NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.3554 8.3449 118.8211 55.6224 30.2313 174.5092 2 K 4.2044 7.7433 122.9575 56.0226 37.9823 173.6511 3 P 4.5818 0.0000 0.0000 63.0896 34.0470 173.9168 4 K 5.6123 7.6196 126.5597 57.0803 35.5194 174.8472 5 L 4.0982 8.1608 125.0404 54.7938 42.9628 177.5650 6 L 4.7537 8.5458 120.8148 53.2135 41.2409 175.8414 7 Y 5.0901 8.9364 125.1827 57.2406 40.8881 173.4437 8 C 5.3611 6.9778 120.0536 57.8761 35.3721 174.3366 9 S 4.3235 8.5252 117.7000 59.4984 63.0532 174.8511 10 N 4.7127 8.4423 119.8836 51.8136 37.7433 173.8898 11 G 3.4624 9.2986 111.3931 44.4174 0.0000 172.9869 12 G 3.2786 7.3149 106.1771 46.7784 0.0000 171.9898 13 Y 4.5925 6.7054 115.3515 55.9994 43.2399 176.3195 14 F 5.0763 8.5358 120.2787 56.7328 40.8166 175.2875 15 L 5.3894 8.9666 124.3098 54.1979 43.1287 176.5385 16 R 4.7253 8.1147 117.8691 55.6721 32.6215 172.7665 17 I 5.1506 7.9864 111.2973 59.5179 40.2336 172.5804 18 F 4.4558 9.0740 130.7628 58.9066 37.2744 174.6043 19 P 4.6961 0.0000 0.0000 65.6717 32.2705 177.7105 20 D 4.6719 8.0924 118.4981 53.5633 40.9833 177.6782 21 G 4.0635 8.4367 105.3235 46.0275 0.0000 173.7317 22 K 4.4642 7.7678 120.4044 56.3299 32.6578 177.1349 23 V 4.3888 8.2318 125.8297 63.1280 33.2593 174.3106 24 D 4.5267 8.9500 121.8999 52.6636 43.2403 174.7716 25 G 4.2678 8.4584 107.8644 45.8305 0.0000 172.4756 26 T 4.8834 9.4396 120.7393 60.0257 69.6633 174.3814 27 R 3.9389 8.8932 124.0727 57.3996 29.8396 177.7191 28 D 4.7713 7.8794 121.3431 52.7728 39.3219 176.7978 29 R 3.7090 8.3057 118.6714 58.6702 29.8633 179.4150 30 S 4.1245 8.0181 113.9646 60.8678 63.3160 174.1953 31 D 4.2749 8.0143 120.3441 54.3063 41.0375 175.2576 32 P 4.4957 0.0000 0.0000 63.6582 31.6562 176.4438 33 Y 5.0375 7.4415 112.5465 58.1109 40.4991 174.2491 34 I 4.5807 7.4158 107.2265 60.5504 39.3635 175.8647 35 Q 4.2313 7.8262 120.5371 56.8507 30.5934 173.9397 36 L 4.8076 7.5707 119.3236 56.6848 45.8324 173.0780 37 Q 4.7283 8.2659 114.7672 55.5241 32.4176 173.3676 38 F 5.3582 9.3788 129.2070 57.0636 40.6241 173.7091 39 Y 4.5039 9.0355 122.6917 55.9853 42.3915 174.3815 40 A 4.9941 8.5684 121.5878 50.7401 22.0707 174.6971 41 E 4.3411 8.3328 118.6374 56.2557 30.9669 175.5721 42 S 4.6083 7.6265 111.7417 58.8207 66.7134 173.3105 43 V 3.8727 9.1434 123.3446 61.4760 28.3213 171.4669 44 G 4.3651 9.0870 103.2152 45.6614 0.0000 170.3309 45 E 5.7058 8.1496 118.5444 54.5106 32.9342 174.9520 46 V 4.9827 8.1709 112.4850 60.0554 37.3072 173.5582 47 Y 4.9890 9.3233 122.1095 56.3476 41.5414 175.3535 48 I 5.5047 8.4585 128.0470 60.2011 40.0978 174.3582 49 K 4.9306 8.3659 121.7371 53.8288 36.1297 174.8151 50 S 4.7676 8.0055 119.3215 57.3003 64.5740 174.3949 51 L 3.6942 8.7357 129.9831 53.4831 41.3467 174.4724 52 E 4.0269 8.2211 115.8587 58.6130 29.7838 178.5866 53 T 3.9952 7.6864 107.5097 61.7203 68.8463 174.1489 54 G 3.6786 7.5296 109.6653 46.9782 0.0000 173.4272 55 Q 4.2849 7.3515 124.1961 56.0997 31.7574 174.0900 56 Y 5.1514 7.9090 120.5015 58.5299 42.1024 173.9137 57 L 4.8455 8.5257 121.5262 54.8333 45.4823 176.2669 58 A 4.7157 9.0538 126.5549 50.3760 23.2506 174.8954 59 M 5.0897 9.0536 120.7724 54.7642 33.0788 175.5407 60 D 4.3517 9.1244 125.8894 54.5284 42.4019 176.7762 61 S 4.7846 8.2777 119.8947 56.0769 61.1649 171.5890 62 D 4.2219 7.0593 133.6628 54.4748 44.2610 177.8500 63 G 3.1428 7.0191 118.9764 46.1710 0.0000 172.2617 64 Q 4.4447 7.1254 119.6313 55.5335 30.5910 174.1986 65 L 5.4215 8.5671 120.9669 53.8328 44.9905 174.9738 66 Y 5.4415 9.3586 123.7079 54.6037 41.9501 174.5700 67 A 4.2165 8.1943 122.5762 51.7609 19.0653 177.8454 68 S 3.7183 8.4010 116.9725 58.0764 63.5636 173.9315 69 Q 4.4376 8.6352 123.7822 57.3314 30.3659 176.3775 70 S 4.7274 7.7795 110.0913 55.9463 64.9532 174.2516 71 P 5.4968 0.0000 0.0000 59.9081 30.4490 175.6849 72 S 3.7682 8.7985 117.3651 56.6423 63.1686 171.4137 73 E 3.8316 8.7398 123.6033 59.6925 29.2343 178.9865 74 E 3.9017 7.5782 116.8288 59.2865 29.9229 177.9033 75 C 4.2881 7.7374 115.9203 59.6029 28.4573 172.1980 76 L 4.3446 6.8933 122.2990 54.8094 44.5078 174.4851 77 F 5.2171 7.8084 115.9617 58.3321 44.8838 172.7489 78 L 5.1700 8.3246 118.8370 54.6395 44.1842 175.2168 79 E 4.5638 9.1452 119.6430 54.7064 31.8978 175.2784 80 R 4.4195 8.3679 125.8579 54.7172 34.0718 174.1243 81 L 4.8778 8.5239 125.9271 51.8364 45.1257 174.0600 82 E 3.8206 8.4129 116.6605 58.3713 28.1534 178.3319 83 E 3.9550 8.5519 116.1452 56.6607 29.7380 176.2254 84 N 4.5609 7.1935 128.5125 53.8902 40.4557 172.2213 85 N 4.5199 8.4954 129.3564 53.4072 43.4423 173.9335 86 Y 5.2202 6.8654 115.0200 55.9011 41.6688 172.9121 87 N 4.8093 9.3098 118.5963 52.9190 42.6243 173.4544 88 T 3.2064 8.5277 106.2410 64.1566 69.2539 175.9251 89 Y 4.0835 8.6282 113.0042 58.6610 37.3921 165.0000 90 K 2.0000 7.7219 126.9028 54.0067 33.6290 176.5391 91 S 4.9288 7.2876 117.2470 59.1349 67.2487 174.1767 92 K 4.3799 8.2061 131.4982 58.0422 38.5714 174.7500 93 V 5.0308 8.1847 120.3618 64.3127 35.1512 174.9384 94 H 4.2497 8.0039 117.4987 55.9127 29.8278 175.8135 95 A 4.1005 8.6636 123.7017 54.9245 19.5720 182.0957 96 D 4.1584 8.8447 111.3981 53.2661 42.4979 172.4485 97 K 4.9475 5.6600 126.4303 58.0511 32.4291 177.4056 98 D 4.1736 8.2802 120.7218 56.0435 41.0312 177.2140 99 W 5.4075 7.8984 118.4154 55.5030 30.8099 172.8998 100 F 4.8815 7.9664 122.5963 56.0844 42.3495 175.2903 101 V 4.1389 8.4029 121.3593 61.3736 33.0890 175.3667 102 G 5.0892 8.4521 107.9063 46.6363 0.0000 171.4259 103 I 4.9636 8.9343 119.2585 58.6346 41.3163 174.5163 104 K 3.9522 8.2649 122.1141 56.3356 35.5506 173.3258 105 K 4.2497 8.5350 122.7139 54.9159 28.6009 177.1371 106 N 3.5450 7.4063 125.0395 52.3836 37.5533 172.4796 107 G 3.4235 7.2682 105.6045 47.7795 0.0000 172.5824 108 K 4.2750 9.6692 131.6424 56.1510 31.5632 177.1971 109 T 3.2875 7.5080 115.1016 62.3273 66.3595 171.6019 110 K 4.3986 8.8187 119.4656 53.7690 32.7591 173.7442 111 P 4.4062 0.0000 0.0000 62.9172 30.1886 176.1366 112 G 4.4089 9.0895 111.2568 46.4911 0.0000 172.4631 113 S 4.1655 7.6229 113.7572 59.9775 62.3396 175.8256 114 R 4.3033 7.1584 118.1333 56.2649 30.9177 173.8666 115 T 4.2218 7.8191 120.2085 61.4476 70.4542 174.9592 116 H 4.6294 8.3133 130.8703 56.2918 29.7278 173.5930 117 F 3.4012 6.1847 115.1921 58.3673 36.9394 175.0445 118 G 4.0770 9.0862 113.5031 45.7768 0.0000 173.4342 119 Q 4.0069 7.9468 118.2533 55.7795 29.4557 178.5039 120 K 3.9535 8.5905 119.1992 59.4623 32.1246 178.1725 121 A 3.9485 7.8490 120.9301 55.4212 17.8464 178.8654 122 I 3.8790 6.8700 106.0346 63.2803 37.8990 175.5666 123 L 4.0505 8.0945 117.2992 54.8815 43.0742 176.1297 124 F 5.5888 9.4285 121.8956 56.0802 43.7992 174.2404 125 L 5.1993 9.2815 123.8917 52.9913 42.4044 174.1675 126 P 5.3445 0.0000 0.0000 62.3426 32.7377 175.8903 127 L 4.8052 8.3496 121.3535 53.6314 43.3518 174.8053 128 P 4.2847 0.0000 0.0000 64.4669 30.5224 180.0998 129 V 2.3789 6.5247 113.4192 59.8554 35.0376 178.6666 130 S 3.6691 8.1189 114.6207 58.8807 64.3495 173.4913 131 S 4.5682 8.1832 114.0466 58.3381 66.3092 172.9790 132 D 4.5181 9.0854 118.2351 54.2441 40.8030 175.7063 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 Q 8.34 4.36 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.89 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 2 K 7.74 4.20 0.00 1.73 1.76 0.00 1.84 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.23 1.42 7.81 3 P 0.00 4.58 0.00 2.10 2.00 0.00 3.90 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 4 K 7.62 5.61 0.00 2.13 2.18 0.00 1.89 0.00 0.00 1.97 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.10 7.81 5 L 8.16 4.10 0.00 1.36 1.66 -0.46 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.55 4.75 0.00 1.72 1.22 0.87 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 8.94 5.09 0.00 3.38 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 8 C 6.98 5.36 0.00 2.94 2.51 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 9 S 8.53 4.32 0.00 3.94 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 10 N 8.44 4.71 0.00 2.87 2.79 0.00 0.00 7.10 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 11 G 9.30 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.31 3.28 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 0.00 13 Y 6.71 4.59 0.00 2.78 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 14 F 8.54 5.08 0.00 3.40 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 15 L 8.97 5.39 0.00 1.45 1.57 1.20 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 16 R 8.11 4.73 0.00 1.83 2.22 0.00 3.29 0.00 0.00 3.56 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.01 0.00 17 I 7.99 5.15 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.47 0.95 0.00 0.00 18 F 9.07 4.46 0.00 3.15 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.70 0.00 2.23 2.15 0.00 3.85 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.56 0.00 20 D 8.09 4.67 0.00 2.76 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 21 G 8.44 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 22 K 7.77 4.46 0.00 1.74 1.84 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.46 7.81 23 V 8.23 4.39 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 1.10 0.00 0.00 1.16 0.00 0.00 24 D 8.95 4.53 0.00 2.76 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 25 G 8.46 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 0.00 0.00 0.00 26 T 9.44 4.88 4.41 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 1.48 0.00 0.00 27 R 8.89 3.94 0.00 1.68 1.44 0.00 2.83 0.00 0.00 2.80 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.57 0.00 28 D 7.88 4.77 0.00 2.90 2.71 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 29 R 8.31 3.71 0.00 1.60 1.57 0.00 2.94 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 30 S 8.02 4.12 0.00 3.88 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 31 D 8.01 4.27 0.00 2.98 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 32 P 0.00 4.50 0.00 2.00 2.02 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.88 0.00 33 Y 7.44 5.04 0.00 2.65 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 34 I 7.42 4.58 1.90 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.72 0.94 0.00 0.00 35 Q 7.83 4.23 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.25 0.00 36 L 7.57 4.81 0.00 1.74 1.60 0.99 0.51 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 37 Q 8.27 4.73 0.00 1.93 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.24 0.00 0.00 0.00 0.00 0.00 1.84 2.10 0.00 38 F 9.38 5.36 0.00 2.65 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 39 Y 9.04 4.50 0.00 2.98 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 40 A 8.57 4.99 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 41 E 8.33 4.34 0.00 2.24 1.93 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 2.30 2.31 0.00 42 S 7.63 4.61 0.00 3.84 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 9.14 3.87 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 0.74 0.00 0.00 0.94 0.00 0.00 44 G 9.09 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.15 5.71 0.00 2.03 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 46 V 8.17 4.98 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.52 0.00 0.00 47 Y 9.32 4.99 0.00 2.99 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 48 I 8.46 5.50 1.99 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.10 0.83 0.00 0.00 49 K 8.37 4.93 0.00 1.53 1.31 0.00 1.00 0.00 0.00 1.41 0.00 0.00 2.48 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.17 0.92 7.81 50 S 8.01 4.77 0.00 3.81 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 51 L 8.74 3.69 0.00 1.40 1.06 0.64 0.10 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 52 E 8.22 4.03 0.00 2.11 2.37 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 2.52 2.40 0.00 53 T 7.69 4.00 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 0.89 0.00 0.00 54 G 7.53 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 7.35 4.28 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.33 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 56 Y 7.91 5.15 0.00 2.75 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 57 L 8.53 4.85 0.00 1.69 1.73 1.05 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 58 A 9.05 4.72 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 59 M 9.05 5.09 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.14 0.00 60 D 9.12 4.35 0.00 2.89 2.48 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 0.00 0.00 0.00 0.00 61 S 8.28 4.78 0.00 3.93 3.80 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 62 D 7.06 4.22 0.00 2.46 2.48 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 0.00 0.00 0.00 0.00 63 G 7.02 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 0.00 0.00 0.00 64 Q 7.13 4.44 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.41 0.00 65 L 8.57 5.42 0.00 1.86 1.61 1.12 0.87 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 66 Y 9.36 5.44 0.00 3.05 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 67 A 8.19 4.22 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 68 S 8.40 3.72 0.00 3.86 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 69 Q 8.64 4.44 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.60 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 70 S 7.78 4.73 0.00 3.86 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 71 P 0.00 5.50 0.00 2.22 1.37 0.00 3.51 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.84 0.00 72 S 8.80 3.77 0.00 4.01 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 73 E 8.74 3.83 0.00 2.15 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 0.00 2.35 2.35 0.00 74 E 7.58 3.90 0.00 2.05 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 2.34 2.29 0.00 75 C 7.74 4.29 0.00 2.92 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 76 L 6.89 4.34 0.00 1.71 1.49 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 F 7.81 5.22 0.00 3.15 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 78 L 8.32 5.17 0.00 1.57 1.34 1.13 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 79 E 9.15 4.56 0.00 2.09 1.93 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 2.29 2.55 0.00 80 R 8.37 4.42 0.00 1.77 1.73 0.00 3.14 0.00 0.00 3.11 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 81 L 8.52 4.88 0.00 1.51 1.48 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.41 3.82 0.00 1.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 2.09 0.00 83 E 8.55 3.96 0.00 1.97 1.86 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 2.29 2.28 0.00 84 N 7.19 4.56 0.00 2.63 2.71 0.00 0.00 6.76 7.83 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 85 N 8.50 4.52 0.00 2.82 3.14 0.00 0.00 7.30 7.65 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 86 Y 6.87 5.22 0.00 3.28 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 87 N 9.31 4.81 0.00 1.44 2.08 0.00 0.00 5.19 6.73 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 88 T 8.53 3.21 4.39 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 1.18 0.00 0.00 89 Y 8.63 4.08 0.00 3.02 3.27 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 90 K 7.72 2.00 0.00 1.15 1.44 0.00 1.92 0.00 0.00 1.93 0.00 0.00 2.87 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.14 0.96 7.81 91 S 7.29 4.93 0.00 3.76 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 92 K 8.21 4.38 0.00 1.72 1.84 0.00 1.76 0.00 0.00 2.36 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.41 7.81 93 V 8.18 5.03 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 0.75 0.00 0.00 1.04 0.00 0.00 94 H 8.00 4.25 0.00 3.20 3.33 0.00 5.94 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.66 4.10 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 96 D 8.84 4.16 0.00 2.81 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 97 K 5.66 4.95 0.00 2.06 2.51 0.00 1.53 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.34 1.24 7.81 98 D 8.28 4.17 0.00 2.75 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 0.00 0.00 0.00 99 W 7.90 5.41 0.00 3.31 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 7.97 4.88 0.00 3.10 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 0.00 101 V 8.40 4.14 2.15 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 -0.04 0.00 0.00 1.07 0.00 0.00 102 G 8.45 5.09 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 0.00 103 I 8.93 4.96 1.86 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 1.35 1.22 0.55 0.00 0.00 104 K 8.26 3.95 0.00 1.82 1.67 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.18 1.17 7.81 105 K 8.53 4.25 0.00 1.70 2.07 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.21 1.20 7.81 106 N 7.41 3.55 0.00 2.76 2.71 0.00 0.00 6.07 6.99 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 0.00 107 G 7.27 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 9.67 4.28 0.00 1.99 2.12 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.14 1.11 7.81 109 T 7.51 3.29 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 110 K 8.82 4.40 0.00 1.91 1.76 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.53 7.81 111 P 0.00 4.41 0.00 2.33 2.33 0.00 3.89 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 2.14 2.02 0.00 112 G 9.09 4.41 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 0.00 113 S 7.62 4.17 0.00 3.85 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 0.00 114 R 7.16 4.30 0.00 1.64 1.65 0.00 3.14 0.00 0.00 3.07 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.41 0.00 115 T 7.82 4.22 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 116 H 8.31 4.63 0.00 2.90 2.76 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 F 6.18 3.40 0.00 3.04 2.98 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 0.00 118 G 9.09 4.08 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 0.00 0.00 0.00 119 Q 7.95 4.01 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 120 K 8.59 3.95 0.00 1.80 1.99 0.00 1.88 0.00 0.00 1.89 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 121 A 7.85 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 0.00 122 I 6.87 3.88 1.83 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.94 0.81 0.00 0.00 123 L 8.09 4.05 0.00 1.91 2.08 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 124 F 9.43 5.59 0.00 3.47 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 L 9.28 5.20 0.00 2.04 2.00 0.62 0.88 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 0.00 126 P 0.00 5.34 0.00 2.36 2.44 0.00 4.14 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 127 L 8.35 4.81 0.00 1.76 1.79 0.43 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 4.28 0.00 2.20 2.21 0.00 3.79 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 129 V 6.52 2.38 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.62 0.00 0.00 130 S 8.12 3.67 0.00 3.97 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 0.00 131 S 8.18 4.57 0.00 3.78 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 0.00 132 D 9.09 4.52 0.00 2.68 2.53 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