NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.1823 8.1749 110.9399 62.6827 69.6249 172.7938 13 N 4.4091 9.1028 123.1284 52.4664 37.7565 171.7939 14 L 4.6129 9.0650 124.9790 53.8728 43.5766 176.6604 15 L 4.3321 8.4709 124.1113 54.5648 42.5429 176.3646 16 Y 4.3740 8.5223 122.7833 58.1693 39.9063 174.8708 17 T 3.9610 7.0228 117.5968 60.8202 70.2035 174.1612 18 R 3.8719 8.1102 125.5362 57.1099 30.0607 176.1070 19 N 4.2135 7.6361 117.7687 53.7226 38.5592 173.7626 20 D 4.2942 9.1020 125.4880 58.1009 41.5985 176.6242 21 V 3.1979 6.8500 115.5925 59.7164 32.6173 176.2943 22 S 4.2810 8.6463 122.5469 58.5557 64.9595 175.1641 23 D 4.3832 8.7287 123.6552 57.2706 40.4462 178.7283 24 S 4.0864 7.9941 113.9680 61.5741 62.5046 175.7934 25 E 4.0518 8.2673 120.7623 59.0624 29.2537 179.2020 26 K 3.9248 8.3666 119.3023 59.6306 32.0095 179.1803 27 K 3.9886 8.1303 117.6773 59.4446 32.0504 179.4076 28 A 3.9615 7.8117 120.6233 55.4470 18.3713 179.8232 29 T 3.7559 8.3957 114.5147 66.9449 68.6313 176.8474 30 V 3.6304 8.2271 120.4336 66.2673 31.1755 177.7481 31 E 3.9038 8.0118 118.6928 58.9390 29.1139 178.2625 32 L 3.9272 7.8342 120.3567 58.1898 42.1404 178.9657 33 L 3.9446 8.2904 119.0233 58.0810 41.7577 179.2810 34 N 4.5114 8.0644 116.0585 56.1854 38.3443 177.5179 35 R 3.9288 7.7957 120.3364 59.3743 30.0772 178.5250 36 Q 4.0954 7.7016 117.3070 58.9044 28.6571 178.5455 37 V 3.5806 8.1382 119.7019 66.2201 31.4800 177.9629 38 I 3.6948 7.5749 118.6218 64.4708 37.0148 177.9637 39 Q 3.9508 8.0553 120.1236 59.3845 28.7978 178.5695 40 F 3.8352 9.1501 118.9014 60.6914 38.8725 177.5379 41 I 3.7219 8.1975 119.7467 64.7436 36.9341 178.0036 42 D 4.3426 8.2268 118.6782 57.0946 41.0486 178.0257 43 L 3.8778 7.8741 121.3145 57.8346 41.9580 179.1345 44 S 4.1397 8.3088 114.7319 61.3489 62.9942 176.5634 45 L 3.9452 7.7357 122.5414 57.5012 41.3557 179.4399 46 I 3.4698 7.7596 119.7593 64.4961 36.8877 178.5775 47 T 3.7906 7.8835 116.5000 66.7044 68.3472 176.9269 48 K 3.2869 7.5202 119.6357 58.7403 31.7239 179.5178 49 Q 3.9159 7.4051 118.3848 58.8193 28.5002 178.6801 50 A 3.7251 7.4223 121.5670 55.2481 18.1907 178.6819 51 H 3.8419 7.7594 115.7718 59.6583 29.8297 176.9695 52 W 4.5875 7.6953 118.8482 59.4026 29.0955 177.5331 53 N 4.9309 7.9288 113.0461 52.5207 38.6685 175.2449 54 M 4.8429 7.2660 118.4816 55.2628 32.8085 175.6751 55 R 4.4022 8.9884 117.4478 55.9765 34.5888 173.7978 56 G 4.0486 8.7367 103.8784 44.0192 0.0000 172.8123 57 A 4.0322 8.5520 122.3899 53.6119 18.8341 177.0656 58 N 4.1632 8.9878 118.9404 54.6211 37.1277 175.9256 59 F 4.1802 7.4250 117.5357 60.2761 39.2726 175.7105 60 I 2.9992 7.8541 116.7723 64.2535 37.8706 177.8944 61 A 3.8237 7.7384 120.6192 55.0510 18.2613 179.6603 62 V 3.3075 7.3459 116.8068 65.9806 31.3890 177.4241 63 H 3.7988 7.9909 117.3261 59.6132 29.6415 176.6973 64 E 3.9054 7.9271 119.9249 59.3377 29.3643 178.8664 65 M 3.5543 7.7670 118.3727 58.4666 32.0311 178.3096 66 L 3.5669 7.5498 119.0160 57.6661 41.7708 179.1099 67 D 4.2413 7.5819 118.8851 57.0260 40.5144 179.2940 68 G 3.3598 7.3930 105.9495 47.6320 0.0000 175.8765 69 F 4.0399 7.1758 120.0448 60.1347 38.9185 177.3123 70 R 3.9677 8.2925 118.6777 59.9145 29.8139 178.4628 71 T 3.8655 7.7858 114.4753 66.7849 68.5317 176.4295 72 A 4.1105 8.0238 122.2625 54.9450 18.4349 179.1122 73 L 4.1886 8.8395 119.2610 58.9232 42.1090 179.5482 74 I 3.8217 8.2252 119.6463 64.2700 36.9630 178.3361 75 D 4.3181 8.0482 119.8944 57.6703 40.5910 178.4828 76 H 4.1156 8.1885 116.6967 58.5793 28.6004 177.3841 77 L 3.6640 7.9500 122.1759 58.3833 41.8711 178.6467 78 D 4.2792 8.2937 117.8913 57.6594 40.9053 178.3200 79 T 3.8481 7.6149 115.4073 66.6950 68.6871 176.4455 80 M 4.0842 8.2470 120.6491 58.2366 32.1569 178.4254 81 A 3.9497 8.0842 121.1779 55.5085 18.6785 179.5795 82 E 4.0274 8.3352 116.2938 58.8588 29.2357 179.4604 83 R 3.9132 7.6808 118.5134 58.8689 30.3853 178.0398 84 A 4.0711 7.8179 120.2447 55.2826 18.5761 179.4779 85 V 3.8178 7.5375 117.7773 65.6958 31.2126 178.2151 86 Q 4.0223 7.7080 116.8102 58.5678 28.5847 177.7236 87 L 4.4107 7.5157 117.3645 54.6056 42.0137 177.8792 88 G 3.9271 8.2285 109.5074 45.0874 0.0000 174.7996 89 G 4.2293 7.5488 108.3942 44.6468 0.0000 171.9077 90 V 4.1526 8.0210 118.2826 60.5305 33.7566 175.8075 91 A 4.1649 8.7173 130.8284 52.1228 18.7536 176.1425 92 L 4.7009 9.3369 123.9726 53.2457 43.0614 177.3953 93 G 4.1958 8.3893 112.1816 44.7869 0.0000 172.9578 94 T 4.2037 7.8768 110.4891 61.0764 71.1201 174.6791 95 T 3.8894 8.4837 115.9637 65.5049 67.1079 176.1544 96 Q 3.9676 8.0187 119.6420 59.0111 28.9278 178.4644 97 V 3.6278 7.5579 118.1650 66.1981 31.5720 178.2909 98 I 3.6857 7.8224 119.4676 64.3923 36.9381 177.7415 99 N 4.5023 8.1221 115.7570 55.5951 38.8028 175.7336 100 S 4.5767 7.6143 112.8399 59.5148 63.0351 174.3422 101 K 4.5821 7.6369 118.1824 55.9280 33.0086 175.6238 102 T 4.0894 7.8183 114.7450 61.4359 67.5517 172.4475 103 P 4.6565 0.0000 0.0000 62.6565 31.7725 175.0745 104 L 4.5785 7.5413 119.7127 52.9303 42.8757 176.5882 105 K 4.0385 8.8032 123.6177 56.5934 32.4459 176.4113 106 S 3.9405 8.4744 117.3212 57.9567 63.1809 172.9578 107 Y 4.1990 8.7090 128.8069 55.9005 39.3740 172.6643 108 P 4.3166 0.0000 0.0000 63.6772 31.3740 175.6443 109 L 4.7454 8.5829 122.6665 54.5687 41.6296 176.6885 110 D 4.8374 7.8248 116.3712 52.3788 40.7797 175.8795 111 I 4.0033 7.5143 113.2910 61.2473 38.7359 175.0663 112 H 4.9667 8.5329 116.1625 56.7820 32.1068 173.8077 113 N 4.8228 8.1143 116.3317 53.6123 40.6263 175.3996 114 V 3.6659 8.2919 125.7501 66.5555 31.7776 178.5329 115 Q 4.1582 8.2124 117.1225 59.1343 28.4801 178.6854 116 D 4.2849 8.0516 119.2339 57.7978 40.9523 178.2053 117 H 4.5076 8.0789 117.6761 58.2917 28.6753 177.6110 118 L 4.0459 8.5070 121.0381 58.0559 41.5348 179.8858 119 K 3.9513 8.0264 117.9613 59.5195 32.1199 179.3053 120 E 3.9538 8.2443 118.8204 59.3218 29.3688 179.4848 121 L 4.2316 8.9200 119.1719 57.9711 41.7514 179.1023 122 A 4.0849 8.7088 121.4116 55.5591 18.1793 179.4989 123 D 4.3015 8.2155 116.9275 57.6974 41.1425 179.1282 124 R 3.9691 7.9639 117.9956 59.6128 30.0597 178.8075 125 Y 3.7375 8.8583 116.5690 60.8572 37.8663 178.3938 126 A 3.9948 8.3133 121.7632 55.2789 18.3854 179.5003 127 I 3.5659 7.7647 118.1366 64.6747 37.1792 178.7115 128 V 3.4134 7.5750 118.0833 65.9167 31.2740 177.6813 129 A 3.8669 8.4929 120.6952 55.4722 18.0435 179.2215 130 N 4.2272 8.6658 114.8004 56.4383 38.5973 177.2496 131 D 4.3346 8.3506 119.6926 57.4264 41.2509 178.6554 132 V 4.0121 7.8585 120.0746 64.3246 31.3227 177.8919 133 R 3.9945 8.1937 119.3932 59.1460 29.6017 178.6001 134 K 4.1197 7.8249 118.0268 58.9656 31.9467 179.1094 135 A 3.8540 8.1302 121.0757 54.7222 18.1675 179.5409 136 I 3.7850 7.4229 117.6388 64.7440 37.0824 178.6579 137 G 3.7323 7.4795 104.1319 46.6713 0.0000 174.3420 138 E 4.2600 7.6454 119.7486 55.9634 29.9918 175.5632 139 A 4.4776 7.1538 122.1822 51.3841 19.9047 177.3871 140 K 4.0208 8.7505 123.4064 59.3900 32.6021 177.9955 141 D 4.3441 7.9853 119.2361 54.1623 41.9163 175.7800 142 D 4.3687 8.8261 127.4832 57.8042 40.9129 178.4695 143 D 4.3603 8.1906 118.3492 58.0110 40.9210 179.0524 144 T 3.8126 7.8039 115.5329 66.5410 68.2791 176.6112 145 A 3.9691 8.2981 123.0715 54.9114 18.3235 179.0205 146 D 4.2230 8.1503 116.5432 57.6463 41.3420 178.3371 147 I 3.6559 7.8135 120.2045 64.7314 37.1371 178.4392 148 L 3.9813 8.0011 119.3681 57.9306 41.3288 179.8338 149 T 3.7919 8.1104 115.8413 66.4643 68.2797 176.4973 150 A 3.9351 8.1737 122.5970 55.1586 18.4096 179.6033 151 A 3.3055 7.8883 119.1786 54.9969 18.3578 179.5798 152 S 3.9420 8.5138 112.0334 61.6603 62.2503 176.0560 153 R 3.7805 8.4414 121.5169 59.9686 29.5992 178.0689 154 D 4.0026 7.6911 118.0141 57.0726 40.7499 178.7853 155 L 3.6021 7.6384 119.4919 57.7551 41.5917 179.3010 156 D 4.4186 8.1750 119.0404 57.0564 40.7076 178.8148 157 K 4.0739 7.6196 120.1828 59.4408 32.1707 179.0399 158 F 3.9688 8.0831 118.3998 60.2649 38.6772 177.1343 159 L 3.8632 8.4360 120.3685 58.1477 41.7342 178.7942 160 W 4.3974 8.2416 127.9520 60.6961 30.3656 177.9131 161 F 4.0752 7.7288 116.4395 60.4922 38.6255 177.4437 162 I 3.8551 8.1845 119.7698 64.5751 36.9888 178.1961 163 E 4.0102 8.5327 119.6114 59.7694 29.1704 179.6427 164 S 4.3354 8.2878 113.5416 60.5329 62.9274 175.2881 165 N 4.7562 7.6816 117.5766 52.2110 38.9664 174.9679 166 I 4.1257 7.1526 122.8683 60.4968 37.6990 175.8847 167 E 4.1446 9.5415 124.8901 56.8300 29.2012 176.8733 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 12 T 8.17 4.18 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 13 N 9.10 4.41 0.00 2.99 3.04 0.00 0.00 6.76 6.97 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 14 L 9.06 4.61 0.00 1.55 1.61 0.96 1.04 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 15 L 8.47 4.33 0.00 1.52 1.63 1.02 0.78 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 16 Y 8.52 4.37 0.00 2.97 2.90 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 0.00 0.00 0.00 17 T 7.02 3.96 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 1.07 0.00 0.00 18 R 8.11 3.87 0.00 1.75 1.91 0.00 3.25 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 19 N 7.64 4.21 0.00 2.63 2.67 0.00 0.00 7.00 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.10 4.29 0.00 2.65 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 21 V 6.85 3.20 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 0.85 0.00 0.00 0.94 0.00 0.00 22 S 8.65 4.28 0.00 4.08 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.73 4.38 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.99 4.09 0.00 3.88 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 25 E 8.27 4.05 0.00 2.04 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 2.32 2.34 0.00 26 K 8.37 3.92 0.00 1.92 1.92 0.00 1.66 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.44 1.78 7.81 27 K 8.13 3.99 0.00 1.83 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.67 7.81 28 A 7.81 3.96 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 29 T 8.40 3.76 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 1.19 0.00 0.00 30 V 8.23 3.63 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 0.98 0.00 0.00 0.96 0.00 0.00 31 E 8.01 3.90 0.00 2.19 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 2.45 0.00 32 L 7.83 3.93 0.00 1.80 1.80 0.95 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.29 3.94 0.00 1.65 1.65 0.96 0.61 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 34 N 8.06 4.51 0.00 2.93 2.88 0.00 0.00 6.75 7.67 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 35 R 7.80 3.93 0.00 1.99 2.06 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 36 Q 7.70 4.10 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 37 V 8.14 3.58 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 1.18 0.00 0.00 0.92 0.00 0.00 38 I 7.57 3.69 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.71 0.93 0.00 0.00 39 Q 8.06 3.95 0.00 2.30 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 40 F 9.15 3.84 0.00 3.26 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 41 I 8.20 3.72 2.10 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.66 0.94 0.00 0.00 42 D 8.23 4.34 0.00 2.91 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 43 L 7.87 3.88 0.00 1.61 1.51 0.50 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.31 4.14 0.00 4.09 4.14 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 45 L 7.74 3.95 0.00 1.80 1.76 0.95 1.28 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 46 I 7.76 3.47 1.96 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 1.52 0.71 0.70 0.00 0.00 47 T 7.88 3.79 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 1.28 0.00 0.00 48 K 7.52 3.29 0.00 1.30 0.74 0.00 1.19 0.00 0.00 1.04 0.00 0.00 2.72 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.15 1.40 7.81 49 Q 7.41 3.92 0.00 1.90 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 50 A 7.42 3.73 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 H 7.76 3.84 0.00 2.85 2.90 0.00 5.95 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 52 W 7.70 4.59 0.00 3.55 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 53 N 7.93 4.93 0.00 2.84 3.03 0.00 0.00 7.10 8.94 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 54 M 7.27 4.84 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.80 0.00 55 R 8.99 4.40 0.00 1.84 1.69 0.00 3.02 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.58 0.00 56 G 8.74 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.55 4.03 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 58 N 8.99 4.16 0.00 2.92 2.84 0.00 0.00 6.83 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 7.43 4.18 0.00 3.23 2.97 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 60 I 7.85 3.00 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.95 0.87 0.00 0.00 61 A 7.74 3.82 1.19 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 0.00 0.00 62 V 7.35 3.31 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 0.90 0.00 0.00 0.90 0.00 0.00 63 H 7.99 3.80 0.00 2.02 2.82 0.00 6.00 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 64 E 7.93 3.91 0.00 1.88 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 0.00 2.25 2.36 0.00 65 M 7.77 3.55 0.00 1.81 1.78 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.39 0.00 66 L 7.55 3.57 0.00 1.66 1.53 0.89 0.81 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 67 D 7.58 4.24 0.00 2.63 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 68 G 7.39 3.36 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 69 F 7.18 4.04 0.00 3.11 3.05 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 R 8.29 3.97 0.00 1.80 2.03 0.00 3.00 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 71 T 7.79 3.87 4.43 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 1.24 0.00 0.00 72 A 8.02 4.11 1.73 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 73 L 8.84 4.19 0.00 2.16 1.87 1.04 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.23 3.82 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.73 0.94 0.00 0.00 75 D 8.05 4.32 0.00 2.79 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 76 H 8.19 4.12 0.00 3.32 3.09 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.95 3.66 0.00 1.89 1.85 0.98 1.03 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 78 D 8.29 4.28 0.00 2.81 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.61 3.85 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 1.17 0.00 0.00 80 M 8.25 4.08 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.38 0.00 81 A 8.08 3.95 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 82 E 8.34 4.03 0.00 2.07 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 2.31 2.39 0.00 83 R 7.68 3.91 0.00 1.89 2.09 0.00 3.28 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 1.60 1.65 0.00 84 A 7.82 4.07 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 85 V 7.54 3.82 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 1.15 0.00 0.00 0.95 0.00 0.00 86 Q 7.71 4.02 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 87 L 7.52 4.41 0.00 1.73 1.66 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.23 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 0.00 0.00 0.00 89 G 7.55 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 90 V 8.02 4.15 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 91 A 8.72 4.16 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 92 L 9.34 4.70 0.00 1.65 1.60 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.39 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.88 4.20 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 1.22 0.00 0.00 95 T 8.48 3.89 4.26 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 1.23 0.00 0.00 96 Q 8.02 3.97 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 97 V 7.56 3.63 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 1.04 0.00 0.00 0.94 0.00 0.00 98 I 7.82 3.69 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.28 0.93 0.00 0.00 99 N 8.12 4.50 0.00 2.75 3.00 0.00 0.00 7.23 6.92 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 0.00 100 S 7.61 4.58 0.00 3.87 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 0.00 101 K 7.64 4.58 0.00 1.77 1.75 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.46 7.81 102 T 7.82 4.09 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 1.29 0.00 0.00 103 P 0.00 4.66 0.00 2.21 2.12 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 104 L 7.54 4.58 0.00 1.86 1.66 0.84 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.80 4.04 0.00 1.76 1.77 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.44 7.81 106 S 8.47 3.94 0.00 3.87 3.81 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 0.00 0.00 0.00 107 Y 8.71 4.20 0.00 3.05 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.32 0.00 2.06 1.92 0.00 2.84 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.60 0.00 109 L 8.58 4.75 0.00 1.71 1.80 0.98 1.28 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 0.00 110 D 7.82 4.84 0.00 2.73 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.51 4.00 1.70 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.27 0.79 0.00 0.00 112 H 8.53 4.97 0.00 3.19 3.33 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.11 4.82 0.00 2.86 2.91 0.00 0.00 6.82 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.29 3.67 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 0.94 0.00 0.00 1.12 0.00 0.00 115 Q 8.21 4.16 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.68 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 116 D 8.05 4.28 0.00 2.91 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 0.00 117 H 8.08 4.51 0.00 3.46 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.51 4.05 0.00 2.01 1.76 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.03 3.95 0.00 1.97 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.63 7.81 120 E 8.24 3.95 0.00 2.16 1.74 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 2.38 2.08 0.00 121 L 8.92 4.23 0.00 1.96 1.72 0.97 1.08 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 0.00 122 A 8.71 4.08 1.41 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 0.00 0.00 0.00 123 D 8.22 4.30 0.00 2.98 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 0.00 124 R 7.96 3.97 0.00 2.00 2.02 0.00 3.37 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.05 0.00 125 Y 8.86 3.74 0.00 3.09 2.99 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 0.00 126 A 8.31 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 0.00 127 I 7.76 3.57 2.02 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 1.40 0.86 0.88 0.00 0.00 128 V 7.57 3.41 1.70 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 0.50 0.00 0.00 0.71 0.00 0.00 129 A 8.49 3.87 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 0.00 130 N 8.67 4.23 0.00 2.89 2.88 0.00 0.00 6.78 8.05 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 0.00 131 D 8.35 4.33 0.00 2.77 2.81 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 0.00 0.00 0.00 132 V 7.86 4.01 2.26 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 1.18 0.00 0.00 1.09 0.00 0.00 133 R 8.19 3.99 0.00 1.97 2.10 0.00 3.05 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 134 K 7.82 4.12 0.00 1.96 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.67 7.81 135 A 8.13 3.85 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 0.00 136 I 7.42 3.79 1.95 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 1.43 1.08 0.89 0.00 0.00 137 G 7.48 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 0.00 138 E 7.65 4.26 0.00 2.04 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 2.30 2.31 0.00 139 A 7.15 4.48 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 0.00 140 K 8.75 4.02 0.00 1.80 1.95 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.41 7.81 141 D 7.99 4.34 0.00 2.72 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 0.00 142 D 8.83 4.37 0.00 2.71 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 0.00 143 D 8.19 4.36 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 0.00 144 T 7.80 3.81 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 1.18 0.00 0.00 145 A 8.30 3.97 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 0.00 146 D 8.15 4.22 0.00 2.90 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 0.00 147 I 7.81 3.66 1.99 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 1.49 0.66 0.84 0.00 0.00 148 L 8.00 3.98 0.00 1.82 1.69 0.90 0.55 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 0.00 149 T 8.11 3.79 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 1.18 0.00 0.00 150 A 8.17 3.94 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 0.00 151 A 7.89 3.31 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.51 3.94 0.00 3.90 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 0.00 153 R 8.44 3.78 0.00 2.00 2.04 0.00 3.11 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 154 D 7.69 4.00 0.00 2.59 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 0.00 0.00 0.00 155 L 7.64 3.60 0.00 1.66 1.56 0.59 0.63 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 0.00 156 D 8.17 4.42 0.00 2.63 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 0.00 157 K 7.62 4.07 0.00 1.86 1.88 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.10 1.50 7.81 158 F 8.08 3.97 0.00 2.85 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 0.00 0.00 0.00 159 L 8.44 3.86 0.00 1.85 1.95 1.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 160 W 8.24 4.40 0.00 3.38 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 0.00 161 F 7.73 4.08 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 0.00 162 I 8.18 3.86 1.92 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.88 0.00 0.00 163 E 8.53 4.01 0.00 2.29 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 2.38 2.55 0.00 164 S 8.29 4.34 0.00 3.76 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 0.00 165 N 7.68 4.76 0.00 2.77 2.80 0.00 0.00 7.01 7.59 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 0.00 166 I 7.15 4.13 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.67 0.98 0.00 0.00 167 E 9.54 4.14 0.00 1.91 1.88 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 2.35 2.41 0.00