NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1A H 4.6323 8.4444 117.8313 56.1270 29.5890 171.7520 1B H 4.6175 8.8919 124.4435 55.1134 31.8371 172.0996 1C H 5.1153 9.1073 123.8912 54.5576 32.8248 172.7407 1D H 4.7296 8.7269 116.6368 56.2267 29.9462 174.3246 1E H 5.1274 7.7987 114.8471 53.4365 32.4220 172.1638 1F H 4.6731 8.8161 116.7418 55.8834 29.0652 174.3435 1 F 4.8061 8.3842 119.4965 57.7978 39.7144 174.4891 2 N 4.6742 8.5229 118.2384 52.0176 38.4709 174.7187 3 L 4.5595 8.0391 123.8157 52.7537 43.1384 175.0534 4 P 4.5769 0.0000 0.0000 61.0515 32.5738 174.0242 5 P 4.3961 0.0000 0.0000 62.0752 32.3859 175.9436 6 G 3.9314 8.5526 105.6305 45.1928 0.0000 173.0952 7 N 4.5398 8.0376 118.2808 51.1363 39.8647 174.3948 8 Y 4.9159 8.0398 115.2443 58.0664 39.1011 176.6773 9 K 4.0757 8.5084 121.6786 59.0611 32.2404 177.3802 10 K 4.6826 7.6251 115.4506 53.3880 34.4948 174.2114 11 P 4.5525 0.0000 0.0000 63.3445 32.1915 175.4297 12 K 4.9527 9.4424 121.4532 54.6843 36.2826 174.5165 13 L 4.9599 8.9389 119.8830 53.4981 45.6370 176.1703 14 L 4.9857 8.8373 124.3857 53.9043 42.7147 174.9300 15 Y 4.9205 9.2078 127.2596 55.8823 40.7979 174.1409 16 C 3.7764 8.7926 129.3042 58.4325 32.0203 174.2575 17 S 3.7727 8.0588 121.7407 60.2761 62.6188 175.0771 18 N 4.0666 8.0101 119.3835 55.9062 38.8644 175.1230 19 G 3.9332 6.9590 103.7516 43.7048 0.0000 172.3285 20 G 3.2511 7.5340 106.1019 44.8005 0.0000 173.3121 21 H 4.8935 7.1237 114.1132 53.6231 33.5524 174.1898 22 F 5.2936 8.7952 119.9345 55.6427 40.7690 175.2944 23 L 4.4584 9.1360 126.7967 56.0542 43.1013 175.8170 24 R 4.8517 9.8647 126.3868 54.7130 33.7446 173.9390 25 I 4.7753 8.2774 127.0940 59.2716 38.1919 175.6605 26 L 4.0526 8.9492 128.0142 53.5787 42.2293 177.0109 27 P 4.2014 0.0000 0.0000 65.7920 31.2876 177.2327 28 D 4.5141 7.9800 114.6165 53.6713 39.8919 177.0294 29 G 4.0417 8.5114 110.1170 45.5560 0.0000 173.6754 30 T 4.3788 7.7128 117.4933 63.1958 69.1674 173.3886 31 V 4.8324 8.0949 125.8278 61.2707 33.6827 174.3051 32 D 4.6100 8.8856 125.3572 52.9603 42.6615 173.9090 33 G 4.5578 8.5039 104.9381 45.2898 0.0000 172.7491 34 T 4.9780 8.6624 115.9169 60.6152 70.8727 174.7310 35 R 4.2322 8.9279 125.7897 57.2644 31.0898 176.1847 36 D 4.5734 8.2243 118.8740 53.7034 40.3494 176.8574 37 R 3.7891 8.5241 127.0278 58.5742 30.2957 178.3205 38 S 4.2540 7.9902 111.0833 59.2122 63.4117 174.2014 39 D 4.4279 7.5718 120.9290 55.1019 41.2685 175.9527 40 Q 4.4445 8.4930 122.0052 56.5174 29.6078 175.8946 41 H 4.8375 9.9405 116.3551 55.4577 29.1043 175.4606 42 I 4.6175 7.4134 111.7098 60.2810 38.6692 175.4889 43 Q 4.2441 7.7766 122.0880 55.7568 29.7621 174.8494 44 L 5.1624 8.9449 123.8622 52.8591 45.8632 175.1334 45 Q 4.7898 9.2625 124.7522 54.4636 30.9860 173.9797 46 L 5.8451 8.8680 126.3141 52.5482 43.8087 175.9972 47 S 4.7416 8.4806 116.2390 56.5034 66.6153 172.5911 48 A 4.4531 8.4430 123.1334 51.8365 20.3613 175.0609 49 E 4.0234 9.0761 121.0453 55.9587 29.8832 178.2694 50 S 4.7453 6.5129 114.9321 56.1196 66.3319 173.4576 51 V 3.9049 8.2182 121.1313 65.1524 31.3121 176.1914 52 G 3.9608 9.3184 116.1325 44.8769 0.0000 171.7108 53 E 5.1434 8.1372 119.8929 54.8422 31.8985 175.6349 54 V 4.8938 8.9854 116.3942 59.8299 36.8092 173.8382 55 Y 5.1796 9.0120 119.0092 56.4039 41.6959 175.4100 56 I 4.7990 8.6937 122.6037 59.6653 40.4126 173.9829 57 K 4.6299 8.7178 129.1771 53.9974 35.0768 175.1286 58 S 4.5733 8.4413 122.6417 58.4802 62.6113 174.9741 59 T 3.6707 8.4495 118.6672 64.7811 68.7683 175.5117 60 E 4.0194 8.3402 122.9864 58.9567 30.3226 177.6483 61 T 3.9426 7.6989 109.6751 63.0566 69.4139 175.8554 62 G 3.8269 8.3032 108.7233 44.4517 0.0000 172.6230 63 Q 4.6257 7.6175 117.9518 55.0895 30.7864 174.8068 64 Y 4.8839 9.1609 119.9743 57.1726 40.1056 174.7002 65 L 4.6111 9.0718 125.3372 55.3532 43.5283 175.5919 66 A 5.1240 8.5029 125.3922 50.9003 23.3301 174.4383 67 M 5.4370 8.6176 119.3272 53.8573 34.7984 175.7049 68 D 5.2643 9.3167 126.9094 52.7851 41.0587 176.7715 69 T 4.3119 8.5291 107.6450 63.4487 68.6919 174.3840 70 D 4.6903 8.7039 121.5748 54.0595 41.6484 177.1848 71 G 3.2716 8.3102 108.3842 44.9662 0.0000 172.7617 72 L 4.8418 7.6627 119.3754 53.1725 43.7068 175.8762 73 L 5.2107 8.5108 122.7863 54.9639 43.2213 175.3621 74 Y 4.9561 8.9312 119.5126 55.9780 42.0890 173.7037 75 G 4.1057 8.8813 108.3965 45.8011 0.0000 173.1167 76 S 4.9954 9.0958 121.9446 56.3822 64.1002 175.2089 77 Q 4.2086 9.1633 126.1738 58.3296 28.8510 176.8210 78 T 4.5842 7.5771 105.6408 58.8762 71.4287 172.4578 79 P 3.8969 0.0000 0.0000 61.4189 30.0680 174.6238 80 N 4.9884 7.8613 124.3324 50.6454 40.0651 175.4502 81 E 3.6588 8.7328 115.3915 59.1098 29.4199 177.5652 82 E 4.2505 8.7920 118.3493 56.9988 29.9335 177.0330 83 C 4.9424 8.2106 115.7565 59.0755 29.5916 173.8259 84 L 3.9855 7.3451 121.1380 54.2940 42.3532 176.0375 85 F 5.2680 8.8571 121.7980 55.6194 43.5363 174.2175 86 L 4.9834 8.9551 121.7156 53.3734 43.1383 175.4114 87 E 4.3681 9.0215 127.1090 55.3040 30.2453 175.7314 88 R 4.7927 8.3254 125.1697 54.1569 34.9024 174.3556 89 L 4.8509 9.0742 123.7256 54.7846 43.3712 175.6801 90 E 4.6855 8.7685 125.0161 54.9941 33.3102 175.2654 91 E 3.8688 9.6740 125.5202 58.3447 27.7149 174.1428 92 N 4.2707 8.4800 109.9802 54.0053 36.2715 174.5537 93 H 4.7823 7.9335 116.0476 57.6358 37.9942 173.7516 94 Y 4.6036 7.7614 115.5343 58.1235 39.8644 173.5237 95 N 5.6506 9.6367 118.2403 51.9108 41.4763 174.4835 96 T 5.3622 8.5061 112.1259 59.0368 73.1180 172.4585 97 Y 4.9123 8.5389 118.8010 56.5506 41.7218 174.1733 98 I 4.6603 8.5235 125.7395 59.0601 39.4639 175.1662 99 S 4.2862 9.1551 122.3962 58.7479 62.8926 174.7795 100 K 3.8529 8.6702 129.3823 59.4581 32.3283 178.6119 101 K 3.7752 8.0120 117.6380 59.1653 32.2086 177.6996 102 H 4.6641 7.9214 115.2946 55.0316 30.0289 176.9535 103 A 4.0110 7.5557 125.9996 54.7122 18.0978 179.7591 104 E 3.6839 7.9594 115.6384 58.6343 29.6731 177.5499 105 K 3.9323 7.5714 115.9928 55.7999 32.7749 175.8351 106 N 3.9218 7.8998 115.8516 54.0484 36.2358 174.6428 107 W 5.1415 7.6558 117.7669 55.5387 31.3717 177.3301 108 F 5.3839 9.1947 123.4924 55.4979 41.6731 175.3162 109 V 4.0139 8.9134 120.8494 62.7571 32.4567 175.1254 110 G 4.8324 8.4214 112.5988 45.2528 0.0000 171.6421 111 L 5.3326 8.1012 119.6355 52.4634 46.1967 176.9772 112 K 4.2525 9.0274 122.5621 55.4984 33.1164 178.1562 113 K 3.9984 8.4069 120.4772 58.7210 32.1235 177.4835 114 N 4.6228 7.9573 114.0901 53.2113 38.1203 175.8461 115 G 3.5831 8.0664 108.9540 44.7146 0.0000 173.3103 116 S 4.8330 7.6655 115.1948 57.0077 64.9223 174.2165 117 V 4.0419 8.3716 121.7497 63.3214 32.2496 174.9655 118 K 4.5732 8.6288 128.7333 54.1481 33.5492 176.1670 119 R 4.0630 8.7833 124.9865 56.2794 30.3195 177.9360 120 G 3.6108 8.7945 112.1464 48.1792 0.0000 174.2343 121 P 4.3311 0.0000 0.0000 64.3869 31.3360 177.2813 122 R 4.3806 8.3324 116.1942 56.1612 30.6016 176.1714 123 T 5.2782 7.6942 108.1803 59.3685 71.0129 173.4531 124 H 4.7327 7.8459 117.0971 55.1919 30.0001 173.4054 125 Y 4.0624 8.7020 118.2026 60.0574 37.9917 177.0264 126 G 4.1160 9.0401 111.8588 45.5963 0.0000 173.9189 127 Q 4.2407 7.5189 118.6409 54.9710 29.9189 177.2315 128 K 3.6576 8.3032 119.4471 58.8451 32.7135 179.4411 129 A 3.9908 8.0538 121.2233 53.7956 18.2081 178.6151 130 I 4.5689 6.8965 107.1750 60.7458 38.6692 175.2495 131 L 4.4016 7.3199 122.8899 54.5298 42.3325 176.1199 132 F 5.3444 9.7462 122.4395 55.5718 43.7561 173.8932 133 L 5.1661 9.2018 120.0867 53.3189 44.5896 175.4064 134 C 5.0212 9.0320 124.8659 58.4037 32.0863 172.3586 135 L 4.8605 8.8219 126.9199 52.1637 44.3138 177.1257 136 P 4.6627 0.0000 0.0000 62.4407 31.3213 177.0854 137 V 3.9851 8.1060 114.7728 62.9116 32.5354 174.2310 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 1A H 8.44 4.63 0.00 3.13 3.24 0.00 5.81 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1B H 8.89 4.62 0.00 3.14 3.11 0.00 5.67 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 1C H 9.11 5.12 0.00 3.05 3.24 0.00 5.74 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.73 4.73 0.00 3.12 3.23 0.00 5.64 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.80 5.13 0.00 3.18 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.82 4.67 0.00 3.33 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 F 8.38 4.81 0.00 2.96 3.09 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 2 N 8.52 4.67 0.00 2.90 2.79 0.00 0.00 6.96 6.74 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 3 L 8.04 4.56 0.00 1.49 1.43 0.61 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.58 0.00 2.23 2.02 0.00 3.68 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 1.94 1.90 0.00 5 P 0.00 4.40 0.00 2.16 2.09 0.00 3.70 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 1.95 1.93 0.00 6 G 8.55 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 7 N 8.04 4.54 0.00 2.69 2.73 0.00 0.00 5.88 7.55 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 8 Y 8.04 4.92 0.00 3.02 3.23 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 9 K 8.51 4.08 0.00 1.90 1.91 0.00 1.59 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.51 7.81 10 K 7.63 4.68 0.00 1.74 1.72 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.40 7.81 11 P 0.00 4.55 0.00 2.06 2.05 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 12 K 9.44 4.95 0.00 1.68 1.93 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.64 7.81 13 L 8.94 4.96 0.00 1.75 1.75 0.59 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.84 4.99 0.00 1.56 1.45 0.29 0.71 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 15 Y 9.21 4.92 0.00 3.01 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 16 C 8.79 3.78 0.00 2.26 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 0.00 0.00 0.00 17 S 8.06 3.77 0.00 3.84 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 18 N 8.01 4.07 0.00 2.50 2.59 0.00 0.00 6.77 7.98 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 19 G 6.96 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 20 G 7.53 3.25 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 0.00 21 H 7.12 4.89 0.00 2.99 3.15 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.80 5.29 0.00 3.25 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 23 L 9.14 4.46 0.00 1.85 1.59 0.93 0.28 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 24 R 9.86 4.85 0.00 1.90 2.02 0.00 3.13 0.00 0.00 3.47 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 25 I 8.28 4.78 1.86 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 1.21 0.76 0.91 0.00 0.00 26 L 8.95 4.05 0.00 1.80 1.60 0.91 0.75 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 27 P 0.00 4.20 0.00 2.02 2.14 0.00 3.55 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 28 D 7.98 4.51 0.00 2.79 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 29 G 8.51 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 30 T 7.71 4.38 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 1.22 0.00 0.00 31 V 8.09 4.83 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.01 0.00 0.00 32 D 8.89 4.61 0.00 2.67 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 33 G 8.50 4.56 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 0.00 0.00 0.00 34 T 8.66 4.98 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 1.39 0.00 0.00 35 R 8.93 4.23 0.00 1.90 2.02 0.00 3.23 0.00 0.00 3.09 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 36 D 8.22 4.57 0.00 2.83 2.65 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 37 R 8.52 3.79 0.00 1.82 1.85 0.00 3.06 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.66 0.00 38 S 7.99 4.25 0.00 3.99 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 39 D 7.57 4.43 0.00 2.85 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.49 4.44 0.00 1.86 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.01 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 41 H 9.94 4.84 0.00 3.12 3.49 0.00 5.79 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 42 I 7.41 4.62 1.91 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.37 1.04 0.00 0.00 43 Q 7.78 4.24 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 44 L 8.94 5.16 0.00 1.50 1.43 0.85 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.26 4.79 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 46 L 8.87 5.85 0.00 1.69 1.40 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.48 4.74 0.00 3.90 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 48 A 8.44 4.45 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 49 E 9.08 4.02 0.00 1.66 1.75 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 2.17 2.35 0.00 50 S 6.51 4.75 0.00 4.04 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 51 V 8.22 3.90 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 0.98 0.00 0.00 1.04 0.00 0.00 52 G 9.32 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 0.00 0.00 0.00 53 E 8.14 5.14 0.00 1.84 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 2.23 2.39 0.00 54 V 8.99 4.89 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.16 0.00 0.00 55 Y 9.01 5.18 0.00 3.01 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 56 I 8.69 4.80 1.84 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.76 0.74 0.00 0.00 57 K 8.72 4.63 0.00 0.97 1.32 0.00 1.29 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.95 0.62 7.81 58 S 8.44 4.57 0.00 3.91 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 59 T 8.45 3.67 4.19 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 1.16 0.00 0.00 60 E 8.34 4.02 0.00 2.00 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 2.09 2.30 0.00 61 T 7.70 3.94 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 1.26 0.00 0.00 62 G 8.30 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 0.00 0.00 0.00 63 Q 7.62 4.63 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.86 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 64 Y 9.16 4.88 0.00 2.89 2.97 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 65 L 9.07 4.61 0.00 1.72 1.65 0.87 0.66 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 66 A 8.50 5.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.62 5.44 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 68 D 9.32 5.26 0.00 2.96 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 69 T 8.53 4.31 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 1.33 0.00 0.00 70 D 8.70 4.69 0.00 2.80 2.65 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 71 G 8.31 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 0.00 0.00 0.00 72 L 7.66 4.84 0.00 2.00 1.61 0.86 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.51 5.21 0.00 1.58 1.64 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.93 4.96 0.00 2.99 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 75 G 8.88 4.11 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 0.00 0.00 0.00 76 S 9.10 5.00 0.00 3.56 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 77 Q 9.16 4.21 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.53 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 78 T 7.58 4.58 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 79 P 0.00 3.90 0.00 1.04 0.49 0.00 3.42 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.24 0.00 80 N 7.86 4.99 0.00 2.92 2.95 0.00 0.00 5.86 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 81 E 8.73 3.66 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 82 E 8.79 4.25 0.00 2.20 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 0.00 2.33 2.43 0.00 83 C 8.21 4.94 0.00 3.13 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.35 3.99 0.00 1.33 1.30 0.76 0.18 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 85 F 8.86 5.27 0.00 3.05 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 86 L 8.96 4.98 0.00 1.55 1.59 0.92 0.77 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 87 E 9.02 4.37 0.00 2.05 1.88 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 2.16 1.82 0.00 88 R 8.33 4.79 0.00 1.77 1.80 0.00 3.10 0.00 0.00 2.89 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.59 0.00 89 L 9.07 4.85 0.00 1.62 1.69 1.03 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.77 4.69 0.00 2.24 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 2.29 2.41 0.00 91 E 9.67 3.87 0.00 2.34 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 2.31 2.34 0.00 92 N 8.48 4.27 0.00 2.82 2.87 0.00 0.00 6.88 8.16 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 93 H 7.93 4.78 0.00 2.91 2.97 0.00 5.95 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.76 4.60 0.00 3.09 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 95 N 9.64 5.65 0.00 3.04 2.79 0.00 0.00 6.95 6.88 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 96 T 8.51 5.36 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 1.33 0.00 0.00 97 Y 8.54 4.91 0.00 2.64 2.61 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 0.00 0.00 0.00 98 I 8.52 4.66 1.72 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.67 0.62 0.00 0.00 99 S 9.16 4.29 0.00 4.17 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.67 3.85 0.00 1.76 1.68 0.00 1.70 0.00 0.00 1.45 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.31 7.81 101 K 8.01 3.78 0.00 1.80 1.65 0.00 1.79 0.00 0.00 1.64 0.00 0.00 3.20 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.93 1.33 7.81 102 H 7.92 4.66 0.00 3.22 2.58 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.56 4.01 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 0.00 104 E 7.96 3.68 0.00 1.45 1.76 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 2.13 2.15 0.00 105 K 7.57 3.93 0.00 0.82 0.74 0.00 0.66 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 0.88 7.81 106 N 7.90 3.92 0.00 2.96 3.12 0.00 0.00 6.86 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 0.00 107 W 7.66 5.14 0.00 3.25 3.07 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 0.00 0.00 0.00 108 F 9.19 5.38 0.00 2.82 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 0.00 109 V 8.91 4.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.38 0.00 0.00 110 G 8.42 4.83 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 0.00 111 L 8.10 5.33 0.00 1.43 1.41 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.03 4.25 0.00 1.98 1.68 0.00 1.81 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.50 7.81 113 K 8.41 4.00 0.00 1.72 1.75 0.00 1.65 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 1.47 1.51 7.81 114 N 7.96 4.62 0.00 2.83 2.87 0.00 0.00 6.35 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.07 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 0.00 116 S 7.67 4.83 0.00 3.83 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 0.00 117 V 8.37 4.04 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 0.80 0.00 0.00 0.97 0.00 0.00 118 K 8.63 4.57 0.00 1.69 1.65 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.29 7.81 119 R 8.78 4.06 0.00 1.77 1.92 0.00 2.93 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.48 0.00 120 G 8.79 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.33 0.00 1.88 2.16 0.00 3.06 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.13 0.00 122 R 8.33 4.38 0.00 1.84 1.93 0.00 3.28 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 123 T 7.69 5.28 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 1.34 0.00 0.00 124 H 7.85 4.73 0.00 3.53 3.60 0.00 5.68 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 0.00 125 Y 8.70 4.06 0.00 3.16 2.97 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 0.00 126 G 9.04 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.52 4.24 0.00 1.83 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.76 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 128 K 8.30 3.66 0.00 1.74 1.63 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.26 7.81 129 A 8.05 3.99 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 0.00 130 I 6.90 4.57 1.73 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.46 0.55 0.00 0.00 131 L 7.32 4.40 0.00 1.11 0.58 0.32 0.84 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 0.00 132 F 9.75 5.34 0.00 3.34 3.09 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 0.00 133 L 9.20 5.17 0.00 2.16 1.79 1.18 1.06 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 0.00 134 C 9.03 5.02 0.00 3.18 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 0.00 135 L 8.82 4.86 0.00 1.74 1.59 1.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.66 0.00 2.04 1.96 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 137 V 8.11 3.99 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 0.59 0.00 0.00 0.95 0.00 0.00