NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3123 8.1233 122.4540 52.1332 20.6218 175.1783 2 T 4.7446 8.2127 115.6039 61.6969 71.0278 172.3232 3 H 4.8530 9.2161 121.7326 53.8982 33.4043 171.5882 4 E 4.8602 8.7186 122.7865 54.2848 31.9309 174.9548 5 V 4.5074 8.6041 126.6145 61.4548 34.6594 173.8460 6 H 5.4202 9.3795 125.3429 55.0621 31.0948 174.0991 7 M 4.7101 8.9728 122.2963 53.9841 33.4469 175.1856 8 L 5.0495 8.4955 123.6271 52.9427 45.7839 177.7419 9 N 4.4058 9.4485 119.6420 55.6232 39.8845 175.4851 10 K 4.7736 7.9644 119.0671 54.8441 34.4903 174.7527 11 G 4.4369 8.8315 118.0675 43.8484 0.0000 172.6683 12 E 3.8215 9.1344 118.5529 58.2251 29.5113 177.9447 13 S 4.6579 8.4864 111.2027 56.9564 65.1319 174.1963 14 G 3.8216 6.5565 106.6893 46.1469 0.0000 171.0390 15 A 4.9116 8.2556 121.7934 51.6836 21.0256 176.8367 16 M 3.2376 8.7869 118.3330 56.2131 29.5640 176.3065 17 V 4.6546 8.2935 113.0150 59.3529 37.0272 174.5140 18 F 4.9385 8.8286 121.5327 56.5636 40.5799 175.1113 19 E 4.7869 9.7836 124.3577 53.6921 32.4741 172.9807 20 P 4.8288 0.0000 0.0000 63.0488 32.1412 176.3443 21 A 4.5628 8.8942 122.0631 53.1432 20.1345 176.5096 22 F 5.8100 8.1207 117.0636 55.1534 42.3126 174.1416 23 V 4.0462 7.5330 124.8107 60.8560 34.7559 173.8212 24 R 4.5405 8.3561 128.0426 54.9733 30.9203 174.5971 25 A 4.8256 8.5279 128.2284 50.0249 22.9976 173.9460 26 E 4.9489 9.2373 119.1455 53.4715 33.2301 173.7035 27 P 4.5126 0.0000 0.0000 64.3584 31.8003 177.1469 28 G 3.9348 9.3514 111.1268 45.1300 0.0000 173.3481 29 D 4.7614 7.7386 119.3994 53.9073 42.6229 175.3264 30 V 4.6873 8.5342 120.9542 61.1950 34.3807 174.3752 31 I 4.5988 8.9638 129.0330 59.5974 39.8655 174.0918 32 N 5.1332 9.1959 125.9211 51.6469 40.6751 174.1861 33 F 5.0885 9.5090 124.1593 56.3491 40.7332 175.0684 34 V 4.6906 9.0771 125.7241 60.4774 33.5002 173.1530 35 P 4.8938 0.0000 0.0000 62.5607 30.1004 175.9333 36 T 4.1422 8.5939 124.2866 65.9614 69.1155 174.3907 37 D 5.0424 7.8672 118.9530 52.1017 43.9925 175.8148 38 K 4.3717 8.2693 120.6469 56.6327 33.0793 177.5318 39 S 4.4051 10.0665 115.5999 58.1222 62.1876 168.3350 40 H 5.1891 7.6932 117.6926 54.6234 31.9782 172.6405 41 N 5.5781 8.3067 116.6496 51.9794 41.4361 172.9566 42 V 4.8412 8.5918 117.3813 60.0659 34.6712 174.3710 43 E 4.7827 9.2366 124.4871 53.9116 33.3300 174.3210 44 A 3.8895 7.3307 127.7375 51.8223 19.3888 177.7514 45 I 3.8296 8.3312 122.9210 59.6813 37.0876 176.6765 46 K 3.6984 8.7018 127.9231 59.5782 32.0932 178.6297 47 E 4.1001 8.1232 116.6732 58.4348 30.1059 177.1341 48 I 4.5038 7.8354 121.1551 59.1399 36.1683 174.3999 49 L 4.7536 7.4384 121.6777 52.0975 46.1810 174.9459 50 P 4.3574 0.0000 0.0000 61.9114 32.8640 175.5216 51 E 3.8421 8.5074 122.9368 57.8918 29.8769 177.3759 52 G 3.9680 9.0564 114.1142 45.2480 0.0000 173.0795 53 V 4.3629 7.0125 113.3398 59.3387 33.1411 175.9342 54 E 4.1977 8.6275 124.0713 55.9984 30.1059 176.9110 55 S 4.3402 8.4207 116.7953 58.3662 63.3969 173.0322 56 F 5.1107 7.5247 118.4359 55.4103 41.7228 173.5285 57 K 4.6784 8.3795 121.1935 55.6266 34.4801 175.4810 58 S 4.6510 8.3628 122.9518 57.0045 65.0870 174.0757 59 K 4.3519 8.3793 119.2852 55.2877 32.9725 176.9613 60 I 3.9885 8.0425 122.1585 63.0450 37.4648 176.1540 61 N 4.3597 8.9271 120.0263 53.8296 36.6975 173.8267 62 E 4.8748 7.7056 116.8781 54.6414 32.0729 176.1285 63 S 4.8649 8.6041 117.6000 58.7415 64.4932 173.1278 64 Y 4.8278 8.9949 122.5100 56.4469 42.4423 173.7715 65 T 4.7512 7.7444 122.7252 61.7106 70.6777 173.2215 66 L 4.2553 8.8316 129.9568 53.5261 44.1333 175.1370 67 T 4.6168 8.2606 123.6262 62.2537 69.8213 174.7396 68 V 3.9017 8.3613 121.5748 60.9321 32.3187 176.7590 69 T 4.1673 8.7070 121.7520 65.1826 69.8942 175.4065 70 E 4.2679 8.0871 119.6573 55.2110 30.2285 175.0811 71 P 4.5728 0.0000 0.0000 62.8538 32.5403 174.7993 72 G 3.8759 8.0848 105.2581 43.7097 0.0000 172.2782 73 L 5.1209 8.7478 120.3386 53.8032 43.1554 176.4333 74 Y 4.7691 9.6381 121.3697 56.2956 40.6197 174.8059 75 G 4.4311 9.2281 112.8543 44.9044 0.0000 172.8382 76 V 4.9898 9.0438 117.3771 59.2917 36.1325 174.6123 77 K 5.1469 8.9114 121.1180 55.8037 36.9998 174.5357 78 C 5.1086 8.7317 121.2238 57.6606 32.3191 174.1612 79 T 3.8264 8.7454 124.6048 66.4174 68.1201 174.1137 80 P 4.3816 0.0000 0.0000 64.8573 31.8824 176.4919 81 H 5.0192 8.1545 115.8480 55.4946 29.6841 175.3814 82 F 4.5090 8.7239 124.6339 61.5417 39.2405 177.6187 83 G 3.6495 8.2612 107.5545 48.6892 0.0000 173.7705 84 M 4.2376 7.9799 116.7739 55.2835 32.0951 176.7710 85 G 3.9385 8.5216 107.5624 45.8178 0.0000 174.9165 86 M 4.6910 7.9583 121.8284 53.7445 30.4232 175.2507 87 V 5.2643 8.1713 114.5702 59.1690 36.1178 174.7549 88 G 4.3136 9.3248 108.7030 44.6954 0.0000 171.2220 89 L 5.3991 9.3668 122.3650 53.0416 45.9351 175.2016 90 V 4.5590 9.1545 125.9780 61.0386 34.5539 173.7003 91 Q 4.8441 8.7546 129.8465 54.5720 30.9632 174.3721 92 V 4.4719 8.9276 128.5988 62.7254 32.8220 176.7258 93 G 4.2354 8.7215 115.4494 45.0289 0.0000 171.6754 94 D 4.5155 8.3871 118.2138 53.6547 41.9192 177.2886 95 A 3.8385 8.3858 117.4364 52.5224 14.9273 173.5142 96 P 4.3149 0.0000 0.0000 62.0813 32.2451 177.6753 97 E 4.0093 8.9542 124.6931 58.5577 30.0310 176.7103 98 N 4.8916 7.9229 115.0196 52.5008 38.1081 176.3331 99 L 3.9647 7.6282 122.8325 59.4034 41.8602 178.4789 100 D 4.4597 8.0916 117.5149 56.6276 40.8103 178.4306 101 A 3.9935 7.9723 121.7876 54.9737 18.2037 179.4792 102 A 3.9742 7.8894 117.8410 55.3087 18.6194 179.6193 103 K 4.1502 8.0414 116.2822 58.5542 32.2365 178.0246 104 T 4.4000 7.4435 106.0265 60.6611 69.8576 174.3705 105 A 3.9423 7.9661 126.2095 52.5455 18.7060 177.2025 106 K 4.1610 8.6146 124.9833 56.3447 32.8675 175.7437 107 M 4.6315 8.1899 121.6259 52.2074 33.8999 172.9001 108 P 4.0991 0.0000 0.0000 62.5911 32.8839 177.2094 109 K 3.7876 8.6957 122.2268 60.6086 32.1794 179.3295 110 K 3.9137 7.9578 118.9708 58.8124 31.9874 179.0997 111 A 4.0338 7.7362 120.6737 55.0888 18.3459 179.5110 112 R 3.9178 8.1462 117.4171 59.5618 29.9998 178.6640 113 E 4.0048 8.3929 118.7579 59.4192 29.4617 179.5211 114 R 4.0173 8.1423 118.2300 59.1832 30.1412 178.6438 115 M 4.1244 8.5837 118.6099 58.7827 31.9052 178.0265 116 D 4.3810 8.2303 118.8837 57.2965 40.7441 178.6380 117 A 4.0042 7.6007 120.5480 55.2290 18.6879 179.2791 118 E 4.0512 8.3022 117.1366 59.4031 29.5594 179.5003 119 L 4.0359 8.3897 119.1747 57.2920 41.4294 178.8178 120 A 4.1530 7.4844 118.9072 53.6702 18.4065 178.3253 121 Q 4.0661 7.2415 115.1119 54.4625 29.4578 176.0387 122 V 3.8298 6.7134 121.4074 63.7712 32.2290 175.5659 123 N 4.7340 8.9831 123.5203 53.8464 38.7870 174.0792 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 A 8.12 4.31 1.16 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 0.00 0.00 2 T 8.21 4.74 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 1.14 0.00 0.00 3 H 9.22 4.85 0.00 2.81 2.98 0.00 5.57 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 4 E 8.72 4.86 0.00 1.84 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.16 0.00 5 V 8.60 4.51 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.65 0.00 0.00 6 H 9.38 5.42 0.00 3.23 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 8.97 4.71 0.00 1.84 2.04 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 8 L 8.50 5.05 0.00 1.50 1.48 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 9 N 9.45 4.41 0.00 2.73 2.85 0.00 0.00 6.50 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 10 K 7.96 4.77 0.00 1.62 1.63 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.48 7.81 11 G 8.83 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.13 3.82 0.00 1.98 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 0.00 2.51 2.41 0.00 13 S 8.49 4.66 0.00 3.98 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 14 G 6.56 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 0.00 0.00 0.00 15 A 8.26 4.91 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 16 M 8.79 3.24 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 17 V 8.29 4.65 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 0.81 0.00 0.00 0.94 0.00 0.00 18 F 8.83 4.94 0.00 3.08 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 19 E 9.78 4.79 0.00 2.01 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 2.26 2.30 0.00 20 P 0.00 4.83 0.00 2.36 2.09 0.00 3.94 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 1.98 1.97 0.00 21 A 8.89 4.56 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 22 F 8.12 5.81 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 23 V 7.53 4.05 1.79 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 0.64 0.00 0.00 0.77 0.00 0.00 24 R 8.36 4.54 0.00 1.75 1.77 0.00 3.47 0.00 0.00 3.33 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 25 A 8.53 4.83 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.24 4.95 0.00 2.11 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 27 P 0.00 4.51 0.00 2.08 2.23 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 28 G 9.35 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 7.74 4.76 0.00 2.72 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 30 V 8.53 4.69 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 0.94 0.00 0.00 0.85 0.00 0.00 31 I 8.96 4.60 1.62 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.52 0.15 0.00 0.00 32 N 9.20 5.13 0.00 2.50 2.66 0.00 0.00 6.51 8.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 9.51 5.09 0.00 3.15 3.21 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 34 V 9.08 4.69 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 1.15 0.00 0.00 1.01 0.00 0.00 35 P 0.00 4.89 0.00 2.19 2.18 0.00 3.91 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 36 T 8.59 4.14 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 1.17 0.00 0.00 37 D 7.87 5.04 0.00 2.67 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 38 K 8.27 4.37 0.00 1.74 1.85 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.43 7.81 39 S 10.07 4.41 0.00 3.95 4.30 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 0.00 0.00 0.00 40 H 7.69 5.19 0.00 3.08 3.14 0.00 5.61 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.31 5.58 0.00 2.84 2.89 0.00 0.00 5.47 7.68 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 42 V 8.59 4.84 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.10 0.00 0.00 43 E 9.24 4.78 0.00 1.75 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.10 0.00 44 A 7.33 3.89 0.25 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 45 I 8.33 3.83 1.79 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 0.91 0.61 0.89 0.00 0.00 46 K 8.70 3.70 0.00 1.67 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.36 7.81 47 E 8.12 4.10 0.00 1.94 2.01 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 2.32 2.38 0.00 48 I 7.84 4.50 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.75 1.00 0.00 0.00 49 L 7.44 4.75 0.00 1.37 1.37 0.95 1.15 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 50 P 0.00 4.36 0.00 1.85 2.03 0.00 2.78 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.69 0.00 51 E 8.51 3.84 0.00 1.88 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 2.28 2.36 0.00 52 G 9.06 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 0.00 0.00 0.00 53 V 7.01 4.36 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 0.67 0.00 0.00 1.09 0.00 0.00 54 E 8.63 4.20 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 55 S 8.42 4.34 0.00 3.75 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 7.52 5.11 0.00 2.94 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 57 K 8.38 4.68 0.00 1.60 1.61 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.73 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 1.31 7.81 58 S 8.36 4.65 0.00 3.98 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.38 4.35 0.00 2.02 1.77 0.00 1.92 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.48 7.81 60 I 8.04 3.99 1.87 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 1.39 0.45 0.87 0.00 0.00 61 N 8.93 4.36 0.00 2.90 2.98 0.00 0.00 6.85 7.26 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 62 E 7.71 4.87 0.00 2.13 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 0.00 2.30 2.30 0.00 63 S 8.60 4.86 0.00 3.82 3.85 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 64 Y 8.99 4.83 0.00 3.16 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 65 T 7.74 4.75 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 1.05 0.00 0.00 66 L 8.83 4.26 0.00 1.71 1.64 0.34 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.26 4.62 4.16 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 1.15 0.00 0.00 68 V 8.36 3.90 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 -0.08 0.00 0.00 0.79 0.00 0.00 69 T 8.71 4.17 4.29 0.00 0.00 0.00 0.00 0.00 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 70 E 8.09 4.27 0.00 2.03 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 0.00 2.38 2.27 0.00 71 P 0.00 4.57 0.00 2.21 2.09 0.00 3.78 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 2.01 1.98 0.00 72 G 8.08 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 73 L 8.75 5.12 0.00 1.63 1.69 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.64 4.77 0.00 2.85 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 75 G 9.23 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 9.04 4.99 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 0.78 0.00 0.00 0.34 0.00 0.00 77 K 8.91 5.15 0.00 1.44 1.48 0.00 0.61 0.00 0.00 0.66 0.00 0.00 2.42 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.15 1.03 7.81 78 C 8.73 5.11 0.00 2.94 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.75 3.83 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 1.15 0.00 0.00 80 P 0.00 4.38 0.00 1.94 2.08 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 81 H 8.15 5.02 0.00 3.25 3.32 0.00 5.65 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.72 4.51 0.00 2.94 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 83 G 8.26 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 84 M 7.98 4.24 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.54 0.00 85 G 8.52 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 86 M 7.96 4.69 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.93 0.00 87 V 8.17 5.26 2.25 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 1.13 0.00 0.00 1.12 0.00 0.00 88 G 9.32 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 89 L 9.37 5.40 0.00 1.95 1.73 1.11 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 90 V 9.15 4.56 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 0.64 0.00 0.00 0.93 0.00 0.00 91 Q 8.75 4.84 0.00 2.33 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 92 V 8.93 4.47 2.38 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 0.97 0.00 0.00 0.84 0.00 0.00 93 G 8.72 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 0.00 0.00 0.00 0.00 94 D 8.39 4.52 0.00 2.70 2.64 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 0.00 0.00 0.00 0.00 95 A 8.39 3.84 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 96 P 0.00 4.31 0.00 2.23 2.06 0.00 3.64 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.15 0.00 97 E 8.95 4.01 0.00 1.93 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 2.29 2.30 0.00 98 N 7.92 4.89 0.00 2.88 2.97 0.00 0.00 5.90 6.67 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 99 L 7.63 3.96 0.00 1.94 1.74 0.95 1.26 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 0.00 100 D 8.09 4.46 0.00 2.81 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 0.00 101 A 7.97 3.99 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 0.00 102 A 7.89 3.97 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.04 4.15 0.00 1.91 1.89 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.66 7.81 104 T 7.44 4.40 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 1.23 0.00 0.00 105 A 7.97 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.61 4.16 0.00 1.74 1.75 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.37 7.81 107 M 8.19 4.63 0.00 2.27 1.81 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.79 0.00 108 P 0.00 4.10 0.00 1.69 1.79 0.00 2.44 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 1.16 1.85 0.00 109 K 8.70 3.79 0.00 1.94 2.06 0.00 1.48 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.53 7.81 110 K 7.96 3.91 0.00 1.92 1.89 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.47 7.81 111 A 7.74 4.03 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 0.00 112 R 8.15 3.92 0.00 1.89 2.08 0.00 3.26 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 113 E 8.39 4.00 0.00 2.21 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 2.53 0.00 114 R 8.14 4.02 0.00 1.94 2.05 0.00 3.46 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 115 M 8.58 4.12 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.70 0.00 116 D 8.23 4.38 0.00 2.93 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 0.00 117 A 7.60 4.00 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 0.00 118 E 8.30 4.05 0.00 2.29 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 2.46 2.53 0.00 119 L 8.39 4.04 0.00 1.80 1.71 1.00 0.82 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 0.00 120 A 7.48 4.15 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 0.00 121 Q 7.24 4.07 0.00 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.77 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 122 V 6.71 3.83 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 0.81 0.00 0.00 1.02 0.00 0.00 123 N 8.98 4.73 0.00 2.98 2.88 0.00 0.00 6.87 7.60 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