NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2719 8.3001 118.1919 54.4000 33.2606 174.9246 2 A 3.7751 7.9598 122.9642 51.8798 18.3032 174.0899 3 E 3.9129 8.7438 122.7124 57.7897 31.1020 177.2176 4 G 3.9363 8.2959 111.6986 44.6435 0.0000 172.7571 5 E 3.8565 8.9729 122.0329 58.1632 27.9288 179.4919 6 I 4.0016 8.8361 126.3953 62.0150 36.7426 175.1687 7 T 3.2121 7.3644 110.3338 63.3385 69.0624 170.2310 8 T 4.1992 7.7999 119.2031 59.9227 76.4400 170.8803 9 L 3.6081 8.0054 130.6997 53.1395 42.1204 173.0756 10 P 4.2083 0.0000 0.0000 63.2096 31.7290 175.7526 11 A 4.5474 7.9707 123.7989 52.3781 22.2003 175.7634 12 L 4.5556 7.8349 113.0470 53.9670 43.2548 173.1542 13 P 4.2438 0.0000 0.0000 63.4247 32.2959 176.0465 14 E 3.6213 8.5139 120.9316 57.3742 26.8487 173.1594 15 D 4.7059 8.3433 119.4771 53.8558 41.8228 178.0468 16 G 3.8781 7.7987 110.3230 44.4966 0.0000 175.7955 17 G 3.9199 7.4693 110.0736 44.8147 0.0000 174.1228 18 S 4.6018 7.5908 115.9738 55.8037 63.3599 175.6507 19 G 4.3488 7.4300 115.2073 45.9921 0.0000 172.2508 20 A 4.7466 8.9933 124.2913 51.8187 24.9787 179.8673 21 F 5.0810 7.7106 109.7798 54.3986 39.2948 172.5661 22 P 4.5214 0.0000 0.0000 62.0238 32.3998 174.7245 23 P 4.6687 0.0000 0.0000 62.8396 31.2005 177.4042 24 G 5.1857 8.1233 126.4963 46.9388 0.0000 171.8616 25 H 4.7624 7.4875 113.6166 55.1019 31.1420 173.3867 26 F 4.8435 8.0323 117.4319 57.5115 39.0101 176.7182 27 K 4.3789 8.0907 122.1380 57.1959 32.7976 176.5720 28 D 5.0351 7.6773 116.8041 51.3101 43.2362 173.6752 29 P 4.6843 0.0000 0.0000 63.1460 32.9626 175.2519 30 K 4.9741 8.4379 119.3314 55.1819 36.3447 176.5610 31 R 4.3764 8.6931 124.1681 55.4743 31.7177 175.9246 32 L 4.4456 8.7951 125.0988 54.2817 42.6844 174.8161 33 Y 4.3144 8.5432 126.3111 56.0213 40.6270 173.6560 34 C 3.8849 8.2199 128.5540 58.3205 32.2364 174.1676 35 K 3.6549 7.6318 126.9121 58.3421 32.4199 176.5717 36 N 4.3523 7.7210 117.9211 53.6080 37.7957 175.6078 37 G 4.0449 8.7961 111.6184 44.4654 0.0000 172.5077 38 G 4.0364 7.1850 104.8374 46.9406 0.0000 171.7239 39 F 4.8776 7.2256 121.0042 55.9918 44.0482 173.0017 40 F 5.1723 9.7399 122.9208 55.8767 40.5209 175.3595 41 L 4.4416 8.6015 126.2519 55.7469 43.2076 176.6804 42 R 4.4843 8.6786 124.9298 55.3249 33.4376 173.6537 43 I 4.4239 8.3112 128.2536 60.5199 38.0875 175.8627 44 H 4.5393 8.6577 124.5517 54.5076 29.4732 174.9647 45 P 4.4720 0.0000 0.0000 65.6935 31.2313 177.3415 46 D 4.4773 7.9905 114.9339 53.8683 39.6437 175.7251 47 G 4.0355 8.6501 109.1133 45.6796 0.0000 174.1046 48 R 3.7007 7.9106 118.7503 56.8542 30.2828 175.3713 49 V 4.5079 8.0285 123.4960 61.9501 32.8624 174.7104 50 D 4.7500 8.7548 125.1114 52.4773 42.8175 174.9098 51 G 4.5140 8.4145 107.7419 45.8580 0.0000 173.2540 52 V 5.0331 9.1094 112.9813 60.1795 36.4055 175.9981 53 R 4.4657 8.9174 120.5490 56.6449 30.7900 177.2891 54 E 4.2405 7.8807 119.5010 55.0976 28.1055 176.9913 55 K 3.8309 8.0578 122.7165 57.8230 33.0679 178.3136 56 S 4.3851 7.3716 113.3071 58.5250 63.1763 173.7375 57 D 4.7421 7.4792 122.3047 52.7665 40.9205 175.4913 58 P 4.4786 0.0000 0.0000 64.1498 31.2504 177.9145 59 H 4.5119 7.9507 115.4822 57.0643 29.0614 175.9432 60 I 4.0933 7.7793 111.9279 61.5060 37.8848 177.1138 61 K 4.3390 7.4958 121.2098 56.3082 31.0697 174.7223 62 L 4.4900 8.1000 124.0311 53.5547 44.1457 175.1906 63 Q 4.4124 9.1189 125.7290 55.1603 29.8559 174.6866 64 L 5.0256 8.5155 126.5875 54.0188 43.9518 176.2314 65 Q 4.5835 8.9126 121.8279 54.5564 32.5949 173.5316 66 A 3.6539 8.2873 128.8847 52.4568 18.4951 175.0236 67 E 3.9674 8.8281 125.3493 56.6292 30.1906 178.9660 68 E 4.4196 7.8569 121.5729 55.2207 32.7161 175.0515 69 R 4.3117 8.4375 120.8804 58.6574 30.0811 176.3843 70 G 4.3086 9.2498 113.0184 44.9636 0.0000 172.2441 71 V 4.3444 7.2023 119.5893 62.1531 32.3527 175.4896 72 V 4.8734 8.0595 117.2342 60.0552 36.2233 174.2055 73 S 4.9518 9.4688 122.5634 57.6071 63.4286 173.6926 74 I 4.6328 8.4342 125.4856 60.4906 39.2147 174.6804 75 K 4.4491 8.5760 124.8206 54.8698 36.3470 174.9335 76 G 3.9496 8.3818 113.3327 45.3081 0.0000 174.5335 77 V 3.7350 8.0515 124.0100 65.5300 32.1131 177.5172 78 S 4.1538 7.8274 114.2398 60.9112 62.6379 175.3427 79 A 4.0635 7.9661 121.9997 52.9163 18.8452 176.5916 80 N 4.2285 7.5277 111.9159 53.9846 36.8768 174.2008 81 R 4.7982 7.0286 114.1123 54.9964 35.8247 175.0901 82 Y 4.7812 9.1937 120.4517 56.4963 39.8269 175.2004 83 L 4.5317 7.9991 123.0014 55.6618 43.8442 175.6595 84 A 5.1364 9.2261 125.9437 50.9469 23.0125 174.5772 85 M 4.7601 8.3480 122.4672 54.0355 33.5220 176.7912 86 K 4.3895 8.3885 126.6015 56.0951 33.4803 176.0503 87 E 3.6900 8.4614 116.1712 58.0022 30.4309 177.2044 88 D 4.2647 8.1124 118.6722 55.2147 40.2843 176.0980 89 G 3.3619 7.7122 113.3327 44.8941 0.0000 172.3563 90 R 4.0383 8.1100 122.6323 55.9747 30.9827 175.5719 91 L 4.9752 8.1401 124.7332 53.7301 43.3303 176.0213 92 L 4.6412 8.5774 122.0341 55.0132 44.0257 174.1178 93 A 5.2392 8.3483 118.3702 51.1932 22.4963 175.7305 94 S 4.6656 8.6797 113.7017 56.9737 67.4720 175.9014 95 K 4.2638 8.8536 121.0071 59.0391 32.1699 177.9640 96 S 4.5462 7.8579 115.1680 56.8738 63.7488 174.5172 97 V 3.6461 7.7324 125.0262 61.6380 32.0399 175.0962 98 T 4.4756 7.3255 108.6459 60.8271 71.1805 173.6238 99 D 4.5958 8.5659 119.4885 56.8107 40.8082 177.0308 100 E 4.2184 7.9363 117.5911 56.5711 29.6333 176.8241 101 C 4.8752 7.0239 115.3123 59.3015 28.6313 173.6979 102 F 4.7531 7.0053 118.2769 56.8496 40.5589 175.8037 103 F 4.6152 8.3504 120.0349 56.1988 43.1021 173.9996 104 F 4.6166 8.8337 124.0793 58.0675 39.6355 174.5235 105 E 4.7888 9.0062 125.8995 55.5794 31.1006 175.8504 106 R 4.6858 8.5018 125.9151 54.9877 33.7633 173.1926 107 L 4.6820 8.7931 128.9977 54.3570 43.1854 176.3193 108 E 4.4716 8.3901 126.1911 55.5922 31.8295 175.6529 109 S 4.7097 8.2780 112.2274 58.1494 62.1637 174.8887 110 N 4.8907 7.7713 112.3021 53.3046 40.3617 176.2706 111 N 4.1292 8.3897 112.9645 54.0485 37.1871 173.5454 112 Y 4.7830 7.6545 116.7631 56.9307 40.0305 175.1278 113 N 5.2221 9.1108 121.1917 52.4525 41.7016 174.3939 114 T 4.8877 8.0822 109.6140 60.8088 72.2479 172.5543 115 Y 4.7887 8.7395 125.1497 56.7530 39.5507 174.5868 116 R 4.7782 9.3261 126.2512 54.7146 32.3544 175.8369 117 S 4.2147 8.5265 119.7337 58.8855 63.5902 173.0793 118 R 4.4292 8.4139 122.9359 57.3218 30.5958 177.6167 119 K 3.5962 7.4965 123.5260 58.7689 33.3011 176.8546 120 Y 5.0242 7.5877 115.5625 57.3948 38.6282 175.9915 121 T 4.3755 7.7191 106.5690 62.8627 69.2703 175.5342 122 S 4.3470 7.8252 117.9257 58.3344 62.9996 173.7211 123 W 5.3702 7.4578 119.8495 55.9492 33.3699 173.6257 124 Y 5.0132 9.2161 121.3659 56.5107 40.2524 174.9091 125 V 4.3880 8.4134 120.5280 62.2944 32.6586 175.1855 126 A 5.0267 8.5683 127.7352 51.0472 22.7082 175.6307 127 L 4.5471 8.5772 121.6303 53.8485 44.1080 175.6079 128 K 4.4845 8.4975 120.3368 55.5528 33.7642 176.9971 129 R 4.1001 8.4135 115.4226 58.0497 30.0989 176.8344 130 T 4.0548 7.6196 111.5784 61.8869 67.6310 174.9984 131 G 3.3223 7.3480 108.7421 45.4473 0.0000 173.4147 132 Q 4.8003 7.3050 118.9321 54.9770 31.0539 174.1060 133 Y 4.7710 8.3325 119.0550 55.8694 38.9685 175.3903 134 K 3.9277 8.0923 126.2674 55.5101 33.1746 176.5051 135 L 4.0189 8.4746 128.8901 55.2686 42.4483 177.7316 136 G 3.7126 8.0596 112.1494 46.8515 0.0000 174.2458 137 S 3.3889 7.3972 114.0733 59.1583 63.8783 175.2833 138 K 4.2927 7.6625 118.6945 57.0425 32.3657 177.2169 139 T 4.2172 7.7919 109.0410 60.6722 69.3999 174.0280 140 G 4.1796 8.3244 110.5645 44.7395 0.0000 169.7377 141 P 4.3741 0.0000 0.0000 63.2921 31.9564 175.9685 142 G 4.3433 8.7958 110.1238 45.9880 0.0000 174.5799 143 Q 4.1219 7.2772 119.3488 55.3848 29.2897 176.8161 144 K 4.1114 8.5146 120.3553 56.6873 32.3559 178.0754 145 A 4.0363 7.3491 121.7899 53.4835 18.1173 178.3880 146 I 4.4288 7.3403 108.2515 61.2031 38.1180 176.5545 147 L 4.3076 7.6154 123.0808 54.3156 40.8126 176.2903 148 F 4.3234 9.2192 123.1151 55.8436 41.5813 174.8971 149 L 5.2478 8.2861 120.5581 52.9175 41.1804 173.3489 150 P 4.6969 0.0000 0.0000 63.2669 32.5532 176.3072 151 M 4.5128 8.6749 125.5144 53.5808 33.6561 176.0588 152 S 4.4198 8.7155 119.2205 57.4489 63.2572 174.5231 153 A 4.4020 7.6702 131.0431 51.2278 17.0242 177.1230 154 K 3.9466 7.1416 121.8991 58.9819 33.1534 178.2784 155 S 4.2991 8.0202 122.1227 59.2201 62.7084 174.4646 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 8.30 4.27 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.60 0.00 2 A 7.96 3.78 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 3 E 8.74 3.91 0.00 1.91 1.85 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 2.28 2.48 0.00 4 G 8.30 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.97 3.86 0.00 1.94 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 6 I 8.84 4.00 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.35 0.90 0.00 0.00 7 T 7.36 3.21 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 1.19 0.00 0.00 8 T 7.80 4.20 4.21 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 1.20 0.00 0.00 9 L 8.01 3.61 0.00 1.78 1.64 0.91 0.98 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 10 P 0.00 4.21 0.00 2.04 1.98 0.00 3.91 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 11 A 7.97 4.55 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 12 L 7.83 4.56 0.00 1.53 1.52 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.24 0.00 2.20 2.04 0.00 3.69 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 14 E 8.51 3.62 0.00 2.14 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 2.33 2.42 0.00 15 D 8.34 4.71 0.00 2.69 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 16 G 7.80 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 7.47 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 0.00 0.00 0.00 18 S 7.59 4.60 0.00 3.88 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 19 G 7.43 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 20 A 8.99 4.75 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 F 7.71 5.08 0.00 3.33 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.52 0.00 2.12 2.07 0.00 3.79 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 23 P 0.00 4.67 0.00 2.16 2.14 0.00 4.18 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 24 G 8.12 5.19 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 0.00 25 H 7.49 4.76 0.00 2.55 2.97 0.00 5.69 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 26 F 8.03 4.84 0.00 3.15 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 27 K 8.09 4.38 0.00 1.78 1.89 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.52 7.81 28 D 7.68 5.04 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.68 0.00 2.00 2.01 0.00 3.83 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 2.12 2.02 0.00 30 K 8.44 4.97 0.00 1.65 1.71 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.54 7.81 31 R 8.69 4.38 0.00 1.98 2.12 0.00 3.12 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 32 L 8.80 4.45 0.00 1.73 1.80 0.63 0.80 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 33 Y 8.54 4.31 0.00 2.74 2.82 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 34 C 8.22 3.88 0.00 2.65 2.50 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 35 K 7.63 3.65 0.00 1.74 1.41 0.00 1.50 0.00 0.00 1.50 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.60 7.81 36 N 7.72 4.35 0.00 2.60 2.65 0.00 0.00 6.75 8.12 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 37 G 8.80 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 7.19 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 F 7.23 4.88 0.00 2.89 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 40 F 9.74 5.17 0.00 3.25 3.17 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 0.00 41 L 8.60 4.44 0.00 1.77 1.64 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.68 4.48 0.00 1.98 1.86 0.00 3.15 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.61 0.00 43 I 8.31 4.42 1.82 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 1.28 0.63 0.87 0.00 0.00 44 H 8.66 4.54 0.00 3.50 3.22 0.00 5.63 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 45 P 0.00 4.47 0.00 2.06 2.14 0.00 3.97 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 2.03 1.98 0.00 46 D 7.99 4.48 0.00 2.77 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 47 G 8.65 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.91 3.70 0.00 2.19 1.93 0.00 3.21 0.00 0.00 3.02 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 49 V 8.03 4.51 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 0.73 0.00 0.00 0.92 0.00 0.00 50 D 8.75 4.75 0.00 2.83 2.78 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 51 G 8.41 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.11 5.03 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 0.86 0.00 0.00 1.10 0.00 0.00 53 R 8.92 4.47 0.00 1.81 1.94 0.00 2.69 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.51 0.00 54 E 7.88 4.24 0.00 2.07 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 2.37 2.30 0.00 55 K 8.06 3.83 0.00 1.48 1.14 0.00 1.33 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.23 7.81 56 S 7.37 4.39 0.00 4.03 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 57 D 7.48 4.74 0.00 2.87 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 58 P 0.00 4.48 0.00 2.08 2.03 0.00 3.60 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 59 H 7.95 4.51 0.00 3.12 3.35 0.00 5.89 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.78 4.09 1.97 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.57 1.03 0.00 0.00 61 K 7.50 4.34 0.00 1.87 1.80 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.51 7.81 62 L 8.10 4.49 0.00 1.56 1.61 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.12 4.41 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 64 L 8.52 5.03 0.00 1.71 1.80 0.94 0.95 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 65 Q 8.91 4.58 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.07 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 66 A 8.29 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 67 E 8.83 3.97 0.00 2.01 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 0.00 2.11 2.22 0.00 68 E 7.86 4.42 0.00 1.98 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 2.24 2.11 0.00 69 R 8.44 4.31 0.00 1.82 1.90 0.00 3.19 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 70 G 9.25 4.31 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 0.00 71 V 7.20 4.34 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 0.69 0.00 0.00 0.75 0.00 0.00 72 V 8.06 4.87 2.21 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 0.95 0.00 0.00 1.24 0.00 0.00 73 S 9.47 4.95 0.00 3.85 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.43 4.63 1.78 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.85 0.75 0.00 0.00 75 K 8.58 4.45 0.00 1.59 1.53 0.00 1.40 0.00 0.00 1.49 0.00 0.00 2.60 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.85 0.21 7.81 76 G 8.38 3.95 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 0.00 0.00 0.00 77 V 8.05 3.73 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 0.67 0.00 0.00 0.94 0.00 0.00 78 S 7.83 4.15 0.00 3.72 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.97 4.06 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 80 N 7.53 4.23 0.00 2.85 2.83 0.00 0.00 6.76 7.05 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 81 R 7.03 4.80 0.00 1.65 1.82 0.00 3.10 0.00 0.00 3.47 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 82 Y 9.19 4.78 0.00 2.88 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 83 L 8.00 4.53 0.00 1.68 1.52 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 84 A 9.23 5.14 1.22 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 85 M 8.35 4.76 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 86 K 8.39 4.39 0.00 1.95 1.82 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.53 7.81 87 E 8.46 3.69 0.00 2.00 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 2.26 2.25 0.00 88 D 8.11 4.26 0.00 2.70 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 89 G 7.71 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 90 R 8.11 4.04 0.00 1.75 1.78 0.00 3.09 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 91 L 8.14 4.98 0.00 1.38 1.54 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 92 L 8.58 4.64 0.00 1.67 1.67 1.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.35 5.24 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 94 S 8.68 4.67 0.00 3.94 3.72 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 95 K 8.85 4.26 0.00 1.78 1.93 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.61 1.48 7.81 96 S 7.86 4.55 0.00 3.84 3.75 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 97 V 7.73 3.65 0.85 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 0.50 0.00 0.00 0.36 0.00 0.00 98 T 7.33 4.48 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 1.15 0.00 0.00 99 D 8.57 4.60 0.00 2.66 2.79 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 0.00 100 E 7.94 4.22 0.00 2.00 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 2.39 2.24 0.00 101 C 7.02 4.88 0.00 2.47 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 0.00 102 F 7.01 4.75 0.00 2.68 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 0.00 103 F 8.35 4.62 0.00 3.27 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.83 4.62 0.00 3.17 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 0.00 105 E 9.01 4.79 0.00 2.15 1.85 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 1.89 1.58 0.00 106 R 8.50 4.69 0.00 2.03 1.80 0.00 3.23 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 107 L 8.79 4.68 0.00 1.75 1.72 1.01 1.07 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 0.00 108 E 8.39 4.47 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 109 S 8.28 4.71 0.00 3.85 3.84 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 0.00 110 N 7.77 4.89 0.00 2.98 2.95 0.00 0.00 7.06 6.96 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 0.00 111 N 8.39 4.13 0.00 2.49 2.75 0.00 0.00 7.02 7.42 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 0.00 112 Y 7.65 4.78 0.00 3.00 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 0.00 113 N 9.11 5.22 0.00 2.63 2.34 0.00 0.00 6.34 6.59 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 0.00 114 T 8.08 4.89 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 0.00 115 Y 8.74 4.79 0.00 2.83 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 0.00 116 R 9.33 4.78 0.00 1.98 1.95 0.00 3.01 0.00 0.00 2.92 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.79 0.00 117 S 8.53 4.21 0.00 4.21 4.27 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 0.00 118 R 8.41 4.43 0.00 1.48 1.49 0.00 2.73 0.00 0.00 3.06 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 119 K 7.50 3.60 0.00 1.25 0.74 0.00 1.49 0.00 0.00 1.54 0.00 0.00 3.06 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.79 1.06 7.81 120 Y 7.59 5.02 0.00 3.28 3.14 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 0.00 121 T 7.72 4.38 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 1.35 0.00 0.00 122 S 7.83 4.35 0.00 3.28 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 0.00 123 W 7.46 5.37 0.00 3.51 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 0.00 124 Y 9.22 5.01 0.00 2.99 3.14 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 0.00 125 V 8.41 4.39 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 0.63 0.00 0.00 1.06 0.00 0.00 126 A 8.57 5.03 1.33 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 0.00 0.00 0.00 127 L 8.58 4.55 0.00 1.50 1.72 1.04 1.01 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 0.00 128 K 8.50 4.48 0.00 1.51 1.63 0.00 1.42 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.29 7.81 129 R 8.41 4.10 0.00 1.92 2.03 0.00 3.01 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 130 T 7.62 4.05 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 1.10 0.00 0.00 131 G 7.35 3.32 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 0.00 132 Q 7.30 4.80 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.03 0.00 0.00 0.00 0.00 0.00 2.36 2.21 0.00 133 Y 8.33 4.77 0.00 3.03 3.13 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 0.00 134 K 8.09 3.93 0.00 1.78 1.89 0.00 1.79 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.30 7.81 135 L 8.47 4.02 0.00 1.63 1.40 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.06 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 0.00 137 S 7.40 3.39 0.00 3.71 3.59 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 0.00 138 K 7.66 4.29 0.00 1.75 1.88 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.30 7.81 139 T 7.79 4.22 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 1.43 0.00 0.00 140 G 8.32 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 0.00 0.00 0.00 0.00 141 P 0.00 4.37 0.00 2.03 1.96 0.00 3.79 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 142 G 8.80 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Q 7.28 4.12 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 144 K 8.51 4.11 0.00 1.85 1.62 0.00 1.54 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.35 7.81 145 A 7.35 4.04 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 0.00 146 I 7.34 4.43 1.92 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.61 0.93 0.00 0.00 147 L 7.62 4.31 0.00 1.06 0.56 0.51 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 148 F 9.22 4.32 0.00 3.22 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 0.00 149 L 8.29 5.25 0.00 1.86 1.80 0.81 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 150 P 0.00 4.70 0.00 2.08 2.19 0.00 3.84 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 2.15 2.46 0.00 151 M 8.67 4.51 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.67 0.00 152 S 8.72 4.42 0.00 3.85 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.67 4.40 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 0.00 154 K 7.14 3.95 0.00 1.76 1.72 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 155 S 8.02 4.30 0.00 3.85 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