NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3934 8.1233 123.5866 52.3856 21.1830 178.9718 10 N 4.1556 8.0219 111.7225 56.0447 38.7297 176.1842 11 S 4.1167 8.8415 117.2777 61.6169 63.3909 176.5580 12 T 3.8913 7.6953 118.1767 66.5678 68.3316 176.7776 13 V 3.3751 7.7685 120.0364 65.9770 31.4898 177.9885 14 L 3.8012 8.0297 119.0067 57.7422 40.9674 179.5491 15 S 4.0885 8.2577 113.0873 61.2318 62.1630 175.8467 16 F 4.3830 7.8706 121.6478 61.8274 39.5399 176.6541 17 C 3.8847 8.2201 116.0251 62.4566 27.6393 175.7238 18 A 3.7069 7.8781 121.9755 54.5796 17.9260 178.7410 19 F 4.5743 7.1641 111.8983 56.4375 38.8038 176.3563 20 A 4.1391 6.9232 122.5375 51.8408 18.7406 179.3723 21 V 3.7548 8.2162 113.6787 63.5376 32.0474 176.3750 22 D 4.6527 7.4500 118.9380 50.3974 41.7740 173.4457 23 P 4.1946 0.0000 0.0000 65.4477 31.5341 177.8355 24 A 3.9752 8.0173 118.6737 54.8937 18.2429 179.4584 25 K 3.9503 8.3494 117.9836 59.3648 32.2570 178.9754 26 A 4.0318 8.1487 121.2703 55.4516 18.3275 179.0233 27 Y 4.3164 8.2430 118.1643 60.6772 38.8094 178.0825 28 K 3.8270 8.2532 120.7143 59.6648 32.3857 178.6135 29 D 4.4262 8.5351 119.3802 57.2639 40.6449 178.0758 30 Y 4.0956 8.3907 120.3298 60.6559 38.7185 178.2222 31 L 3.6416 8.0508 119.6835 57.6074 41.5404 179.2741 32 A 3.9579 7.7818 119.2471 54.3797 18.2423 178.7442 33 S 4.5599 7.3291 111.4224 58.1849 63.2501 174.9511 34 G 3.8588 7.9922 110.5408 44.7436 0.0000 174.6711 35 G 2.3667 7.2568 108.8718 44.8415 0.0000 173.3449 36 Q 4.1874 8.3725 123.4262 54.3234 29.8000 174.1548 37 P 4.7025 0.0000 0.0000 62.6321 32.0588 176.1373 38 I 3.9777 8.3784 122.4325 61.8586 37.4924 176.0782 39 T 4.6674 8.6294 115.9421 60.9851 71.0945 173.7194 40 N 4.3209 8.7501 117.2349 54.9720 35.6803 174.3808 41 C 4.4054 8.0666 114.5577 59.6507 29.2389 173.3574 42 V 4.3750 8.1226 116.1160 60.0640 32.9268 175.0475 43 K 4.4424 8.6523 126.9807 55.5753 33.2581 175.7208 44 M 4.3984 8.7393 127.0828 54.3593 33.4068 175.7573 45 L 4.3055 8.3285 124.5838 53.9918 42.5530 175.3232 46 C 4.7919 8.0891 119.8467 56.6490 32.7820 174.0490 47 T 3.9778 8.3349 109.2802 62.9505 68.6154 174.3418 48 H 4.1779 8.1867 117.7307 57.3770 25.7001 174.5195 49 T 4.6431 7.8590 106.2952 61.3869 69.2577 174.0064 50 G 3.9915 7.8854 112.7466 45.4248 0.0000 174.5275 51 T 3.8556 8.9038 109.3579 62.8351 68.7105 175.8847 52 G 3.9585 8.4510 109.7304 45.5187 0.0000 173.7515 53 Q 4.1386 7.6084 117.5581 55.4908 29.6250 176.4856 54 A 4.0068 8.7395 122.6108 54.6706 19.3047 177.7818 55 I 5.0799 7.4250 116.0097 60.1414 40.4540 174.8241 56 T 4.8001 8.8924 116.8518 59.7178 72.0279 175.4949 57 V 3.9038 8.6009 114.5169 63.1679 32.0550 176.4058 58 T 4.6498 7.5217 107.9071 58.4758 71.8098 171.7321 59 P 4.2153 0.0000 0.0000 63.1875 31.6329 176.4397 60 E 4.6566 9.2592 122.7483 55.7030 31.0688 175.5821 61 A 4.4999 7.6849 121.9804 52.4343 19.1529 178.3672 62 N 5.3028 8.9275 119.9175 51.6577 39.8521 175.4065 63 M 4.2607 8.6191 116.3378 57.9082 32.3500 176.7582 64 D 4.8749 8.9794 118.7394 53.9229 41.2694 175.1023 65 Q 5.2419 7.8478 117.5508 54.3387 33.1677 174.0407 66 E 4.7959 9.1456 118.6345 54.8211 33.6144 175.4794 67 S 5.2374 8.1781 117.5118 56.9662 65.6968 173.2067 68 F 5.3468 9.2599 122.2692 55.2229 43.1183 174.6955 69 G 3.8848 9.3863 110.1820 46.3552 0.0000 174.4655 70 G 3.8849 9.0569 112.9976 48.0896 0.0000 175.6537 71 A 3.9870 8.0051 123.3280 54.9275 18.1278 179.5991 72 S 4.1053 7.5984 111.1262 61.3243 63.2869 175.7336 73 C 4.5065 8.1945 117.6191 58.5226 28.3950 172.4515 74 C 4.5614 7.5284 123.0446 57.7189 31.9767 173.5637 75 L 3.5722 8.3955 129.2399 58.5436 41.5094 178.5384 76 Y 3.8128 7.0920 115.8397 61.0927 37.7401 177.9494 77 C 4.1381 7.8812 117.1745 62.9289 28.1091 176.2703 78 R 3.8318 8.0294 118.7893 58.6339 29.6836 177.9690 79 C 4.1737 7.5984 114.4193 59.1471 28.5890 173.2787 80 H 4.1089 7.5252 116.6238 56.8147 26.2521 174.3171 81 I 4.5677 7.1294 110.4582 58.4199 40.1773 174.8243 82 D 4.5113 8.3632 120.3988 54.8398 41.1408 176.3246 83 H 3.9027 8.3365 119.0123 54.4841 30.0812 173.4333 84 P 4.4225 0.0000 0.0000 65.0481 32.1751 176.7554 85 N 3.1400 6.8640 108.6594 55.9751 39.3572 176.0429 *89 F 4.7110 7.9355 124.5368 57.3522 41.6458 174.5896 90 C 4.5737 8.3776 117.4400 57.3644 34.8691 173.3823 91 D 4.5840 8.6765 125.1585 54.7222 40.0430 177.1997 92 L 4.2604 7.7589 119.7370 56.1845 42.5633 176.8656 93 K 3.9184 7.8990 119.3858 58.0892 32.2441 176.6428 94 G 3.8982 9.0112 114.6728 44.9208 0.0000 172.3274 95 K 4.5799 7.6979 119.2301 54.6968 35.8677 174.0969 96 Y 5.0183 8.6842 117.4992 56.7043 41.4980 175.1186 97 V 4.9387 9.1085 124.2738 61.4215 33.8629 174.2620 98 Q 5.0243 9.0607 127.8263 55.1010 29.8007 175.2906 99 I 4.0832 8.6841 125.0478 58.2727 40.6191 173.4451 100 P 4.5335 0.0000 0.0000 63.2835 31.7066 177.5003 101 T 3.9527 9.1969 121.5305 67.0078 68.5993 176.3537 102 T 4.0505 7.9145 109.4579 63.5555 69.2022 174.4332 103 C 4.6650 8.2208 118.8585 59.3462 29.3357 175.0034 104 A 4.0951 7.5530 121.9465 53.3201 17.6811 178.1351 105 N 4.6269 7.8887 113.3614 54.2893 38.3724 175.2827 106 D 4.7561 7.8941 118.6574 51.3205 41.4937 173.5320 107 P 4.1138 0.0000 0.0000 64.8418 31.7220 178.2946 108 V 4.2609 7.0882 118.2049 65.6708 31.5244 178.3263 109 G 3.9681 8.7730 106.7426 46.9464 0.0000 175.4186 110 F 3.8211 8.3090 123.3520 61.4191 39.1548 177.3326 111 T 3.9112 7.5851 108.1638 64.4123 68.7437 176.4357 112 L 4.1735 7.2578 120.1494 57.6144 41.7603 179.0223 113 R 4.1070 7.9488 116.6604 56.7556 30.3352 176.1457 114 N 4.8717 7.0167 115.0361 51.6115 41.1544 173.7880 115 T 4.9052 8.2923 114.8487 61.9425 72.2319 173.5425 116 V 4.0987 8.3724 125.7249 61.9252 32.8546 175.0627 117 C 4.4218 9.3657 129.6327 59.5944 31.8709 174.6537 118 T 3.9606 8.7224 116.3150 63.9720 68.7193 175.5680 119 V 3.8581 7.5205 121.8981 64.9885 31.9789 176.4041 120 C 4.2148 7.9196 113.5223 58.3220 30.5037 175.2225 121 G 3.7811 8.3023 108.9276 45.8927 0.0000 173.0527 122 M 4.6429 7.0874 119.6130 52.7926 34.3025 175.4315 123 W 4.8048 8.4089 120.0286 56.5064 29.8259 176.2787 124 K 4.3910 9.3887 123.8584 58.0992 31.6638 177.3576 125 G 4.0317 10.1649 113.1119 45.6607 0.0000 173.3316 126 Y 4.8350 8.3591 116.2022 53.8251 39.0687 173.2522 127 G 4.1228 8.7997 113.2176 46.1290 0.0000 172.4574 128 C 4.1182 8.2573 119.8694 60.5132 32.1660 173.3161 129 S 4.0728 8.8094 121.4830 59.2339 62.6851 172.0585 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 9 A 8.12 4.39 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 10 N 8.02 4.16 0.00 2.82 2.85 0.00 0.00 6.94 6.68 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 11 S 8.84 4.12 0.00 3.88 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 12 T 7.70 3.89 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 1.24 0.00 0.00 13 V 7.77 3.38 1.82 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 -0.14 0.00 0.00 0.88 0.00 0.00 14 L 8.03 3.80 0.00 1.67 1.57 0.89 0.79 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 15 S 8.26 4.09 0.00 4.04 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 16 F 7.87 4.38 0.00 3.04 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 17 C 8.22 3.88 0.00 2.79 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 18 A 7.88 3.71 0.77 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 0.00 0.00 19 F 7.16 4.57 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 20 A 6.92 4.14 1.03 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 0.00 0.00 21 V 8.22 3.75 2.08 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 0.71 0.00 0.00 0.93 0.00 0.00 22 D 7.45 4.65 0.00 2.75 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 23 P 0.00 4.19 0.00 2.10 1.96 0.00 3.71 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 24 A 8.02 3.98 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 25 K 8.35 3.95 0.00 2.04 1.98 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.46 1.47 7.81 26 A 8.15 4.03 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 27 Y 8.24 4.32 0.00 2.89 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 28 K 8.25 3.83 0.00 1.98 2.00 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.44 7.81 29 D 8.54 4.43 0.00 2.88 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 30 Y 8.39 4.10 0.00 3.25 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.05 3.64 0.00 1.68 1.50 0.37 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.78 3.96 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 33 S 7.33 4.56 0.00 3.72 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 34 G 7.99 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 7.26 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 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.37 4.19 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 37 P 0.00 4.70 0.00 2.27 2.30 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 38 I 8.38 3.98 1.73 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.38 0.83 0.00 0.00 39 T 8.63 4.67 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 1.31 0.00 0.00 40 N 8.75 4.32 0.00 2.91 2.99 0.00 0.00 6.83 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 41 C 8.07 4.41 0.00 2.90 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 42 V 8.12 4.38 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 0.75 0.00 0.00 1.03 0.00 0.00 43 K 8.65 4.44 0.00 1.69 1.54 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.77 0.45 7.81 44 M 8.74 4.40 0.00 1.78 1.86 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.76 0.00 45 L 8.33 4.31 0.00 1.55 1.54 0.90 0.84 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 46 C 8.09 4.79 0.00 2.93 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 47 T 8.33 3.98 4.23 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 1.19 0.00 0.00 48 H 8.19 4.18 0.00 3.33 3.46 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 49 T 7.86 4.64 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 1.29 0.00 0.00 50 G 7.89 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 0.00 0.00 0.00 51 T 8.90 3.86 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 1.26 0.00 0.00 52 G 8.45 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 Q 7.61 4.14 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 54 A 8.74 4.01 -0.09 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 55 I 7.42 5.08 1.76 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.47 0.91 0.00 0.00 56 T 8.89 4.80 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 1.22 0.00 0.00 57 V 8.60 3.90 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 0.77 0.00 0.00 0.97 0.00 0.00 58 T 7.52 4.65 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 1.21 0.00 0.00 59 P 0.00 4.22 0.00 1.82 1.80 0.00 3.23 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.91 0.00 60 E 9.26 4.66 0.00 1.97 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 2.44 2.37 0.00 61 A 7.68 4.50 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 0.00 0.00 0.00 0.00 0.00 62 N 8.93 5.30 0.00 2.98 3.02 0.00 0.00 6.85 8.14 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 63 M 8.62 4.26 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.67 0.00 64 D 8.98 4.87 0.00 2.80 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 65 Q 7.85 5.24 0.00 1.88 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 66 E 9.15 4.80 0.00 1.84 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 67 S 8.18 5.24 0.00 3.61 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 9.26 5.35 0.00 3.03 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 69 G 9.39 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 70 G 9.06 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 71 A 8.01 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.60 4.11 0.00 4.16 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 73 C 8.19 4.51 0.00 3.08 2.88 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 74 C 7.53 4.56 0.00 2.97 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 75 L 8.40 3.57 0.00 1.36 0.97 0.36 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.09 3.81 0.00 2.65 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 77 C 7.88 4.14 0.00 3.18 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.03 3.83 0.00 1.73 1.80 0.00 3.21 0.00 0.00 3.14 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 79 C 7.60 4.17 0.00 2.80 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 80 H 7.53 4.11 0.00 3.23 3.37 0.00 5.60 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 81 I 7.13 4.57 1.83 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 1.36 0.73 0.84 0.00 0.00 82 D 8.36 4.51 0.00 2.67 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 83 H 8.34 3.90 0.00 2.83 2.81 0.00 5.87 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 84 P 0.00 4.42 0.00 1.99 1.87 0.00 2.67 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 1.52 1.39 0.00 85 N 6.86 3.14 0.00 2.64 2.65 0.00 0.00 6.79 7.45 0.00 0.00 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 F 7.94 4.71 0.00 2.85 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 90 C 8.38 4.57 0.00 1.91 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 0.00 0.00 0.00 0.00 91 D 8.68 4.58 0.00 2.82 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 92 L 7.76 4.26 0.00 1.74 1.78 1.04 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.90 3.92 0.00 1.75 1.82 0.00 2.08 0.00 0.00 1.99 0.00 0.00 3.12 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.51 7.81 94 G 9.01 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 0.00 0.00 0.00 95 K 7.70 4.58 0.00 1.76 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.35 7.81 96 Y 8.68 5.02 0.00 3.00 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 97 V 9.11 4.94 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 1.42 0.00 0.00 1.06 0.00 0.00 98 Q 9.06 5.02 0.00 2.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.35 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 99 I 8.68 4.08 1.93 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.93 0.13 0.00 0.00 100 P 0.00 4.53 0.00 1.91 2.07 0.00 2.30 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.12 0.00 101 T 9.20 3.95 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 0.00 102 T 7.91 4.05 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 1.25 0.00 0.00 103 C 8.22 4.67 0.00 2.50 2.92 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 0.00 104 A 7.55 4.10 1.46 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 0.00 105 N 7.89 4.63 0.00 2.83 2.97 0.00 0.00 5.81 8.06 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 0.00 106 D 7.89 4.76 0.00 2.75 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 0.00 107 P 0.00 4.11 0.00 1.67 1.18 0.00 3.44 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.46 0.00 108 V 7.09 4.26 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 0.98 0.00 0.00 0.75 0.00 0.00 109 G 8.77 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 0.00 110 F 8.31 3.82 0.00 3.08 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 0.00 111 T 7.59 3.91 4.54 0.00 0.00 0.00 0.00 0.00 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 0.00 112 L 7.26 4.17 0.00 1.87 1.79 0.96 0.90 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 0.00 113 R 7.95 4.11 0.00 1.51 1.83 0.00 3.03 0.00 0.00 3.15 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 114 N 7.02 4.87 0.00 1.51 2.37 0.00 0.00 6.76 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 0.00 115 T 8.29 4.91 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 1.27 0.00 0.00 116 V 8.37 4.10 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 0.47 0.00 0.00 0.05 0.00 0.00 117 C 9.37 4.42 0.00 3.04 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.72 3.96 4.23 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 1.20 0.00 0.00 119 V 7.52 3.86 2.08 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 0.85 0.00 0.00 0.93 0.00 0.00 120 C 7.92 4.21 0.00 3.15 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.30 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 M 7.09 4.64 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.61 0.00 123 W 8.41 4.80 0.00 3.86 3.31 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 0.00 124 K 9.39 4.39 0.00 2.01 1.88 0.00 1.61 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.50 7.81 125 G 10.16 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 0.00 0.00 0.00 126 Y 8.36 4.83 0.00 3.12 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 0.00 127 G 8.80 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 0.00 128 C 8.26 4.12 0.00 3.09 2.94 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 0.00 129 S 8.81 4.07 0.00 4.03 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 * Residues marked with a * may have inaccurate shift predictions.