NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4869 8.3049 120.6148 55.4138 33.5914 174.5193 2 K 4.6133 9.0319 125.3516 53.5966 34.3713 174.1450 3 S 5.3155 8.6036 116.2627 57.2987 66.5810 172.1573 4 Y 4.8240 8.9356 121.2224 56.2472 42.4410 173.6777 5 R 4.8815 7.4551 124.7144 54.6311 33.6942 173.9668 6 K 4.4688 8.9285 125.8879 55.1993 36.1840 174.1569 7 E 5.0995 8.7628 126.6439 55.2327 31.2057 175.2085 8 L 4.6356 9.2169 124.5333 52.8272 44.0660 175.5223 9 W 5.2657 8.3418 123.0585 55.0489 31.6942 175.3404 10 F 4.8065 9.1629 120.8749 56.3262 43.1902 173.8643 11 H 5.1348 8.8640 121.4402 54.9950 31.1559 172.5793 12 T 4.2825 8.3185 115.1139 60.7672 69.9445 175.9200 13 K 3.9844 8.1656 124.5885 58.6864 32.4286 176.7358 14 R 4.7258 7.4368 115.1269 53.5828 33.6973 175.3642 15 R 4.0963 8.6235 118.4702 59.2061 30.8374 176.2959 16 R 5.4255 7.4251 115.1493 53.5279 33.3493 174.8097 17 E 4.4730 7.7439 120.0742 55.3248 33.1112 173.5940 18 F 5.3459 8.5772 124.3640 55.9040 41.2180 175.0329 19 I 4.6715 8.8634 124.2636 59.2460 40.3054 174.2730 20 N 4.0679 9.1579 126.7896 53.2776 39.2193 174.3748 21 I 4.3840 8.4535 119.5954 60.8848 38.6457 177.3403 22 T 3.7553 8.1909 120.1240 66.9455 68.3469 174.4698 23 P 4.6814 0.0000 0.0000 64.7430 31.2786 178.8140 24 L 3.9901 7.8120 117.6603 57.8112 41.6086 179.1503 25 L 4.0025 7.8814 118.9196 57.8652 41.3829 179.3753 26 E 3.8952 8.3312 118.5606 59.5139 29.3177 179.1382 27 E 3.9176 8.0699 118.7534 59.1570 29.6878 178.4629 28 C 3.9573 8.1051 118.2981 62.1518 28.0189 176.3290 29 V 3.3601 7.6072 118.4562 65.7527 31.2437 177.7317 30 R 3.9524 7.9939 118.7162 59.4713 29.8060 178.4241 31 E 4.0077 8.0653 116.1421 59.0060 29.6808 178.7463 32 S 4.1661 7.4839 114.9376 59.2285 62.9296 175.5927 33 G 3.8651 7.5723 108.3590 45.5037 0.0000 173.4537 34 I 3.9085 7.5297 122.1211 60.9355 37.8984 176.7336 35 K 4.1247 8.6174 126.1293 57.9682 32.9963 176.2185 36 E 5.0687 8.5742 118.2948 54.2182 33.1342 175.5405 37 G 4.2606 7.7834 109.9236 45.7891 0.0000 171.0474 38 L 5.1897 7.8131 118.4570 52.7959 45.8666 175.5080 39 L 5.1912 9.0717 125.3027 53.2239 44.6277 174.5182 40 L 5.1707 9.1477 128.6219 53.5869 44.5886 174.5175 41 C 5.4668 9.1928 126.0041 57.7436 34.6883 172.2763 42 N 5.6336 9.2695 122.7808 50.7553 40.9239 173.5726 43 A 4.5998 8.7748 123.2736 52.7482 18.6250 177.6570 44 M 4.3387 9.1503 121.8205 56.2738 32.6962 176.2333 45 H 4.8875 8.2243 115.7770 54.0348 31.1415 173.9546 46 I 4.3412 8.2379 114.9623 61.2787 37.4356 176.2071 47 T 4.8473 7.7481 109.8298 61.3788 70.0140 172.7444 48 A 4.7227 8.0437 121.5731 51.5736 22.8608 176.0522 49 S 5.1183 8.9344 114.2322 55.6611 67.5747 173.5817 50 V 5.1586 8.5433 121.3472 61.2636 33.8049 174.4936 51 F 5.1332 8.7858 121.4607 55.8524 42.0008 172.8385 52 I 5.0116 8.2250 119.7675 60.0925 39.1856 174.9359 53 N 4.7907 8.7716 124.8377 53.7989 43.5007 172.5992 54 D 4.7634 9.0536 116.9422 54.2928 42.1753 177.3495 55 D 4.9725 8.6087 125.8604 52.8898 40.0759 174.0680 56 E 4.5892 7.6934 122.3703 52.3629 33.5645 173.0187 57 P 4.3553 0.0000 0.0000 65.8250 31.3641 178.7911 58 G 3.6039 8.3384 105.0416 47.6521 0.0000 175.2604 59 L 3.9703 8.3213 123.1961 57.9587 42.0538 178.6714 60 H 4.2599 8.1749 116.3265 59.1435 28.6715 177.1133 61 H 4.2253 8.5225 119.9829 59.5438 29.6228 176.9886 62 D 4.3427 8.3067 120.7427 57.3801 40.5241 178.8188 63 F 4.3783 8.5407 118.7053 60.4786 38.9014 177.1567 64 E 4.1247 8.5990 119.0026 59.5276 29.4976 179.0967 65 V 3.6043 7.9286 118.1012 65.7731 31.5324 177.8046 66 W 4.2559 8.6141 128.3518 60.5976 30.5418 178.0605 67 L 3.6538 8.6207 119.3991 57.6255 40.8718 179.3395 68 E 3.9224 8.2941 118.7550 58.9309 29.0880 179.3311 69 K 3.9959 7.6672 119.1741 59.5481 32.4116 178.6864 70 L 4.0789 7.6684 117.8328 56.4229 42.8938 177.6995 71 A 4.6809 7.7720 120.7175 49.5601 19.4809 173.5358 72 P 4.6258 0.0000 0.0000 61.3706 32.4790 177.2436 73 E 4.3104 9.3048 123.5737 58.6790 29.7332 177.0372 74 K 4.4784 7.4764 115.1500 53.1831 35.7899 174.0607 75 P 4.2101 0.0000 0.0000 62.5507 32.3305 177.1265 76 Y 4.4797 8.1886 118.4789 61.3563 37.9882 178.8550 77 S 4.3112 8.1036 113.1584 60.5990 63.1065 175.1900 78 Q 3.9350 7.6780 118.1590 57.5866 28.8410 175.4275 79 Y 4.8681 7.5542 117.7878 55.8861 40.0524 176.9676 80 K 4.3936 8.8172 124.3923 59.5777 32.5353 178.6768 81 H 4.1609 8.3989 117.6389 58.9211 30.0856 175.2273 82 N 4.9188 8.1563 114.5228 52.6021 38.6045 176.5742 83 D 4.4872 7.9833 119.8660 56.6339 40.9610 177.1740 84 T 4.4843 7.6856 108.2637 61.7354 69.0358 174.9884 85 G 4.0209 7.8360 110.8852 46.4309 0.0000 175.1167 86 E 4.1457 8.0608 119.3028 56.5520 30.0412 176.5654 87 D 4.7013 8.2753 117.9695 52.9955 40.4138 175.4702 88 N 4.8078 8.0445 115.1304 53.1224 38.0452 176.0953 89 A 3.9205 8.4752 124.0014 56.0273 18.2210 180.1888 90 D 3.9410 7.8713 116.4991 56.4964 39.3113 178.5928 91 A 4.0474 8.0083 122.1191 55.1614 18.0691 179.3387 92 H 4.3723 7.8905 115.7989 58.2867 28.8267 178.1146 93 L 3.8839 7.5744 120.3337 57.6649 41.7358 179.2937 94 K 3.5081 8.0641 119.0486 59.3377 31.8375 179.5896 95 R 4.5099 7.6851 117.4889 59.0507 29.0831 179.0228 96 T 3.8539 7.2045 115.5686 66.4203 68.4949 176.2447 97 I 3.7869 7.1593 120.0400 64.8382 37.2481 178.2196 98 M 4.1161 7.6420 117.5778 55.6248 32.0597 177.7108 99 G 4.1107 8.1302 105.7123 44.9930 0.0000 174.2531 100 R 4.2555 8.6385 120.5403 58.5726 31.2536 175.7925 101 E 5.3521 8.0899 113.8092 54.9549 32.9929 175.0275 102 V 4.6600 8.9004 113.3945 59.5717 35.7140 174.8121 103 V 4.8731 8.4174 122.3863 61.2543 34.0418 174.6799 104 I 4.7325 8.9349 128.0578 59.1395 40.8470 174.8549 105 A 4.4257 8.6914 128.2885 52.0795 19.9774 175.9655 106 I 4.8184 8.6116 122.7750 59.9901 39.6740 175.0800 107 T 5.1690 8.6815 123.3838 61.1147 72.4417 173.8841 108 D 4.2741 10.0203 126.7978 55.5505 40.1367 173.9978 109 R 4.1925 8.2886 112.1164 56.4295 28.8103 176.7909 110 K 4.6726 7.7408 116.7309 54.2563 36.0516 175.7754 111 M 4.3982 8.5271 120.9816 55.9776 32.2537 176.8041 112 D 4.6425 8.6700 124.5706 52.4416 40.0278 175.0247 113 L 4.9204 7.7697 122.9327 51.9836 44.5744 176.8728 114 G 3.9218 9.4845 111.5521 43.9855 0.0000 172.9987 115 P 3.8545 0.0000 0.0000 64.4582 31.0968 177.1971 116 W 4.9810 7.6273 115.0573 55.9876 30.2038 175.0063 117 E 4.2596 7.9262 118.9319 56.5346 29.3403 176.2968 118 Q 4.6250 8.6821 122.5901 54.0011 33.2963 174.3789 119 V 4.5291 8.4976 123.0035 61.5099 33.5652 174.6170 120 F 5.0465 8.7351 126.0565 55.5994 42.6971 173.4407 121 Y 4.7443 8.8754 124.4464 56.7393 40.1797 174.3999 122 G 4.0246 8.7587 115.3763 44.4645 0.0000 171.5312 123 E 3.9480 7.9340 129.3225 54.7387 30.4584 176.4787 124 F 4.8386 7.9725 123.5185 57.1099 40.6753 175.8782 125 D 4.6273 8.2717 118.0156 53.1977 39.9650 175.0051 126 G 4.3886 8.6936 115.6900 44.9341 0.0000 173.3396 127 M 3.5322 9.1978 121.0395 55.1545 29.5181 176.2266 128 R 4.6744 6.8569 109.5176 54.1614 32.9054 172.6212 129 P 4.6726 0.0000 0.0000 62.9917 31.9476 175.5979 130 K 4.4778 9.2737 123.3210 54.4558 37.0660 175.3357 131 R 5.1550 8.4545 119.0256 54.5084 34.5699 174.5226 132 V 4.8636 9.0356 122.0790 61.0961 34.8187 173.8052 133 L 5.1066 9.0655 129.6449 53.4800 44.3852 174.9164 134 V 4.9413 8.9322 126.2117 61.0233 34.3147 174.0651 135 K 5.1431 9.3513 128.8626 54.7832 35.6438 174.6800 136 I 5.2619 9.2014 128.1099 59.4567 40.7895 174.5262 137 I 5.0077 9.7635 119.4957 58.3646 40.9292 176.1132 138 G 4.0868 7.4391 112.1765 46.9293 0.0000 173.2321 139 E 4.2669 8.3169 117.4381 56.1717 30.8807 171.9583 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 4.49 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.68 0.00 2 K 9.03 4.61 0.00 1.87 1.73 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.46 7.81 3 S 8.60 5.32 0.00 3.84 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 4 Y 8.94 4.82 0.00 3.02 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 5 R 7.46 4.88 0.00 1.69 1.51 0.00 3.24 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 6 K 8.93 4.47 0.00 1.76 1.66 0.00 1.44 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.39 1.44 7.81 7 E 8.76 5.10 0.00 2.00 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 2.37 2.40 0.00 8 L 9.22 4.64 0.00 1.65 1.43 1.03 0.77 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 9 W 8.34 5.27 0.00 2.88 2.84 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 10 F 9.16 4.81 0.00 2.77 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 11 H 8.86 5.13 0.00 3.15 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.32 4.28 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 1.34 0.00 0.00 13 K 8.17 3.98 0.00 1.81 1.91 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.44 7.81 14 R 7.44 4.73 0.00 1.78 1.81 0.00 3.28 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 15 R 8.62 4.10 0.00 1.90 1.93 0.00 3.17 0.00 0.00 3.39 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.68 0.00 16 R 7.43 5.43 0.00 1.61 1.61 0.00 3.53 0.00 0.00 3.92 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.44 0.00 17 E 7.74 4.47 0.00 1.90 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 18 F 8.58 5.35 0.00 2.83 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 19 I 8.86 4.67 1.87 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.90 1.05 0.00 0.00 20 N 9.16 4.07 0.00 2.66 2.68 0.00 0.00 7.08 7.94 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 21 I 8.45 4.38 1.95 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 1.30 0.52 1.00 0.00 0.00 22 T 8.19 3.76 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 1.15 0.00 0.00 23 P 0.00 4.68 0.00 2.14 2.08 0.00 3.78 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 2.10 2.01 0.00 24 L 7.81 3.99 0.00 1.86 1.74 1.02 0.68 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 25 L 7.88 4.00 0.00 1.87 1.70 1.01 0.99 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 26 E 8.33 3.90 0.00 2.17 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 2.29 2.47 0.00 27 E 8.07 3.92 0.00 2.08 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 0.00 2.29 2.38 0.00 28 C 8.11 3.96 0.00 3.15 2.86 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 29 V 7.61 3.36 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 0.77 0.00 0.00 0.91 0.00 0.00 30 R 7.99 3.95 0.00 1.96 1.97 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 31 E 8.07 4.01 0.00 2.16 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 0.00 2.40 2.25 0.00 32 S 7.48 4.17 0.00 3.91 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 33 G 7.57 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.53 3.91 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.96 0.93 0.00 0.00 35 K 8.62 4.12 0.00 1.77 1.90 0.00 1.64 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.43 7.81 36 E 8.57 5.07 0.00 1.95 1.77 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 2.20 2.36 0.00 37 G 7.78 4.26 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 0.00 38 L 7.81 5.19 0.00 1.60 1.53 0.94 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 39 L 9.07 5.19 0.00 1.67 1.65 0.92 0.37 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 40 L 9.15 5.17 0.00 1.78 1.66 0.96 0.71 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 41 C 9.19 5.47 0.00 3.03 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 42 N 9.27 5.63 0.00 2.90 2.89 0.00 0.00 6.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.77 4.60 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 44 M 9.15 4.34 0.00 1.88 2.23 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.56 0.00 45 H 8.22 4.89 0.00 3.19 3.23 0.00 5.69 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.24 4.34 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.89 0.93 0.00 0.00 47 T 7.75 4.85 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 48 A 8.04 4.72 1.18 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 49 S 8.93 5.12 0.00 3.96 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 50 V 8.54 5.16 2.29 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 0.94 0.00 0.00 1.08 0.00 0.00 51 F 8.79 5.13 0.00 3.11 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 52 I 8.23 5.01 1.98 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 1.37 0.70 1.05 0.00 0.00 53 N 8.77 4.79 0.00 3.06 2.86 0.00 0.00 6.45 8.59 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 54 D 9.05 4.76 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.61 4.97 0.00 3.02 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 56 E 7.69 4.59 0.00 2.01 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.19 0.00 57 P 0.00 4.36 0.00 2.32 2.33 0.00 3.72 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 2.06 2.04 0.00 58 G 8.34 3.60 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 0.00 0.00 0.00 59 L 8.32 3.97 0.00 1.76 1.75 0.54 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 60 H 8.17 4.26 0.00 3.50 3.55 0.00 5.70 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 61 H 8.52 4.23 0.00 3.33 3.56 0.00 5.79 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 62 D 8.31 4.34 0.00 2.63 2.46 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 63 F 8.54 4.38 0.00 3.14 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 64 E 8.60 4.12 0.00 2.31 2.27 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 2.37 2.41 0.00 65 V 7.93 3.60 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 0.98 0.00 0.00 0.83 0.00 0.00 66 W 8.61 4.26 0.00 3.40 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.62 3.65 0.00 1.76 1.49 1.05 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.29 3.92 0.00 2.25 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 0.00 2.33 2.47 0.00 69 K 7.67 4.00 0.00 1.79 1.98 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.46 7.81 70 L 7.67 4.08 0.00 1.20 1.37 -0.40 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.77 4.68 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.63 0.00 2.36 2.14 0.00 3.42 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.90 0.00 73 E 9.30 4.31 0.00 2.08 2.02 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 2.43 2.67 0.00 74 K 7.48 4.48 0.00 1.54 1.36 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.30 0.94 7.81 75 P 0.00 4.21 0.00 2.13 2.07 0.00 3.56 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 76 Y 8.19 4.48 0.00 3.10 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 77 S 8.10 4.31 0.00 3.97 4.03 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 78 Q 7.68 3.93 0.00 1.87 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.63 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 79 Y 7.55 4.87 0.00 3.13 2.87 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 0.00 0.00 0.00 80 K 8.82 4.39 0.00 1.83 1.89 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.40 7.81 81 H 8.40 4.16 0.00 3.03 3.35 0.00 5.91 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.16 4.92 0.00 3.20 2.95 0.00 0.00 6.99 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 83 D 7.98 4.49 0.00 2.83 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 84 T 7.69 4.48 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 1.20 0.00 0.00 85 G 7.84 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 0.00 0.00 0.00 86 E 8.06 4.15 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.14 0.00 87 D 8.28 4.70 0.00 1.58 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 0.00 0.00 0.00 88 N 8.04 4.81 0.00 2.94 3.03 0.00 0.00 6.02 7.01 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 89 A 8.48 3.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.87 3.94 0.00 3.00 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 91 A 8.01 4.05 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 92 H 7.89 4.37 0.00 3.19 3.26 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.57 3.88 0.00 1.62 1.55 0.77 0.61 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 94 K 8.06 3.51 0.00 0.92 0.74 0.00 1.41 0.00 0.00 1.19 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.07 1.31 7.81 95 R 7.69 4.51 0.00 2.32 2.49 0.00 3.14 0.00 0.00 3.50 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.77 0.00 96 T 7.20 3.85 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 1.18 0.00 0.00 97 I 7.16 3.79 1.77 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.34 0.68 0.00 0.00 98 M 7.64 4.12 0.00 1.69 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.69 0.00 99 G 8.13 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 0.00 100 R 8.64 4.26 0.00 1.97 1.98 0.00 3.19 0.00 0.00 3.43 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.69 0.00 101 E 8.09 5.35 0.00 2.09 1.91 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 2.23 2.39 0.00 102 V 8.90 4.66 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 0.82 0.00 0.00 1.01 0.00 0.00 103 V 8.42 4.87 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.97 0.00 0.00 104 I 8.93 4.73 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.58 0.91 0.00 0.00 105 A 8.69 4.43 1.24 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 0.00 106 I 8.61 4.82 1.94 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 1.22 1.00 0.94 0.00 0.00 107 T 8.68 5.17 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 1.20 0.00 0.00 108 D 10.02 4.27 0.00 2.69 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 0.00 109 R 8.29 4.19 0.00 1.97 2.01 0.00 3.10 0.00 0.00 3.05 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 110 K 7.74 4.67 0.00 1.70 1.59 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.49 7.81 111 M 8.53 4.40 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 112 D 8.67 4.64 0.00 2.66 2.58 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 0.00 113 L 7.77 4.92 0.00 1.59 1.50 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 114 G 9.48 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 0.00 115 P 0.00 3.85 0.00 0.92 1.75 0.00 3.65 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 116 W 7.63 4.98 0.00 3.33 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 0.00 117 E 7.93 4.26 0.00 2.02 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 2.43 2.33 0.00 118 Q 8.68 4.63 0.00 2.19 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 119 V 8.50 4.53 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 0.91 0.00 0.00 0.88 0.00 0.00 120 F 8.74 5.05 0.00 1.51 2.43 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 0.00 121 Y 8.88 4.74 0.00 2.54 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 0.00 0.00 0.00 0.00 122 G 8.76 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 0.00 0.00 0.00 123 E 7.93 3.95 0.00 1.64 1.55 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 0.00 2.20 2.35 0.00 124 F 7.97 4.84 0.00 3.11 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 0.00 125 D 8.27 4.63 0.00 2.62 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 0.00 126 G 8.69 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 0.00 0.00 0.00 0.00 127 M 9.20 3.53 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 128 R 6.86 4.67 0.00 1.72 1.80 0.00 3.01 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 129 P 0.00 4.67 0.00 1.79 2.09 0.00 3.67 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.94 0.00 130 K 9.27 4.48 0.00 1.66 1.56 0.00 1.61 0.00 0.00 1.89 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.93 1.39 7.81 131 R 8.45 5.15 0.00 1.72 1.81 0.00 2.96 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 0.60 1.24 0.00 132 V 9.04 4.86 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 1.00 0.00 0.00 0.81 0.00 0.00 133 L 9.07 5.11 0.00 1.82 1.70 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.93 4.94 2.30 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 1.10 0.00 0.00 1.01 0.00 0.00 135 K 9.35 5.14 0.00 1.88 1.63 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.35 1.47 7.81 136 I 9.20 5.26 1.97 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.91 0.99 0.00 0.00 137 I 9.76 5.01 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 0.94 0.00 0.00 138 G 7.44 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 8.32 4.27 0.00 1.85 1.73 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 2.13 2.10 0.00