NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 P 4.4971 0.0000 0.0000 63.1123 31.3653 173.7966 10 V 4.5011 7.2613 116.7735 58.9877 35.8152 172.4500 11 E 5.0552 8.1506 117.0074 55.7259 32.5112 174.7339 12 V 4.4893 8.3682 121.5493 60.0384 34.3029 174.7796 13 T 5.0498 8.4587 112.9628 60.1429 71.8109 172.6678 14 Y 5.1636 9.4043 124.4994 57.7886 43.4048 174.6676 15 K 3.3958 8.4098 126.6741 57.7681 31.5421 176.2691 16 N 4.5446 8.8380 125.1392 54.0647 37.9612 174.4089 17 M 2.5500 8.0291 120.5773 53.4549 33.6008 175.2435 18 R 4.5897 7.1000 122.0403 55.2380 32.7846 173.9114 19 F 5.4203 9.5029 125.7152 55.9557 42.6269 174.6798 20 L 5.0355 9.2245 121.4686 53.8091 44.8738 174.9337 21 I 5.4493 8.5273 126.4789 59.6487 39.8981 174.8746 22 T 4.6088 8.1386 113.8337 61.1273 72.1401 171.8714 23 H 4.9730 7.8090 117.5741 54.5212 31.5393 173.3061 24 N 3.8792 8.9605 123.8107 51.9862 37.7978 172.1219 25 P 3.7542 0.0000 0.0000 62.8273 31.7624 176.1635 26 T 4.0824 7.8174 111.6332 61.5564 69.6035 175.7089 27 N 4.0398 8.7357 124.1438 56.3866 38.7532 176.0434 28 A 4.1221 8.1175 120.9911 55.3974 18.8560 179.1348 29 T 4.1368 7.7685 104.8470 62.9278 68.5041 175.6011 30 L 4.0999 7.4863 123.1887 57.3659 42.1220 177.9468 31 N 4.5522 7.9710 115.4566 56.5397 38.3199 176.9612 32 K 4.1736 7.9439 118.7347 58.2374 32.3778 178.9576 33 F 4.2765 8.2858 121.5349 61.3407 39.3100 176.9216 34 I 3.5090 7.4903 117.8632 64.3909 36.7491 177.5755 35 E 3.8456 7.7365 118.4976 59.5643 29.6769 178.4030 36 E 3.9220 9.5084 118.7617 59.4097 29.7728 178.1913 37 L 3.8609 7.8832 119.1694 58.2295 41.7662 179.5739 38 K 3.9414 8.7164 119.1281 59.0033 31.8018 178.9378 39 K 3.9359 8.0540 118.4556 59.7274 32.2210 178.3900 40 Y 4.3160 7.7301 115.0207 58.2627 39.2272 175.0895 41 G 3.5847 7.7169 107.2597 45.8843 0.0000 174.2008 42 V 5.0689 7.2743 109.6728 60.0623 33.1712 177.0116 43 T 4.2172 8.5298 122.1676 66.0008 69.7257 174.9421 44 T 5.0754 7.7716 116.1084 61.5509 73.0087 173.0251 45 I 4.8629 8.8464 124.4123 59.4230 41.3752 174.2474 46 V 4.3188 9.8754 130.9323 61.3475 32.7364 174.3617 47 R 4.1319 8.4436 130.1612 55.8619 30.6809 176.8978 48 V 4.6565 8.5173 119.4149 60.6269 33.0973 176.0345 49 C 4.5458 7.7741 118.0855 57.8307 29.3283 172.4342 50 E 4.4449 8.4676 119.5963 53.7471 30.8051 175.8100 51 A 4.0367 8.3963 129.0788 53.0793 18.8241 177.7402 52 T 4.7427 7.9535 112.5526 60.7534 69.2604 173.0747 53 Y 4.5157 7.1441 116.1242 56.0430 40.1842 174.0916 54 D 4.4684 8.4065 121.6153 53.7510 41.2246 176.7597 55 T 3.9418 8.2889 119.5120 64.9543 68.4978 175.7648 56 T 3.4350 8.0720 112.0363 64.7853 68.0523 175.4940 57 L 4.1169 7.7414 121.9308 58.0391 42.3407 177.6466 58 V 3.8806 9.0418 120.1612 63.9036 31.2877 177.9828 59 E 3.9011 7.9361 116.6863 60.3273 30.3495 180.3914 60 K 4.0936 7.4893 118.0280 58.6475 32.0548 176.0565 61 E 4.3924 9.1658 120.2186 54.5753 29.5279 174.9136 62 G 3.6934 8.6966 110.6028 47.8018 0.0000 171.3011 63 I 4.6812 10.0463 120.0795 61.1983 37.4664 174.6709 64 H 5.5832 8.6531 127.6804 54.9109 31.5154 174.1439 65 V 4.5891 9.3760 127.1304 61.3273 32.1793 174.9882 66 L 3.8176 8.4540 129.9680 54.2127 42.6530 176.2145 67 D 4.8786 8.3649 124.8039 52.8497 41.3294 175.7222 68 W 5.0446 8.5268 124.2829 53.9609 29.9810 173.8965 69 P 5.7403 0.0000 0.0000 61.2944 32.6340 174.8215 70 F 5.1458 8.3121 122.8971 56.4738 38.5089 172.7192 71 D 4.3151 8.4973 123.6623 54.7290 41.1050 176.5527 72 D 4.3996 8.9760 126.9708 56.4083 39.0858 177.4939 73 G 4.0629 7.8981 106.5439 45.1496 0.0000 172.7426 74 A 4.7187 8.0609 121.1130 49.0968 22.8955 175.2710 75 P 3.8522 0.0000 0.0000 61.7644 31.9174 175.1821 76 P 3.1925 0.0000 0.0000 62.1734 30.9792 174.7844 77 S 3.5160 7.6212 116.4705 58.5788 64.4327 173.0113 78 N 4.3947 8.4306 117.8730 56.2735 38.3406 177.5560 79 Q 3.8428 7.8980 120.7329 59.3283 29.2655 177.9887 80 I 3.2159 7.4940 120.6048 64.2063 37.0140 178.6549 81 V 3.6319 7.3895 118.4416 66.2432 31.1990 177.9414 82 D 4.3723 8.0082 117.9819 57.0020 40.4377 178.5336 83 D 4.2835 7.6277 119.2389 56.7534 40.9929 178.0322 84 W 4.8749 8.4281 129.6548 61.3484 30.6357 177.3289 85 L 3.7422 8.3692 118.3113 58.3516 41.0793 179.5238 86 S 4.1012 7.9409 113.0406 61.8328 62.6243 176.8768 87 L 3.9421 8.1129 122.8963 58.2476 41.8644 179.1849 88 V 3.6747 7.3843 117.9661 65.8721 31.2166 177.6792 89 K 3.8833 7.8465 118.0459 59.5416 32.3229 177.9073 90 I 3.7541 9.0324 120.9022 62.5858 36.5446 179.3151 91 K 4.2887 6.3962 120.0473 59.0288 32.4607 177.4390 92 F 4.3826 7.5996 118.8833 61.2086 39.1615 177.9478 93 R 4.1769 8.2007 116.4877 58.7285 30.0230 178.2030 94 E 4.2699 8.0261 117.9649 57.8319 31.2678 176.7205 95 E 4.7023 8.7140 118.4946 53.2883 31.0846 171.7156 96 P 4.5493 0.0000 0.0000 64.3165 32.2474 176.6216 97 G 4.1261 9.0596 110.9548 45.6488 0.0000 173.4643 98 C 4.4059 7.6584 113.5838 58.5839 30.2716 172.2055 99 C 5.2571 9.0537 120.0441 57.7115 34.8027 172.3254 100 I 4.9087 8.5380 124.8878 59.6217 38.8583 174.5901 101 A 4.9741 9.1899 130.1137 51.0482 19.9405 175.8540 102 V 4.5163 8.6262 122.7941 62.2655 34.3384 174.3980 103 H 5.0102 8.5065 120.2877 54.9421 31.9998 173.0341 104 S 5.0149 8.4113 117.2298 58.0329 65.7496 174.5380 105 V 3.8044 8.5300 109.7288 63.7114 31.9762 177.5413 106 A 4.1186 8.1442 121.7731 52.3935 19.4013 178.2453 107 G 4.0880 9.8178 104.1446 45.0801 0.0000 173.9539 108 L 4.5008 7.7531 117.8743 54.9794 42.0044 177.0488 109 G 3.7834 7.7684 107.7102 46.8693 0.0000 176.4126 110 R 4.0497 8.7479 118.3899 58.9958 31.1362 177.8492 111 A 3.8699 7.9317 119.9995 54.8229 18.1606 177.7526 112 P 4.0401 0.0000 0.0000 65.5259 31.3166 178.7461 113 V 4.0075 7.3471 115.7534 66.2242 31.1606 177.7234 114 L 3.5642 7.4560 117.1483 57.8072 41.6831 179.6469 115 V 3.4855 7.4670 117.3449 65.9475 31.5106 177.5293 116 A 4.1343 8.9235 121.7789 55.6806 18.1454 179.5925 117 L 3.9655 8.6832 117.5332 57.8564 41.5323 179.1566 118 A 4.5188 8.6466 118.6676 53.6119 18.6232 178.3461 119 L 4.8847 7.7707 116.8910 56.3708 43.1295 178.4535 120 I 4.6927 8.2380 121.4560 64.0908 37.0626 177.9318 121 E 4.4161 8.7250 119.0548 57.9100 29.1932 177.6773 122 G 4.5738 7.9532 104.2065 45.0013 0.0000 173.7292 123 G 4.3482 8.0066 109.1408 45.2838 0.0000 173.4830 124 M 4.7536 8.2069 119.2886 52.8360 34.7719 175.4397 125 K 4.4280 8.3005 124.8596 56.3147 32.9621 177.0826 126 Y 4.1798 8.8363 120.3016 60.8271 37.7385 178.7036 127 E 3.1309 6.5775 120.5546 58.5351 29.3737 179.5163 128 D 4.2288 7.8997 118.5836 57.2211 40.8783 178.5771 129 A 4.0686 8.2201 121.5348 54.9261 18.3354 179.6756 130 V 3.2842 7.6440 116.3096 66.5019 31.3779 178.2623 131 Q 4.1036 7.7188 115.7660 58.7261 28.6658 178.3503 132 F 4.7734 8.4464 122.1027 61.5998 39.4127 177.4310 133 I 3.7482 8.3660 119.7743 64.1365 36.7185 178.1541 134 R 4.5559 8.0029 118.6058 57.2933 30.0068 178.2514 135 Q 4.1620 7.6162 119.4485 59.0567 29.3322 177.4654 136 K 4.4191 7.9027 117.5209 57.1159 32.8550 176.4947 137 R 4.3363 7.7906 119.9840 54.3575 30.0173 176.2731 138 R 3.5450 7.5431 122.5601 58.1145 31.3583 175.8413 139 G 4.0598 7.6029 107.8222 43.3318 0.0000 172.6441 140 A 4.2738 8.5968 126.5744 52.6363 20.8848 173.0082 141 F 3.9221 7.7976 126.6537 57.0995 37.9930 174.8062 142 N 5.0175 8.5458 123.0843 51.4194 39.5383 177.3748 143 S 3.9490 8.1698 115.1773 61.0282 64.5499 176.5540 144 K 3.9296 8.2939 121.9825 59.2736 32.1279 178.4689 145 Q 4.0937 8.5950 118.4467 59.1034 28.7022 178.9607 146 L 3.9759 8.1707 119.7916 58.0285 41.6245 179.4784 147 L 4.0389 7.8261 119.4846 58.0864 41.6911 178.4691 148 Y 3.9352 8.0590 119.2191 60.6872 39.1217 177.5905 149 L 3.8681 8.5014 120.2856 57.6141 41.4613 178.8782 150 E 2.5400 7.6656 118.5730 58.6293 29.4920 178.5328 151 K 4.0846 7.0856 115.8172 56.2922 32.6597 176.6817 152 Y 3.9379 6.9521 121.6678 57.4207 39.1210 174.9991 153 R 4.2717 7.5309 126.2728 53.5893 31.7301 174.4797 154 P 4.6362 0.0000 0.0000 61.6529 32.5666 176.1202 155 K 4.0697 9.0449 118.1324 57.4355 32.7607 178.2193 156 M 3.3309 9.5308 116.2810 55.6845 30.2337 178.2714 157 R 4.1882 7.5493 119.2176 54.6596 28.3517 175.2773 158 L 4.1609 7.2712 118.7543 53.0291 43.7596 175.2072 159 R 3.9201 8.2045 126.7878 56.4588 30.6847 176.3976 160 F 4.7408 8.3801 122.1660 57.9288 40.0314 174.4799 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 9 P 0.00 4.50 0.00 2.14 2.21 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.05 0.00 10 V 7.26 4.50 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 0.97 0.00 0.00 0.88 0.00 0.00 11 E 8.15 5.06 0.00 2.07 1.62 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 2.12 2.26 0.00 12 V 8.37 4.49 1.87 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 0.98 0.00 0.00 0.38 0.00 0.00 13 T 8.46 5.05 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 1.25 0.00 0.00 14 Y 9.40 5.16 0.00 3.07 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.41 3.40 0.00 1.21 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.51 0.21 7.81 16 N 8.84 4.54 0.00 2.79 2.95 0.00 0.00 5.85 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 17 M 8.03 2.55 0.00 1.13 1.89 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.10 0.00 18 R 7.10 4.59 0.00 1.77 1.94 0.00 3.37 0.00 0.00 3.37 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 19 F 9.50 5.42 0.00 3.19 3.15 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 20 L 9.22 5.04 0.00 1.54 1.43 0.31 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.53 5.45 1.83 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 0.90 1.54 0.92 0.00 0.00 22 T 8.14 4.61 4.28 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 1.29 0.00 0.00 23 H 7.81 4.97 0.00 2.96 3.34 0.00 5.73 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 24 N 8.96 3.88 0.00 2.77 2.68 0.00 0.00 7.23 7.52 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 25 P 0.00 3.75 0.00 0.98 0.49 0.00 3.26 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 26 T 7.82 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 27 N 8.74 4.04 0.00 2.73 2.93 0.00 0.00 7.10 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 28 A 8.12 4.12 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 29 T 7.77 4.14 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 30 L 7.49 4.10 0.00 1.91 1.75 0.88 0.74 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 31 N 7.97 4.55 0.00 2.79 2.85 0.00 0.00 7.12 6.94 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 32 K 7.94 4.17 0.00 1.83 1.87 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.74 1.50 7.81 33 F 8.29 4.28 0.00 3.15 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.49 3.51 1.89 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.93 0.92 0.00 0.00 35 E 7.74 3.85 0.00 2.16 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 0.00 2.29 2.33 0.00 36 E 9.51 3.92 0.00 2.07 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 2.43 2.24 0.00 37 L 7.88 3.86 0.00 1.76 1.59 0.65 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.72 3.94 0.00 1.78 1.99 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.51 7.81 39 K 8.05 3.94 0.00 1.67 1.57 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.69 1.47 7.81 40 Y 7.73 4.32 0.00 3.10 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 41 G 7.72 3.58 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 0.00 0.00 0.00 42 V 7.27 5.07 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 0.95 0.00 0.00 0.91 0.00 0.00 43 T 8.53 4.22 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 1.20 0.00 0.00 44 T 7.77 5.08 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 1.23 0.00 0.00 45 I 8.85 4.86 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 2.24 1.01 0.00 0.00 46 V 9.88 4.32 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 0.86 0.00 0.00 1.13 0.00 0.00 47 R 8.44 4.13 0.00 1.91 1.86 0.00 3.23 0.00 0.00 3.33 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 48 V 8.52 4.66 1.48 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 0.83 0.00 0.00 0.66 0.00 0.00 49 C 7.77 4.55 0.00 3.00 2.69 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 50 E 8.47 4.44 0.00 1.90 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 2.18 2.24 0.00 51 A 8.40 4.04 1.06 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 0.00 0.00 52 T 7.95 4.74 4.28 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 1.31 0.00 0.00 53 Y 7.14 4.52 0.00 3.00 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 54 D 8.41 4.47 0.00 2.83 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 55 T 8.29 3.94 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 0.99 0.00 0.00 56 T 8.07 3.43 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 1.21 0.00 0.00 57 L 7.74 4.12 0.00 1.72 1.93 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 58 V 9.04 3.88 2.32 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 1.10 0.00 0.00 1.17 0.00 0.00 59 E 7.94 3.90 0.00 2.06 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 2.54 2.30 0.00 60 K 7.49 4.09 0.00 1.98 1.89 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.75 1.60 7.81 61 E 9.17 4.39 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 62 G 8.70 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 63 I 10.05 4.68 1.90 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 1.06 1.72 0.94 0.00 0.00 64 H 8.65 5.58 0.00 3.24 3.14 0.00 5.88 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 65 V 9.38 4.59 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 0.73 0.00 0.00 0.94 0.00 0.00 66 L 8.45 3.82 0.00 0.87 0.13 0.49 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.36 4.88 0.00 2.49 2.60 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 0.00 0.00 0.00 0.00 68 W 8.53 5.04 0.00 3.42 2.96 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 69 P 0.00 5.74 0.00 1.96 1.98 0.00 4.01 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.90 0.00 70 F 8.31 5.15 0.00 3.14 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 71 D 8.50 4.32 0.00 2.77 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 72 D 8.98 4.40 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 73 G 7.90 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.06 4.72 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 75 P 0.00 3.85 0.00 2.14 2.05 0.00 3.54 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 76 P 0.00 3.19 0.00 1.55 0.94 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.48 0.00 77 S 7.62 3.52 0.00 4.14 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 78 N 8.43 4.39 0.00 2.83 2.91 0.00 0.00 6.57 7.30 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 79 Q 7.90 3.84 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 80 I 7.49 3.22 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.13 0.90 0.00 0.00 81 V 7.39 3.63 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.94 0.00 0.00 82 D 8.01 4.37 0.00 2.94 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 7.63 4.28 0.00 1.99 1.68 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 84 W 8.43 4.87 0.00 3.39 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 85 L 8.37 3.74 0.00 2.07 1.71 1.12 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 86 S 7.94 4.10 0.00 4.08 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 87 L 8.11 3.94 0.00 2.11 1.91 0.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 88 V 7.38 3.67 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 1.18 0.00 0.00 0.51 0.00 0.00 89 K 7.85 3.88 0.00 1.75 1.99 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.42 7.81 90 I 9.03 3.75 1.86 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 1.83 0.71 0.91 0.00 0.00 91 K 6.40 4.29 0.00 1.88 1.31 0.00 1.56 0.00 0.00 1.40 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.52 7.81 92 F 7.60 4.38 0.00 3.35 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 93 R 8.20 4.18 0.00 1.93 2.00 0.00 3.33 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 94 E 8.03 4.27 0.00 1.96 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 95 E 8.71 4.70 0.00 1.91 1.78 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 2.21 2.25 0.00 96 P 0.00 4.55 0.00 2.06 2.05 0.00 3.72 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 2.06 2.15 0.00 97 G 9.06 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 C 7.66 4.41 0.00 3.06 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 C 9.05 5.26 0.00 3.00 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 0.00 100 I 8.54 4.91 2.41 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 0.57 0.66 1.28 0.00 0.00 101 A 9.19 4.97 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 0.00 102 V 8.63 4.52 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.12 0.00 0.00 103 H 8.51 5.01 0.00 3.31 3.39 0.00 5.48 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.41 5.01 0.00 3.81 3.90 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 0.00 105 V 8.53 3.80 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 0.64 0.00 0.00 0.89 0.00 0.00 106 A 8.14 4.12 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 0.00 107 G 9.82 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 0.00 0.00 0.00 108 L 7.75 4.50 0.00 1.60 1.81 0.84 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 109 G 7.77 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 R 8.75 4.05 0.00 1.71 1.99 0.00 2.46 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.69 0.00 111 A 7.93 3.87 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 0.00 112 P 0.00 4.04 0.00 1.54 1.52 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.02 0.00 113 V 7.35 4.01 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 0.99 0.00 0.00 1.08 0.00 0.00 114 L 7.46 3.56 0.00 1.46 0.76 -0.43 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.47 3.49 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 0.88 0.00 0.00 0.85 0.00 0.00 116 A 8.92 4.13 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.68 3.97 0.00 1.90 1.92 -0.04 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.65 4.52 1.59 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 0.00 0.00 119 L 7.77 4.88 0.00 1.96 1.89 1.08 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.24 4.69 2.09 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.42 1.19 0.00 0.00 121 E 8.73 4.42 0.00 2.47 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 0.00 2.46 2.49 0.00 122 G 7.95 4.57 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 0.00 0.00 0.00 123 G 8.01 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 0.00 0.00 0.00 0.00 124 M 8.21 4.75 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 125 K 8.30 4.43 0.00 2.23 1.93 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.40 7.81 126 Y 8.84 4.18 0.00 3.12 3.22 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 0.00 127 E 6.58 3.13 0.00 1.73 1.71 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 2.02 1.47 0.00 128 D 7.90 4.23 0.00 2.80 2.60 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 0.00 0.00 0.00 0.00 129 A 8.22 4.07 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 V 7.64 3.28 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 1.00 0.00 0.00 0.64 0.00 0.00 131 Q 7.72 4.10 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 132 F 8.45 4.77 0.00 3.07 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 0.00 133 I 8.37 3.75 2.31 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 2.05 1.14 0.88 0.00 0.00 134 R 8.00 4.56 0.00 1.96 2.06 0.00 3.24 0.00 0.00 3.10 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.93 0.00 135 Q 7.62 4.16 0.00 2.15 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.99 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 136 K 7.90 4.42 0.00 1.61 1.77 0.00 1.58 0.00 0.00 1.21 0.00 0.00 3.23 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.63 1.50 7.81 137 R 7.79 4.34 0.00 1.76 1.83 0.00 3.16 0.00 0.00 3.08 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.67 0.00 138 R 7.54 3.55 0.00 1.80 1.85 0.00 3.33 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 1.61 1.75 0.00 139 G 7.60 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.60 4.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 F 7.80 3.92 0.00 3.36 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 0.00 142 N 8.55 5.02 0.00 2.89 2.96 0.00 0.00 5.94 7.64 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 0.00 143 S 8.17 3.95 0.00 4.08 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 0.00 144 K 8.29 3.93 0.00 1.84 2.01 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.50 7.81 145 Q 8.59 4.09 0.00 2.54 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 146 L 8.17 3.98 0.00 1.94 1.82 1.01 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 147 L 7.83 4.04 0.00 1.91 1.84 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 148 Y 8.06 3.94 0.00 2.99 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 0.00 149 L 8.50 3.87 0.00 1.72 1.62 0.74 0.88 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 0.00 150 E 7.67 2.54 0.00 1.48 1.87 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 2.13 2.30 0.00 151 K 7.09 4.08 0.00 1.61 1.69 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.95 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.49 1.49 7.81 152 Y 6.95 3.94 0.00 2.45 2.83 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 0.00 153 R 7.53 4.27 0.00 1.53 1.64 0.00 3.15 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 154 P 0.00 4.64 0.00 2.28 2.12 0.00 3.23 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 155 K 9.04 4.07 0.00 1.78 1.89 0.00 1.86 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.36 1.45 7.81 156 M 9.53 3.33 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.66 0.00 157 R 7.55 4.19 0.00 1.79 1.88 0.00 3.34 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 158 L 7.27 4.16 0.00 1.44 1.31 0.82 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 159 R 8.20 3.92 0.00 1.70 1.69 0.00 3.19 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 160 F 8.38 4.74 0.00 3.01 2.76 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