NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.3378 7.7374 121.8369 56.2098 32.7484 175.0032 3 G 3.6980 8.4668 114.9439 44.3875 0.0000 169.0660 4 D 4.5363 8.6404 120.0380 53.7092 42.6073 175.1946 5 K 3.8943 8.9766 126.7574 59.8750 32.2402 179.1481 6 K 4.0338 8.6281 118.8328 59.0207 31.7779 179.6184 7 V 3.6715 8.0563 118.3240 66.2496 31.6317 177.6355 8 I 3.5719 7.6192 119.1367 64.8436 36.9644 178.4371 9 Q 3.9389 7.9016 118.0156 59.2636 28.5549 178.2054 10 H 4.1456 8.3171 117.3018 58.9196 28.7020 177.5218 11 L 3.9846 8.5752 121.2365 58.2377 41.4950 179.3290 12 N 4.4080 8.8212 116.3717 56.1843 38.4108 177.5530 13 K 3.9091 8.0318 121.0211 59.5855 32.3658 178.9289 14 I 3.6993 8.1120 120.5243 64.2392 37.0213 178.0170 15 L 4.0353 8.4264 121.7306 58.2870 41.6426 179.1662 16 G 3.7128 8.2217 105.6103 48.0890 0.0000 175.3464 17 N 4.4550 8.1386 118.6476 56.0879 38.4922 177.4059 18 E 3.9993 8.2462 120.0810 59.3794 29.4508 179.1956 19 L 4.0585 8.0391 119.0120 57.8722 41.6415 179.8512 20 I 3.5783 7.4099 117.9434 64.2849 37.1184 178.1210 21 A 3.2028 7.7880 121.5001 54.9999 18.1327 179.4996 22 I 3.6648 8.2736 118.5714 64.7984 37.2488 178.4805 23 N 4.3244 7.8325 116.7039 56.2153 38.3868 177.1335 24 Q 3.8282 8.3392 121.2018 59.6513 29.1297 178.1671 25 Y 4.5134 8.0363 117.9140 61.2594 37.9029 178.5675 26 F 4.0916 8.4172 121.5985 60.9864 39.3805 177.0797 27 L 3.9452 8.1846 120.1213 58.3857 41.9061 178.4195 28 H 3.7385 8.1905 116.2974 58.8364 28.6155 177.4194 29 S 4.3385 8.5438 115.1232 61.8913 62.1304 176.6563 30 R 3.8859 7.7533 120.3158 58.9856 29.7388 179.0194 31 M 3.4660 7.9696 119.0147 58.0871 31.8305 178.6756 32 W 4.5570 7.7222 118.9613 59.9609 29.1525 178.3329 33 N 4.3476 8.2064 116.3980 56.4349 37.8482 176.6977 34 D 4.3767 7.8439 118.3852 57.5220 41.4176 178.4939 35 W 4.8068 7.9321 116.5717 57.2850 29.0056 177.2889 36 G 3.9765 8.8629 108.1965 45.9341 0.0000 174.2391 37 L 4.8275 8.2067 122.2892 53.3945 40.2752 177.7836 38 K 4.1059 8.6960 121.2926 58.6812 32.5668 179.2660 39 R 3.8320 7.7933 119.1329 59.4021 30.1017 178.2896 40 L 3.8609 7.8234 118.4527 57.5202 41.4238 179.3613 41 G 3.8696 8.2288 105.4153 48.1152 0.0000 175.4608 42 A 4.0330 7.9434 123.7941 54.8143 18.4080 179.2702 43 H 3.9706 8.1419 116.2944 59.4197 29.9159 177.1474 44 E 4.0202 8.3957 121.1953 59.3847 29.5818 178.0706 45 Y 4.0320 8.1643 119.6832 61.1534 38.8573 177.9180 46 H 4.1650 8.2378 116.8570 58.4168 28.6142 177.7129 47 E 3.8174 8.0818 120.9164 59.2285 29.2100 179.0444 48 S 4.3513 8.3738 113.4887 61.6231 62.3563 176.4146 49 I 3.6521 7.5097 122.1749 64.2427 36.8022 177.8800 50 D 4.2913 7.9916 119.8333 57.6860 40.6324 178.9859 51 E 4.2615 7.9390 120.2592 59.0084 28.9816 179.1876 52 M 4.0632 8.1024 118.7095 57.9517 31.9552 178.9343 53 K 4.0298 7.6747 118.5011 59.4361 32.5012 178.7015 54 H 4.2163 8.1531 116.2728 59.1717 28.5805 177.6568 55 A 4.0602 8.2571 122.3247 55.0339 18.1436 179.2622 56 D 4.2461 7.7237 115.8146 57.4621 41.2567 178.6593 57 K 4.0454 8.0510 118.9246 59.3919 32.0368 179.4220 58 L 4.0347 8.0171 119.4147 57.7668 41.4242 179.5593 59 I 3.8046 8.1040 120.1169 64.1499 36.8860 178.4271 60 E 3.9944 8.1013 119.6368 59.1828 29.3207 178.9411 61 R 3.9933 8.1984 118.9541 59.6716 30.1450 178.3640 62 I 3.7025 7.8341 119.1928 64.5845 37.1681 178.1151 63 L 3.9908 7.7290 119.3820 58.0634 41.2645 179.6047 64 F 4.3205 8.1750 119.3335 61.2992 39.6905 176.6972 65 L 3.8903 8.0941 115.6247 54.5979 40.6432 177.4083 66 E 3.4714 8.0839 117.9558 57.2589 27.2861 174.7677 67 G 3.8744 7.8440 108.6845 44.2248 0.0000 173.4577 68 L 4.5770 8.0461 118.9384 52.1193 42.6437 175.0892 69 P 4.5076 0.0000 0.0000 62.3029 31.8821 176.2850 70 N 4.6950 9.0995 122.6658 52.2927 38.0063 173.6603 71 L 4.5862 8.1753 122.0033 54.2508 42.2673 177.3222 72 Q 4.1525 8.2720 122.1040 57.3204 29.5526 175.5027 73 D 4.6513 8.1095 117.7795 52.5829 41.6254 175.1973 74 L 4.4851 8.3285 126.8745 52.9402 43.2767 177.1330 75 G 3.7864 8.3424 116.5143 45.1104 0.0000 171.1092 76 K 4.2632 8.3470 121.4016 54.7269 32.7424 177.3078 77 L 4.0649 8.4013 127.1355 55.0349 42.1454 178.1458 78 L 4.3622 8.5078 126.0741 53.4104 40.0881 174.8795 79 I 3.8826 7.6791 120.6952 60.6908 37.7685 176.7688 80 G 4.0178 8.7139 115.0311 44.8920 0.0000 172.6404 81 E 4.7678 8.5142 113.8240 55.3908 30.5022 175.3577 82 N 5.1072 7.7047 116.9989 50.9429 42.1761 174.8045 83 T 4.5134 8.5977 115.9899 67.1423 68.4906 176.5780 84 Q 4.0252 8.2328 121.0248 59.1359 29.0896 177.8000 85 E 4.0410 8.7141 119.7567 59.4457 29.4724 179.2422 86 M 4.1313 8.2971 118.7969 58.2903 32.0485 178.6216 87 L 4.1366 7.9837 118.7005 58.1392 41.9162 179.4431 88 Q 4.0133 8.0643 119.1530 59.3098 28.8482 178.1295 89 C 4.1814 9.1082 118.9347 63.0973 28.2608 175.7353 90 D 4.6524 8.3955 120.3800 57.4166 40.3148 178.7976 91 L 3.9896 8.1671 120.7440 58.2513 42.1063 178.7357 92 N 4.3329 8.3046 116.4489 56.3423 38.6186 177.1566 93 L 3.9936 8.1785 121.8421 58.2215 42.0840 178.9079 94 E 4.1384 8.4389 118.6487 59.0968 29.4330 179.2422 95 L 4.0002 8.2820 119.5315 57.6912 41.7755 179.3241 96 K 3.9206 8.3129 119.4327 59.3736 32.0163 178.7661 97 A 3.9842 7.9405 120.6274 55.3834 18.4529 179.3773 98 T 3.8516 8.1502 114.8932 66.9041 68.5578 176.3178 99 K 3.9076 7.9875 120.8058 59.8299 32.3565 178.4867 100 D 4.4159 7.9492 118.6217 57.2099 40.4542 178.7508 101 L 3.9374 7.8843 120.0473 58.1963 42.5394 178.7499 102 R 4.0907 7.9477 117.9408 59.5533 30.1654 178.8675 103 E 3.9584 8.2030 117.8513 59.4481 29.3584 179.3863 104 A 3.6393 8.0886 120.5107 54.6252 18.2376 179.8440 105 I 3.7180 7.4590 118.2313 64.3017 37.3472 178.1826 106 V 3.5553 7.8386 118.7030 66.5860 31.1492 177.2835 107 H 4.1270 8.0315 117.2272 59.4676 29.6771 176.8900 108 C 3.9428 7.7395 118.5505 62.6650 27.9530 175.4868 109 E 3.8156 8.2529 120.9335 59.6214 28.9707 178.1307 110 Q 3.8854 7.7860 117.6497 59.6820 29.0341 178.5013 111 V 3.8488 7.4286 110.4322 60.9410 31.6888 176.1470 112 H 3.0784 7.3550 113.8616 56.8231 26.8882 176.1909 113 D 4.5088 7.3652 121.6610 53.6231 39.0228 175.9241 114 Y 4.2632 7.6504 121.9115 59.9619 38.3168 177.2128 115 V 3.7277 7.8743 119.2750 65.9839 31.8431 178.0659 116 S 4.1856 8.4695 115.0544 61.1384 62.5265 176.5500 117 R 3.8857 7.7761 121.3248 59.5285 29.7276 178.1249 118 D 4.3188 8.0677 117.4764 57.0331 41.1915 177.9588 119 L 3.9443 7.7236 121.0775 58.2431 42.1811 179.0189 120 L 4.0089 7.8533 118.7096 57.6329 41.5072 179.4162 121 K 4.1004 8.3719 119.8710 59.3869 32.1562 178.7715 122 D 4.2954 7.9577 119.1631 57.2765 40.7967 178.3480 123 I 3.3985 7.5327 120.3594 64.4177 37.0910 177.7121 124 L 3.9072 8.2541 121.1735 58.5011 41.8102 178.6173 125 E 3.9181 8.1175 118.8136 59.5263 29.5848 178.8088 126 S 4.1734 7.9649 112.8383 61.3849 62.4920 175.9821 127 E 4.2137 8.5423 121.5450 59.3223 29.2042 179.1075 128 E 4.1062 8.4524 118.9138 59.1570 29.5491 179.1442 129 E 4.0439 8.1751 119.0633 59.5605 29.4447 178.8194 130 H 4.3708 8.3068 118.1820 59.4493 30.0149 177.3413 131 I 3.7057 7.9618 121.6662 64.3065 36.8932 177.6977 132 D 4.3742 8.2653 118.8984 57.6230 40.9869 177.8924 133 Y 4.0906 7.9725 119.4936 60.7136 38.8379 177.5860 134 L 3.6592 8.1714 119.9228 58.0986 41.7369 179.3561 135 E 3.9156 8.2107 118.0343 59.8793 29.4226 179.7630 136 T 3.8141 7.8070 115.5919 66.6296 68.3942 176.8237 137 Q 3.8496 7.8265 119.9903 58.7075 28.3233 178.5080 138 L 3.8393 7.8069 120.0975 57.9317 41.8244 179.8417 139 G 3.6659 8.1544 105.4741 47.8958 0.0000 175.6078 140 L 4.0223 7.7856 121.0517 57.5689 41.7549 179.2020 141 I 3.4476 7.5515 120.1067 64.7634 36.7848 178.4431 142 Q 4.0037 7.4961 117.0424 58.6528 28.5835 178.3744 143 K 4.1993 7.7780 118.4964 58.0177 32.3754 178.0977 144 V 4.2180 8.2992 110.0211 60.3781 33.8147 176.7773 145 G 3.9876 8.0864 106.9882 45.5208 0.0000 174.1290 146 L 3.9441 8.7024 123.4289 58.1852 42.0289 179.5072 147 E 3.9578 8.1074 117.6410 59.6810 29.5904 178.7067 148 N 4.3027 8.3050 115.9691 56.6121 38.2883 176.7291 149 Y 3.9864 7.5867 119.3753 60.7875 39.3732 177.3926 150 L 4.0175 8.1636 119.8183 57.6271 41.6420 179.4236 151 Q 3.9274 7.9132 119.7153 59.2011 28.8145 177.7947 152 S 4.5158 7.5515 112.0858 59.2253 62.9582 174.0790 153 H 4.7159 7.6630 117.9288 55.7302 30.3830 175.6374 154 M 4.1312 7.9628 120.1685 57.9468 31.9206 176.5043 155 H 5.1441 7.5457 113.5573 54.2749 30.9957 175.0910 156 E 4.1864 8.5453 119.3795 56.7747 29.4641 176.6721 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 2 K 7.74 4.34 0.00 1.72 1.78 0.00 1.54 0.00 0.00 0.68 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.20 7.81 3 G 8.47 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.64 4.54 0.00 2.74 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.98 3.89 0.00 1.85 1.79 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.53 7.81 6 K 8.63 4.03 0.00 2.00 1.72 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.39 7.81 7 V 8.06 3.67 2.28 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 1.15 0.00 0.00 0.91 0.00 0.00 8 I 7.62 3.57 2.04 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.75 0.91 0.00 0.00 9 Q 7.90 3.94 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 10 H 8.32 4.15 0.00 3.34 3.35 0.00 5.63 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 11 L 8.58 3.98 0.00 1.87 1.74 0.96 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.82 4.41 0.00 2.76 2.88 0.00 0.00 6.78 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 13 K 8.03 3.91 0.00 1.93 2.00 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 8.11 3.70 2.01 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 1.66 0.67 0.92 0.00 0.00 15 L 8.43 4.04 0.00 1.72 1.91 0.92 0.94 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 16 G 8.22 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 0.00 0.00 0.00 17 N 8.14 4.46 0.00 2.95 2.88 0.00 0.00 7.02 7.82 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 18 E 8.25 4.00 0.00 2.13 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 2.55 2.54 0.00 19 L 8.04 4.06 0.00 1.66 1.70 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.41 3.58 1.94 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 1.41 0.55 0.82 0.00 0.00 21 A 7.79 3.20 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 22 I 8.27 3.66 1.98 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 1.58 1.00 0.87 0.00 0.00 23 N 7.83 4.32 0.00 2.71 2.82 0.00 0.00 6.72 8.95 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 24 Q 8.34 3.83 0.00 1.94 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 25 Y 8.04 4.51 0.00 3.11 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 26 F 8.42 4.09 0.00 3.34 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.18 3.95 0.00 1.94 1.72 0.89 0.81 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 28 H 8.19 3.74 0.00 3.36 2.78 0.00 5.71 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 29 S 8.54 4.34 0.00 3.99 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 30 R 7.75 3.89 0.00 2.05 1.85 0.00 3.01 0.00 0.00 2.71 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 31 M 7.97 3.47 0.00 0.75 1.50 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.18 0.00 32 W 7.72 4.56 0.00 3.74 3.31 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 33 N 8.21 4.35 0.00 2.92 2.83 0.00 0.00 6.52 8.11 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 34 D 7.84 4.38 0.00 2.59 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 35 W 7.93 4.81 0.00 3.74 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 36 G 8.86 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 0.00 0.00 0.00 37 L 8.21 4.83 0.00 2.09 1.61 1.31 0.99 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 38 K 8.70 4.11 0.00 2.02 1.86 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.48 7.81 39 R 7.79 3.83 0.00 2.03 1.84 0.00 3.09 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 40 L 7.82 3.86 0.00 1.23 0.23 0.34 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.23 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 42 A 7.94 4.03 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 43 H 8.14 3.97 0.00 3.28 3.26 0.00 5.79 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 44 E 8.40 4.02 0.00 2.64 2.35 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 2.83 2.82 0.00 45 Y 8.16 4.03 0.00 3.04 3.08 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 0.00 0.00 0.00 0.00 46 H 8.24 4.17 0.00 3.34 3.21 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.08 3.82 0.00 1.94 1.54 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 2.20 2.10 0.00 48 S 8.37 4.35 0.00 4.12 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 49 I 7.51 3.65 1.80 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.81 0.83 0.00 0.00 50 D 7.99 4.29 0.00 2.81 2.62 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 0.00 0.00 0.00 0.00 51 E 7.94 4.26 0.00 2.15 2.16 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 2.75 2.70 0.00 52 M 8.10 4.06 0.00 2.04 2.17 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 2.89 2.55 0.00 53 K 7.67 4.03 0.00 1.90 1.80 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.54 7.81 54 H 8.15 4.22 0.00 3.47 3.37 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.26 4.06 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 56 D 7.72 4.25 0.00 2.95 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 57 K 8.05 4.05 0.00 2.01 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.65 7.81 58 L 8.02 4.03 0.00 1.89 1.73 0.96 0.64 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 59 I 8.10 3.80 2.08 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 1.53 1.57 0.92 0.00 0.00 60 E 8.10 3.99 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 61 R 8.20 3.99 0.00 2.04 2.13 0.00 3.35 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 62 I 7.83 3.70 1.90 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 1.54 0.85 0.95 0.00 0.00 63 L 7.73 3.99 0.00 1.86 1.80 0.93 1.51 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 64 F 8.17 4.32 0.00 2.96 3.35 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 65 L 8.09 3.89 0.00 1.84 1.59 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.08 3.47 0.00 2.09 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 2.16 2.16 0.00 67 G 7.84 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 68 L 8.05 4.58 0.00 1.61 1.60 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.51 0.00 2.04 1.98 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 70 N 9.10 4.70 0.00 2.62 2.83 0.00 0.00 7.12 7.35 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 71 L 8.18 4.59 0.00 1.63 1.63 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.27 4.15 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 73 D 8.11 4.65 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.33 4.49 0.00 1.54 1.54 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.34 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 76 K 8.35 4.26 0.00 1.71 1.72 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.44 7.81 77 L 8.40 4.06 0.00 1.62 1.55 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.51 4.36 0.00 1.76 1.66 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.68 3.88 1.87 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 1.32 0.71 0.89 0.00 0.00 80 G 8.71 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 81 E 8.51 4.77 0.00 2.18 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 0.00 2.39 2.23 0.00 82 N 7.70 5.11 0.00 2.87 2.85 0.00 0.00 6.21 7.22 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 83 T 8.60 4.51 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 1.52 0.00 0.00 84 Q 8.23 4.03 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 85 E 8.71 4.04 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 86 M 8.30 4.13 0.00 1.52 2.36 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 2.44 1.95 0.00 87 L 7.98 4.14 0.00 1.77 1.73 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.06 4.01 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 89 C 9.11 4.18 0.00 3.17 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.40 4.65 0.00 3.13 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 91 L 8.17 3.99 0.00 1.90 1.90 0.94 0.48 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 92 N 8.30 4.33 0.00 3.04 2.88 0.00 0.00 6.70 6.10 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 93 L 8.18 3.99 0.00 1.79 1.93 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.44 4.14 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 95 L 8.28 4.00 0.00 1.70 1.73 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.31 3.92 0.00 1.88 1.99 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 97 A 7.94 3.98 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 98 T 8.15 3.85 4.59 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 1.23 0.00 0.00 99 K 7.99 3.91 0.00 1.86 1.96 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 100 D 7.95 4.42 0.00 2.76 2.74 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 0.00 101 L 7.88 3.94 0.00 1.98 1.78 0.93 0.92 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 0.00 102 R 7.95 4.09 0.00 2.10 1.98 0.00 3.20 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 103 E 8.20 3.96 0.00 2.05 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 2.34 0.00 104 A 8.09 3.64 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 0.00 105 I 7.46 3.72 2.01 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 1.41 0.64 0.92 0.00 0.00 106 V 7.84 3.56 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.94 0.00 0.00 107 H 8.03 4.13 0.00 3.23 3.34 0.00 5.84 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 0.00 108 C 7.74 3.94 0.00 3.13 3.03 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 0.00 109 E 8.25 3.82 0.00 2.10 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 0.00 2.37 2.45 0.00 110 Q 7.79 3.89 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.06 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 111 V 7.43 3.85 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 0.72 0.00 0.00 0.78 0.00 0.00 112 H 7.36 3.08 0.00 3.20 3.33 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.37 4.51 0.00 2.70 2.43 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 0.00 114 Y 7.65 4.26 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 0.00 115 V 7.87 3.73 2.16 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 1.09 0.00 0.00 0.99 0.00 0.00 116 S 8.47 4.19 0.00 4.22 3.91 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 0.00 117 R 7.78 3.89 0.00 1.92 2.18 0.00 3.22 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 118 D 8.07 4.32 0.00 3.13 2.67 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 0.00 119 L 7.72 3.94 0.00 1.89 1.81 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.85 4.01 0.00 1.94 1.70 0.92 0.73 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 0.00 121 K 8.37 4.10 0.00 2.04 1.99 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.35 7.81 122 D 7.96 4.30 0.00 2.84 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 0.00 123 I 7.53 3.40 1.96 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 1.17 0.71 0.83 0.00 0.00 124 L 8.25 3.91 0.00 1.78 1.90 0.94 0.92 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 0.00 125 E 8.12 3.92 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 126 S 7.96 4.17 0.00 4.04 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 0.00 127 E 8.54 4.21 0.00 2.07 2.30 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 2.60 2.54 0.00 128 E 8.45 4.11 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 2.36 2.52 0.00 129 E 8.18 4.04 0.00 2.29 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 130 H 8.31 4.37 0.00 3.28 3.50 0.00 5.61 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 0.00 131 I 7.96 3.71 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 1.44 0.79 0.94 0.00 0.00 132 D 8.27 4.37 0.00 2.95 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 0.00 133 Y 7.97 4.09 0.00 3.18 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.17 3.66 0.00 1.84 1.67 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.21 3.92 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.70 0.00 136 T 7.81 3.81 4.38 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 1.21 0.00 0.00 137 Q 7.83 3.85 0.00 1.84 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 1.20 2.07 0.00 138 L 7.81 3.84 0.00 1.88 1.62 0.82 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.15 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 0.00 140 L 7.79 4.02 0.00 1.91 1.83 1.05 0.56 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 0.00 141 I 7.55 3.45 1.81 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 0.76 0.28 0.77 0.00 0.00 142 Q 7.50 4.00 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 7.78 4.20 0.00 1.76 1.86 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.69 7.81 144 V 8.30 4.22 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 0.72 0.00 0.00 1.14 0.00 0.00 145 G 8.09 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 0.00 146 L 8.70 3.94 0.00 1.75 1.69 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.11 3.96 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 148 N 8.31 4.30 0.00 3.13 2.92 0.00 0.00 6.70 7.48 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 0.00 149 Y 7.59 3.99 0.00 3.03 3.20 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 0.00 150 L 8.16 4.02 0.00 1.77 1.74 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 7.91 3.93 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 152 S 7.55 4.52 0.00 3.77 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 0.00 153 H 7.66 4.72 0.00 2.92 3.00 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 7.96 4.13 0.00 1.83 1.97 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.43 0.00 155 H 7.55 5.14 0.00 3.10 3.17 0.00 5.71 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.55 4.19 0.00 1.95 1.84 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 2.27 2.29 0.00