.7695 178.7868 29 Q 3.9504 7.9208 118.2682 58.9805 28.7887 178.9420 30 I 3.6375 7.6383 120.7914 64.7352 37.0696 178.2431 31 H 4.0520 7.7805 116.9528 58.3201 28.2228 177.5276 32 E 3.9296 7.9588 121.3001 59.2883 29.3601 178.8735 33 I 3.7571 7.9098 119.8400 64.5443 37.0815 178.3690 34 M 4.8354 7.8723 120.7799 57.8372 31.8819 178.7828 35 Q 4.1367 8.1192 117.8512 59.4300 28.9618 178.7985 36 T 3.9514 8.3547 117.0945 66.6967 67.9424 176.3848 37 F 4.1966 8.1150 122.7847 61.1057 39.4609 177.5677 38 V 3.4440 8.1456 118.0508 65.9997 31.1783 177.8820 39 K 4.0549 8.1958 118.6265 59.2479 31.8319 178.8220 40 Q 4.3876 8.1138 115.9055 57.0815 28.6107 177.1503 41 G 3.8230 7.0263 106.7172 43.9791 0.0000 172.8199 42 N 4.0640 8.7641 116.9821 53.8413 36.6524 174.8922 43 L 4.2135 7.7084 117.2972 54.4690 42.7646 178.5931 44 D 4.6265 8.3965 124.2833 53.1335 39.5164 173.7491 45 V 4.6649 7.5873 120.2203 60.6315 35.2488 173.5769 46 E 4.6536 9.8492 128.4842 54.5885 31.6144 175.1812 47 L 4.6889 8.4602 125.0073 53.9032 43.1965 175.8975 48 E 4.4894 8.5693 123.3836 54.2952 32.5833 174.3182 49 F 5.3906 8.7015 124.8298 55.8740 41.6362 175.0729 50 F 4.9334 9.3263 125.0340 57.0612 42.6741 172.6155 51 Q 4.9981 8.1360 127.0403 54.7065 31.3217 174.1630 52 T 4.5300 8.3006 118.4053 61.4510 70.6363 172.9850 53 N 4.6724 9.0996 122.4468 53.3605 39.6012 175.3577 54 F 4.7364 8.5975 119.6189 55.6491 40.7430 175.8136 55 E 3.8040 8.9319 124.8615 59.4946 29.4032 179.1549 56 G 3.6716 8.1242 105.0006 47.7256 0.0000 175.4418 57 E 4.2013 8.3702 120.4597 59.2624 29.4962 179.2318 58 I 3.9586 7.9392 119.5902 64.5051 37.2173 178.5978 59 I 3.7077 7.8812 120.6158 64.4461 37.0155 178.0447 60 D 4.3460 8.5616 120.1584 57.3823 40.4165 179.0426 61 K 3.6764 7.8072 118.8410 59.4273 32.3486 178.6162 62 I 3.7647 7.9095 120.2825 64.5549 36.9674 178.4840 63 Q 3.9822 8.1630 118.8813 58.7228 28.0135 178.2102 64 E 3.9919 8.0051 120.5897 58.8844 29.3616 178.2574 65 S 4.4712 7.2669 111.4456 59.0114 62.9853 175.8385 66 V 3.7753 7.5058 122.8589 65.4852 31.6825 176.4604 67 G 3.7283 7.2704 107.8688 45.5351 0.0000 174.3138 68 S 4.6239 8.5174 119.9714 58.9651 60.9056 173.0195 69 D 4.5237 7.6095 120.9200 55.5072 43.0388 176.5987 70 Y 4.6387 7.4811 115.7340 57.0056 39.1151 175.6963 71 E 4.4409 9.2171 124.4163 57.8839 31.4594 176.1746 72 G 4.3745 7.9046 104.5374 45.0914 0.0000 171.8498 73 I 5.1998 8.8728 121.4304 59.3023 40.7927 174.7987 74 I 4.9134 8.9244 127.6898 59.7173 39.3116 174.4146 75 I 5.0091 9.0401 128.1140 59.1819 41.2706 173.6739 76 N 5.2376 9.0113 128.2335 50.4809 39.8050 173.0125 77 P 4.5137 0.0000 0.0000 62.4129 32.8214 178.1180 78 G 3.6861 8.5452 107.7407 46.0385 0.0000 175.7667 79 A 4.2434 8.2101 122.1334 54.4819 18.9093 179.4512 80 F 4.8365 7.7395 115.7857 59.4097 38.8174 177.5577 81 S 4.5668 8.0219 117.0005 61.2649 62.4382 175.9463 82 H 4.9436 8.1606 117.7779 56.3587 28.7500 176.1727 83 T 4.6765 7.9193 109.1446 61.5630 70.9477 173.1086 84 S 4.6137 8.6142 117.7508 56.7466 61.2287 174.0161 85 I 3.4187 7.7316 129.0053 63.5225 37.0010 177.6149 86 A 3.9008 7.7383 121.3449 55.2271 18.2426 179.6088 87 I 3.6672 8.0468 118.4933 64.2781 37.1491 178.4251 88 A 4.0218 7.9729 121.6739 55.4369 18.1436 179.4468 89 D 4.2779 8.3737 117.2742 57.3776 40.6404 178.8100 90 A 3.9665 7.8528 120.2869 55.1440 18.7879 179.3590 91 I 3.8092 8.0133 118.4472 65.0073 37.0306 178.5246 92 M 4.0941 7.9022 117.8438 58.3847 31.8926 178.3980 93 L 4.2163 8.0478 117.0311 56.4236 42.0547 178.7405 94 A 4.1568 7.9364 121.4425 52.8070 18.2870 178.0172 95 G 4.1182 8.2756 103.8078 46.4963 0.0000 173.1906 96 K 4.8711 7.3757 113.5337 53.1621 36.7745 175.2870 97 P 4.4160 0.0000 0.0000 63.3122 32.5090 175.2316 98 V 5.0225 8.4057 121.7558 61.2315 35.4987 173.9433 99 I 5.0257 8.6406 126.3473 59.6027 41.2208 173.7288 100 E 5.0690 8.9237 127.7906 54.7451 31.4378 174.6979 101 V 4.7773 8.7789 126.0029 61.3442 35.2180 173.7677 102 H 4.9349 9.0006 123.9210 53.9079 32.0028 174.7029 103 L 4.1743 8.9114 122.6548 57.6138 42.5482 177.5766 104 T 4.4929 7.8408 106.6490 59.6739 70.9455 174.0666 105 N 4.4515 8.1959 120.9117 52.6842 37.4252 175.1351 106 I 4.0379 8.0382 118.3730 61.7790 38.0172 177.5598 107 Q 4.0945 7.9911 119.3199 57.2374 28.8981 176.2835 108 A 4.7069 7.9248 119.8067 51.5799 20.0665 176.6985 109 R 4.6680 7.3584 117.1475 56.2250 31.8726 175.6294 110 E 3.8799 8.1951 121.5853 57.1906 30.3760 177.7866 111 E 3.8976 8.4203 120.5253 59.3990 29.6668 179.2997 112 F 4.4578 7.5616 111.8379 58.6329 38.1074 175.9187 113 R 3.8323 7.2152 119.3180 56.6875 30.4943 177.7614 114 K 4.2850 7.6666 117.0831 58.4698 32.3569 177.6041 115 N 4.2313 7.9738 117.6800 53.4011 39.6005 173.4439 116 S 4.9036 8.2507 118.3753 55.9290 64.5019 173.8378 117 Y 4.3067 8.3050 128.1687 61.2613 38.1460 178.4809 118 T 4.1921 8.1635 110.3165 64.9695 69.0070 176.4929 119 G 3.6735 8.2843 108.7339 47.3452 0.0000 175.4770 120 A 4.0779 7.8267 121.4146 54.6681 18.4409 179.0586 121 A 4.2147 7.8274 118.0923 53.4138 18.9571 177.6518 122 C 4.4751 7.1529 114.5923 58.9280 29.2765 174.1040 123 G 3.7668 8.4929 109.0343 49.3795 0.0000 173.8235 124 G 4.3712 7.7387 105.3959 45.4462 0.0000 172.2960 125 V 5.1510 8.1685 118.8010 61.2073 34.9119 174.2160 126 I 4.9563 8.9148 127.6304 59.7720 40.7220 174.3014 127 M 5.5590 8.3297 122.4930 55.0865 33.9388 175.2223 128 G 3.6480 9.2007 109.0877 45.5113 0.0000 173.6741 129 F 4.6353 7.7675 116.3588 56.1669 40.2200 177.9559 130 G 3.8665 8.0214 110.5794 45.4629 0.0000 173.2955 131 P 4.5119 0.0000 0.0000 66.0299 31.3077 177.8017 132 L 4.0617 8.2511 118.5943 58.1779 41.8236 178.9695 133 G 3.6848 8.3639 105.6679 48.1333 0.0000 175.2202 134 Y 4.1743 8.0070 118.6222 60.9771 37.9730 178.2006 135 N 3.9900 8.0490 117.1064 56.2683 38.6937 177.1786 136 M 3.9076 7.9750 119.9550 58.2147 31.9859 178.6945 137 A 3.9887 7.9728 120.9738 54.8986 18.4980 179.5665 138 L 3.9313 7.7504 117.4344 58.2436 41.6518 179.0743 139 M 4.0794 8.1815 117.8230 59.1119 32.0047 178.2475 140 A 4.0280 7.9725 120.3061 55.0961 18.4593 179.3029 141 M 3.9517 8.5359 117.1730 58.8532 32.3996 178.4802 142 V 3.5864 8.2057 118.8310 66.0507 31.5555 177.4727 143 N 4.3017 7.9960 116.5686 56.8075 38.8608 176.8106 144 I 3.6906 8.0352 121.4796 64.5402 37.1985 178.4631 145 L 4.0258 8.2704 119.6847 57.4944 41.3743 179.4085 146 A 3.9545 8.1539 120.7332 55.3254 18.4319 179.2677 147 E 3.9557 8.3377 117.1340 60.1235 29.5137 179.7503 148 M 4.1101 8.1021 118.4174 58.2026 31.7838 178.8435 149 K 3.9421 7.9560 118.5488 59.4120 32.5233 178.1547 150 A 4.1658 8.2089 120.3061 55.4552 18.3110 179.0632 151 F 4.2333 8.0705 117.6386 61.4172 39.5791 175.5898 152 Q 4.2763 8.1981 121.1031 56.2847 28.6815 176.1808 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.11 4.84 0.00 2.00 2.27 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.40 0.00 2 K 8.49 4.77 0.00 1.84 1.51 0.00 1.40 0.00 0.00 1.35 0.00 0.00 2.19 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.19 1.37 7.81 3 I 8.71 4.91 1.86 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 1.13 1.19 0.93 0.00 0.00 4 L 8.81 4.86 0.00 1.72 1.48 0.90 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.84 4.82 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 1.08 0.00 0.00 0.93 0.00 0.00 6 I 8.88 5.08 1.99 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 1.41 0.60 1.12 0.00 0.00 7 Q 9.21 4.85 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 8 G 8.77 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.46 0.00 1.82 1.77 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.44 0.00 10 N 9.18 4.39 0.00 2.78 2.87 0.00 0.00 7.12 6.30 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 11 L 7.37 3.94 0.00 1.77 1.66 0.89 0.78 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 12 N 7.94 4.42 0.00 2.79 3.03 0.00 0.00 6.06 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 13 M 7.89 4.34 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 14 L 7.49 4.04 0.00 1.78 1.73 0.90 1.04 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 15 G 8.84 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 16 H 7.82 4.73 0.00 3.32 3.34 0.00 5.61 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.58 4.56 0.00 1.76 1.79 0.00 3.51 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 18 D 8.73 4.33 0.00 2.89 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 19 P 0.00 4.75 0.00 2.26 2.30 0.00 3.93 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 2.08 1.96 0.00 20 R 8.04 3.91 0.00 1.79 1.99 0.00 3.17 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 21 L 7.74 4.00 0.00 1.39 1.34 0.60 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.80 4.56 0.00 3.03 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 23 G 8.30 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 24 M 8.11 4.30 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 25 V 7.63 3.86 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 0.79 0.00 0.00 0.93 0.00 0.00 26 T 8.99 4.49 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 27 L 8.14 3.71 0.00 1.79 1.56 0.75 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.94 4.16 0.00 2.65 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 29 Q 7.92 3.95 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 30 I 7.64 3.64 1.67 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.21 0.45 0.00 0.00 31 H 7.78 4.05 0.00 2.69 1.51 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.96 3.93 0.00 1.97 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 2.30 2.47 0.00 33 I 7.91 3.76 2.04 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 1.54 0.82 0.95 0.00 0.00 34 M 7.87 4.84 0.00 2.32 2.47 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.67 0.00 35 Q 8.12 4.14 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.79 2.69 0.00 36 T 8.35 3.95 4.47 0.00 0.00 0.00 0.00 0.00 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 37 F 8.12 4.20 0.00 3.25 3.30 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 38 V 8.15 3.44 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 1.14 0.00 0.00 39 K 8.20 4.05 0.00 2.02 1.79 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.73 7.81 40 Q 8.11 4.39 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.98 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 41 G 7.03 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 42 N 8.76 4.06 0.00 2.68 2.80 0.00 0.00 6.94 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 43 L 7.71 4.21 0.00 1.66 1.62 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.40 4.63 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.59 4.66 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 0.90 0.00 0.00 0.96 0.00 0.00 46 E 9.85 4.65 0.00 1.74 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 2.20 2.22 0.00 47 L 8.46 4.69 0.00 1.25 0.66 1.18 0.84 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 48 E 8.57 4.49 0.00 2.08 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 2.22 2.31 0.00 49 F 8.70 5.39 0.00 2.96 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 50 F 9.33 4.93 0.00 3.08 2.92 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 51 Q 8.14 5.00 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.48 0.00 0.00 0.00 0.00 0.00 2.32 2.18 0.00 52 T 8.30 4.53 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 1.40 0.00 0.00 53 N 9.10 4.67 0.00 2.67 2.69 0.00 0.00 6.89 7.45 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 54 F 8.60 4.74 0.00 3.16 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 55 E 8.93 3.80 0.00 1.16 1.69 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 2.18 1.98 0.00 56 G 8.12 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 0.00 0.00 0.00 57 E 8.37 4.20 0.00 2.41 2.38 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 2.41 2.36 0.00 58 I 7.94 3.96 2.15 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.01 1.02 0.00 0.00 59 I 7.88 3.71 1.98 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 1.50 1.05 0.89 0.00 0.00 60 D 8.56 4.35 0.00 2.80 2.66 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 61 K 7.81 3.68 0.00 1.51 1.80 0.00 1.12 0.00 0.00 0.61 0.00 0.00 2.60 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.91 1.09 7.81 62 I 7.91 3.76 1.97 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 1.52 0.87 0.94 0.00 0.00 63 Q 8.16 3.98 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 64 E 8.01 3.99 0.00 2.12 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 2.27 2.25 0.00 65 S 7.27 4.47 0.00 3.98 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 66 V 7.51 3.78 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 67 G 7.27 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 0.00 0.00 0.00 68 S 8.52 4.62 0.00 3.86 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 69 D 7.61 4.52 0.00 2.42 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 0.00 0.00 0.00 0.00 70 Y 7.48 4.64 0.00 2.80 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 71 E 9.22 4.44 0.00 1.92 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 2.29 2.26 0.00 72 G 7.90 4.37 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 0.00 73 I 8.87 5.20 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.97 0.94 0.00 0.00 74 I 8.92 4.91 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.87 1.09 0.00 0.00 75 I 9.04 5.01 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.84 0.99 0.00 0.00 76 N 9.01 5.24 0.00 2.93 3.00 0.00 0.00 7.09 7.27 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 77 P 0.00 4.51 0.00 2.41 2.21 0.00 3.78 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.15 0.00 78 G 8.55 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.21 4.24 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 80 F 7.74 4.84 0.00 3.26 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 81 S 8.02 4.57 0.00 3.61 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 82 H 8.16 4.94 0.00 3.28 3.52 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 7.92 4.68 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 1.32 0.00 0.00 84 S 8.61 4.61 0.00 3.77 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 85 I 7.73 3.42 1.61 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 -0.36 0.71 0.00 0.00 86 A 7.74 3.90 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 87 I 8.05 3.67 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.59 0.96 0.00 0.00 88 A 7.97 4.02 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 89 D 8.37 4.28 0.00 2.86 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 90 A 7.85 3.97 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 91 I 8.01 3.81 2.06 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 1.55 1.25 0.95 0.00 0.00 92 M 7.90 4.09 0.00 2.00 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.60 0.00 93 L 8.05 4.22 0.00 1.60 1.71 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.94 4.16 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 95 G 8.28 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 0.00 0.00 0.00 96 K 7.38 4.87 0.00 1.68 1.88 0.00 1.88 0.00 0.00 1.95 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.52 7.81 97 P 0.00 4.42 0.00 2.13 2.19 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 98 V 8.41 5.02 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 1.03 0.00 0.00 1.02 0.00 0.00 99 I 8.64 5.03 1.89 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 1.12 0.57 0.91 0.00 0.00 100 E 8.92 5.07 0.00 2.07 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 2.11 2.26 0.00 101 V 8.78 4.78 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 0.16 0.00 0.00 0.77 0.00 0.00 102 H 9.00 4.93 0.00 3.13 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.91 4.17 0.00 1.81 1.86 1.04 0.89 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 0.00 104 T 7.84 4.49 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 105 N 8.20 4.45 0.00 2.59 2.67 0.00 0.00 6.64 7.79 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 0.00 106 I 8.04 4.04 1.98 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 1.32 0.59 0.81 0.00 0.00 107 Q 7.99 4.09 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.18 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 108 A 7.92 4.71 1.15 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 0.00 109 R 7.36 4.67 0.00 1.61 1.57 0.00 3.13 0.00 0.00 3.16 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.67 0.00 110 E 8.20 3.88 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 111 E 8.42 3.90 0.00 1.95 1.96 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 2.33 2.21 0.00 112 F 7.56 4.46 0.00 2.99 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 0.00 113 R 7.22 3.83 0.00 1.74 1.83 0.00 3.06 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.24 0.00 114 K 7.67 4.28 0.00 1.83 1.81 0.00 1.61 0.00 0.00 1.43 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.50 1.23 7.81 115 N 7.97 4.23 0.00 2.67 2.56 0.00 0.00 6.58 7.87 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 0.00 116 S 8.25 4.90 0.00 3.89 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 0.00 117 Y 8.31 4.31 0.00 3.07 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 0.00 118 T 8.16 4.19 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 1.31 0.00 0.00 119 G 8.28 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 0.00 0.00 0.00 120 A 7.83 4.08 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 A 7.83 4.21 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 0.00 122 C 7.15 4.48 0.00 3.23 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 0.00 123 G 8.49 3.77 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 0.00 0.00 0.00 124 G 7.74 4.37 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 0.00 125 V 8.17 5.15 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 0.89 0.00 0.00 0.96 0.00 0.00 126 I 8.91 4.96 1.85 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 1.29 0.68 1.05 0.00 0.00 127 M 8.33 5.56 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 128 G 9.20 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 0.00 0.00 0.00 129 F 7.77 4.64 0.00 3.03 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 0.00 130 G 8.02 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.51 0.00 2.23 2.21 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 132 L 8.25 4.06 0.00 1.78 1.89 0.83 1.01 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 0.00 133 G 8.36 3.68 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 0.00 134 Y 8.01 4.17 0.00 3.27 3.02 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 0.00 0.00 0.00 135 N 8.05 3.99 0.00 2.52 1.61 0.00 0.00 7.16 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 0.00 136 M 7.97 3.91 0.00 1.86 2.08 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.28 0.00 137 A 7.97 3.99 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 0.00 138 L 7.75 3.93 0.00 1.92 1.94 1.09 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 139 M 8.18 4.08 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 140 A 7.97 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 0.00 141 M 8.54 3.95 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 142 V 8.21 3.59 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 0.96 0.00 0.00 1.03 0.00 0.00 143 N 8.00 4.30 0.00 2.92 2.93 0.00 0.00 7.24 8.32 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 0.00 144 I 8.04 3.69 2.08 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 1.52 0.50 0.92 0.00 0.00 145 L 8.27 4.03 0.00 1.86 1.73 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 146 A 8.15 3.95 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 0.00 147 E 8.34 3.96 0.00 2.21 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 2.35 2.38 0.00 148 M 8.10 4.11 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.54 0.00 149 K 7.96 3.94 0.00 1.92 1.96 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 150 A 8.21 4.17 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 0.00 151 F 8.07 4.23 0.00 3.17 3.34 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 0.00 152 Q 8.20 4.28 0.00 2.29 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.32 0.00 0.00 0.00 0.00 0.00 2.45 2.67 0.00