NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.6630 0.0000 0.0000 62.9743 33.1200 174.7794 3 S 4.9611 8.3829 113.9786 56.6041 66.2397 171.0590 4 I 4.7686 9.6323 121.6205 59.3853 42.6610 174.8739 5 K 5.0300 8.5623 124.7452 55.1238 34.1852 175.4451 6 L 5.2006 9.2666 124.7904 52.9516 44.9120 175.1104 7 Q 5.2826 8.9863 124.7585 54.1904 31.5479 175.3676 8 S 4.9289 9.2289 122.1787 57.6971 64.2784 175.5253 9 S 4.1267 9.2518 115.4589 60.8952 62.6893 175.4626 10 D 4.7663 8.2220 118.4551 52.8689 39.2553 177.3479 11 G 3.9521 8.2618 108.0806 45.5600 0.0000 174.0027 12 E 4.0599 7.9882 121.4524 56.1958 30.8219 175.3395 13 I 4.9051 8.0101 126.6726 59.7073 39.5325 174.8664 14 F 4.7565 9.4575 125.2423 55.5131 42.0663 173.8960 15 E 4.7761 9.0051 125.4780 55.8046 30.2048 175.8888 16 V 4.6055 9.2179 120.6313 59.0715 35.7366 175.0606 17 D 4.7308 8.7628 124.1203 54.4260 41.8577 177.6778 18 V 3.6410 8.5736 119.9066 64.2573 31.2446 178.3162 19 E 4.0291 8.9965 118.6356 58.4297 29.4392 178.3646 20 I 4.0032 7.4793 119.2845 63.9081 37.7452 177.7105 21 A 4.0291 8.2366 121.8607 54.9068 17.9983 179.1735 22 K 4.0457 7.9478 116.5906 58.7240 32.1511 178.1615 23 Q 4.4147 7.9285 117.3508 57.0769 28.6761 175.1661 24 S 4.5409 7.8708 115.7688 56.9302 62.8107 174.1521 25 V 3.5771 8.3328 130.7595 66.3374 31.2817 178.0404 26 T 3.8470 7.3997 109.7735 64.9684 68.6619 176.8239 27 I 3.7035 7.6814 122.8800 63.5110 37.0149 178.1246 28 K 3.8549 8.3059 121.1793 59.9371 31.9081 178.9232 29 T 3.8983 7.7034 109.7930 65.0813 68.6674 176.4915 30 M 4.0524 8.0256 121.4663 57.9273 31.5869 178.8242 31 L 3.9905 8.1774 119.3377 57.9321 41.7319 179.3399 32 E 4.0248 8.1793 117.0954 58.5894 29.5429 177.5755 33 D 4.6849 8.0963 117.2619 56.2102 41.9340 178.1163 34 L 4.0078 7.9595 116.6160 55.3340 42.5354 177.0010 35 G 3.8675 7.8268 106.7664 45.1887 0.0000 173.2601 36 M 4.1865 7.4043 117.7175 54.3702 33.8362 174.7327 *43 D 4.6536 8.1283 125.2378 55.5403 42.0794 174.3883 44 P 4.0150 0.0000 0.0000 60.2286 27.7843 175.1699 45 V 3.8611 8.8668 124.5249 61.9094 32.1355 173.3923 46 P 4.6880 0.0000 0.0000 62.4496 32.3530 177.0155 47 L 5.0248 8.8144 123.6548 51.6739 41.6218 175.3665 48 P 4.3416 0.0000 0.0000 64.8689 31.6059 177.8665 49 N 4.6501 7.7616 114.6046 52.3914 38.8376 174.1316 50 V 4.2281 7.5349 118.6389 60.3693 34.1477 175.3177 51 N 5.0927 8.7552 126.0781 51.0850 39.9177 175.8798 52 A 4.2278 9.1378 122.1754 55.4173 18.0170 179.8354 53 A 4.0018 8.0654 118.7151 55.4760 18.5142 179.8245 54 I 3.8035 8.9540 118.7913 64.2367 37.2316 178.2855 55 L 3.8911 8.3753 121.7394 57.9777 41.7294 178.9532 56 K 3.6675 8.1809 119.7702 59.4043 32.0793 179.0068 57 K 4.2406 7.7324 117.5609 59.3234 31.9282 179.5656 58 V 3.7438 8.3246 119.0493 66.1121 31.5013 178.0859 59 I 3.7305 8.2617 119.8258 64.4755 36.8916 178.1273 60 Q 4.0970 8.4548 119.1129 58.9328 28.5790 179.0686 61 W 3.8506 8.4734 128.9621 60.7876 30.5710 177.6102 62 C 4.1499 8.5652 115.5229 63.2380 27.7206 176.0815 63 T 3.9303 8.4922 117.4738 66.9444 67.8456 176.2551 64 H 3.6487 7.8291 118.8596 58.7484 29.8478 176.0068 65 H 4.2612 7.4531 116.4673 55.1400 28.2977 177.0613 66 K 3.7825 7.2357 122.5069 59.7381 32.2881 177.5842 67 D 4.4728 7.6078 116.3867 54.5312 41.2761 176.1745 68 D 4.3455 7.5814 122.0480 54.6181 41.4356 175.6113 *84 D 4.4357 8.2457 117.2220 53.2978 41.0823 171.1892 85 I 4.0739 8.3051 124.5105 59.5847 37.7457 175.0022 86 P 4.4239 0.0000 0.0000 62.6255 33.1568 177.3014 87 V 3.6297 8.5835 120.6562 66.0937 31.3543 178.2292 88 W 4.2243 8.2773 127.3366 60.7619 30.5124 177.5246 89 D 4.7750 8.5317 118.3214 57.5921 40.1327 178.5887 90 Q 4.0610 8.1538 118.1300 58.8698 29.0233 178.4226 91 E 4.0286 8.2362 118.7065 59.2744 29.5657 178.7254 92 F 3.8618 7.9474 121.1107 60.6759 39.3593 176.1551 93 L 4.3087 7.9103 115.7917 54.1617 42.8426 178.7735 94 K 4.3067 7.4259 121.2029 54.4907 29.5657 175.4212 95 V 4.4224 6.9651 114.8673 58.2354 36.1149 175.5999 96 D 4.5883 8.1370 120.4037 53.0360 41.3516 176.9624 97 Q 4.0227 8.7177 119.4184 59.3659 28.6159 179.8528 98 G 3.7511 8.1349 105.8441 48.2989 0.0000 175.6908 99 T 3.8714 7.4219 118.6594 66.0745 68.4054 176.5487 100 L 3.8183 7.8630 122.3162 58.2388 42.0811 179.1511 101 F 4.2867 8.2863 117.7544 60.5257 38.6996 177.5859 102 E 4.0451 8.5157 118.5841 59.2188 29.1241 179.3242 103 L 3.9909 8.1960 119.6098 57.5409 41.5561 179.5258 104 I 3.6440 7.7228 119.8309 64.3907 37.1305 178.3039 105 L 3.9812 8.1291 119.5922 57.9630 41.3943 179.6235 106 A 4.1385 8.3696 120.5915 55.0213 18.2492 179.5670 107 A 3.8772 8.2790 119.6479 55.1103 18.4818 179.4496 108 N 4.2062 8.4089 115.7256 57.0095 38.9064 176.3771 109 Y 4.1977 8.2976 119.8402 60.6974 38.7982 177.5064 110 L 4.0512 8.4920 117.9132 53.7622 43.2182 175.4833 111 D 4.4074 7.7664 118.4304 55.5826 39.6542 174.3729 112 I 4.9183 7.8089 121.3775 58.1734 37.5358 176.8867 113 K 3.9110 8.6676 125.0658 59.6342 32.0879 178.7067 114 G 3.7815 8.1144 105.0815 47.5468 0.0000 175.4661 115 L 2.6232 7.1294 122.0716 57.2740 42.0859 178.4419 116 L 3.8194 7.8358 120.5953 58.1083 41.8995 178.4230 117 D 4.3005 8.3198 118.3743 57.4704 41.1986 178.6707 118 V 3.7128 7.8114 119.9174 65.0027 31.4336 178.3748 119 T 3.8709 7.9384 110.4965 64.7029 68.6225 176.6404 120 C 4.1385 8.2204 119.6085 62.3385 28.0608 176.0482 121 K 3.9517 8.4046 120.5419 59.8374 31.4265 179.3941 122 T 3.8541 7.8723 114.9090 66.7240 68.6683 176.5593 123 V 3.7722 7.7788 119.7388 65.8349 31.5646 177.7956 124 A 4.0275 8.3772 120.9902 55.4273 17.9759 179.3669 125 N 4.4390 8.2382 113.9025 56.1682 38.6778 176.7951 126 M 4.3211 8.0350 118.3676 56.6222 31.9946 177.4711 127 I 4.2835 7.7280 120.2650 61.9313 38.4391 176.1054 128 K 3.7716 7.8408 117.1318 58.0893 32.3426 176.0279 129 G 4.1291 8.8081 108.4811 46.3443 0.0000 173.1394 130 K 4.8798 7.5435 115.6428 53.6525 35.9349 177.0707 131 T 4.3476 8.8184 112.4582 60.4882 71.1349 174.0720 132 P 4.2248 0.0000 0.0000 66.3016 30.9162 178.2383 133 E 3.9234 8.1271 118.3885 59.1941 29.6491 178.5457 134 E 4.0370 8.5062 118.9529 59.2071 29.4798 179.4304 135 I 3.8855 8.1292 120.3348 64.4478 37.1300 178.4742 136 R 4.0138 8.2597 119.0469 59.3096 29.6793 179.0529 137 K 3.9536 7.6354 117.1572 59.8810 32.2157 179.1425 138 T 3.8488 7.7304 108.7297 64.2617 68.6871 175.4330 139 F 4.7798 8.0128 117.5812 56.2758 39.7327 175.3660 140 N 4.6248 8.4065 122.7357 53.9204 40.3404 173.4141 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 2 P 0.00 4.66 0.00 1.78 1.99 0.00 3.67 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 1.92 1.60 0.00 3 S 8.38 4.96 0.00 4.03 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 4 I 9.63 4.77 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 1.25 1.36 0.94 0.00 0.00 5 K 8.56 5.03 0.00 1.78 1.75 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.59 1.48 7.81 6 L 9.27 5.20 0.00 1.69 1.64 0.94 0.72 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 7 Q 8.99 5.28 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 8 S 9.23 4.93 0.00 4.15 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 0.00 9 S 9.25 4.13 0.00 4.02 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 0.00 10 D 8.22 4.77 0.00 2.82 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 11 G 8.26 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 0.00 0.00 0.00 12 E 7.99 4.06 0.00 2.06 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 1.47 1.96 0.00 13 I 8.01 4.91 1.79 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 1.31 1.00 0.92 0.00 0.00 14 F 9.46 4.76 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.01 4.78 0.00 1.99 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 2.30 2.44 0.00 16 V 9.22 4.61 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 17 D 8.76 4.73 0.00 2.71 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 18 V 8.57 3.64 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 0.84 0.00 0.00 0.98 0.00 0.00 19 E 9.00 4.03 0.00 1.95 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 2.29 2.36 0.00 20 I 7.48 4.00 2.04 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.57 0.94 0.00 0.00 21 A 8.24 4.03 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 22 K 7.95 4.05 0.00 1.93 1.89 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 23 Q 7.93 4.41 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 24 S 7.87 4.54 0.00 3.92 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 25 V 8.33 3.58 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 0.93 0.00 0.00 26 T 7.40 3.85 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 1.12 0.00 0.00 27 I 7.68 3.70 1.87 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 1.40 0.57 0.92 0.00 0.00 28 K 8.31 3.85 0.00 1.97 1.96 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 29 T 7.70 3.90 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 1.25 0.00 0.00 30 M 8.03 4.05 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.56 0.00 31 L 8.18 3.99 0.00 1.68 1.71 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.18 4.02 0.00 1.99 2.00 0.00 0.00 0.00 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 2.52 0.00 33 D 8.10 4.68 0.00 2.86 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 34 L 7.96 4.01 0.00 1.82 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 35 G 7.83 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 36 M 7.40 4.19 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.72 0.00 *43 D 8.13 4.65 0.00 2.73 2.69 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 0.00 0.00 0.00 44 P 0.00 4.02 0.00 2.10 2.13 0.00 3.69 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 45 V 8.87 3.86 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 1.04 0.00 0.00 1.00 0.00 0.00 46 P 0.00 4.69 0.00 2.03 2.00 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.27 0.00 47 L 8.81 5.02 0.00 1.68 1.79 1.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.34 0.00 2.22 2.25 0.00 3.99 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 49 N 7.76 4.65 0.00 1.44 2.15 0.00 0.00 6.66 8.71 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 50 V 7.53 4.23 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 1.12 0.00 0.00 1.02 0.00 0.00 51 N 8.76 5.09 0.00 3.22 2.95 0.00 0.00 6.61 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 52 A 9.14 4.23 1.56 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 53 A 8.07 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 54 I 8.95 3.80 1.93 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.85 0.92 0.00 0.00 55 L 8.38 3.89 0.00 1.74 1.65 0.83 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.18 3.67 0.00 2.08 2.02 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.67 7.81 57 K 7.73 4.24 0.00 2.12 2.01 0.00 1.67 0.00 0.00 1.38 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.49 1.61 7.81 58 V 8.32 3.74 2.24 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 1.16 0.00 0.00 1.00 0.00 0.00 59 I 8.26 3.73 1.95 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.46 0.95 0.00 0.00 60 Q 8.45 4.10 0.00 2.66 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.58 2.79 0.00 61 W 8.47 3.85 0.00 3.16 3.38 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 62 C 8.57 4.15 0.00 3.20 3.24 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 63 T 8.49 3.93 4.40 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 1.17 0.00 0.00 64 H 7.83 3.65 0.00 2.10 2.27 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 H 7.45 4.26 0.00 2.33 2.80 0.00 5.88 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.24 3.78 0.00 1.74 1.97 0.00 1.51 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.29 7.81 67 D 7.61 4.47 0.00 2.50 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 68 D 7.58 4.35 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 *84 D 8.25 4.44 0.00 2.72 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 85 I 8.31 4.07 1.93 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 1.48 0.99 1.02 0.00 0.00 86 P 0.00 4.42 0.00 2.53 2.08 0.00 3.91 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 87 V 8.58 3.63 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 1.07 0.00 0.00 0.98 0.00 0.00 88 W 8.28 4.22 0.00 3.40 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 89 D 8.53 4.77 0.00 3.13 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 90 Q 8.15 4.06 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.98 0.00 0.00 0.00 0.00 0.00 2.45 2.66 0.00 91 E 8.24 4.03 0.00 2.09 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 2.08 1.92 0.00 92 F 7.95 3.86 0.00 1.84 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 93 L 7.91 4.31 0.00 1.73 1.65 1.04 1.06 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 94 K 7.43 4.31 0.00 1.76 1.70 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.70 7.81 95 V 6.97 4.42 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 0.53 0.00 0.00 0.80 0.00 0.00 96 D 8.14 4.59 0.00 2.88 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 97 Q 8.72 4.02 0.00 2.17 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 98 G 8.13 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 0.00 0.00 0.00 99 T 7.42 3.87 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 1.12 0.00 0.00 100 L 7.86 3.82 0.00 1.62 1.64 0.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.29 4.29 0.00 3.27 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 0.00 102 E 8.52 4.05 0.00 2.16 2.00 0.00 0.00 0.00 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 2.55 0.00 103 L 8.20 3.99 0.00 1.79 1.67 0.81 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 104 I 7.72 3.64 2.11 0.00 0.00 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 1.48 0.68 0.95 0.00 0.00 105 L 8.13 3.98 0.00 1.85 1.72 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.37 4.14 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 0.00 107 A 8.28 3.88 1.30 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 0.00 0.00 108 N 8.41 4.21 0.00 2.86 3.05 0.00 0.00 6.84 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 0.00 109 Y 8.30 4.20 0.00 2.90 3.18 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 0.00 110 L 8.49 4.05 0.00 1.79 1.67 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 111 D 7.77 4.41 0.00 2.81 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 0.00 112 I 7.81 4.92 1.75 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 1.48 1.05 0.95 0.00 0.00 113 K 8.67 3.91 0.00 1.78 1.90 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.49 7.81 114 G 8.11 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 0.00 115 L 7.13 2.62 0.00 0.27 1.25 -0.06 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.84 3.82 0.00 1.76 1.78 0.89 1.38 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 0.00 117 D 8.32 4.30 0.00 2.82 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 0.00 118 V 7.81 3.71 2.26 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 0.87 0.00 0.00 1.11 0.00 0.00 119 T 7.94 3.87 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 1.14 0.00 0.00 120 C 8.22 4.14 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.40 3.95 0.00 2.05 1.89 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.75 7.81 122 T 7.87 3.85 4.38 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 1.18 0.00 0.00 123 V 7.78 3.77 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 1.00 0.00 0.00 0.75 0.00 0.00 124 A 8.38 4.03 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 0.00 125 N 8.24 4.44 0.00 2.90 2.92 0.00 0.00 7.10 8.47 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 0.00 126 M 8.03 4.32 0.00 2.00 2.60 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.55 0.00 127 I 7.73 4.28 2.06 0.00 0.00 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 1.63 1.45 0.95 0.00 0.00 128 K 7.84 3.77 0.00 1.76 1.80 0.00 1.93 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.62 1.44 7.81 129 G 8.81 4.13 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 0.00 130 K 7.54 4.88 0.00 1.95 1.75 0.00 1.95 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.55 7.81 131 T 8.82 4.35 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 0.00 132 P 0.00 4.22 0.00 2.30 2.38 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 133 E 8.13 3.92 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 134 E 8.51 4.04 0.00 2.18 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 2.34 2.36 0.00 135 I 8.13 3.89 2.12 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 1.65 1.11 1.10 0.00 0.00 136 R 8.26 4.01 0.00 2.03 2.03 0.00 3.15 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 1.69 1.96 0.00 137 K 7.64 3.95 0.00 1.86 1.87 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.73 7.81 138 T 7.73 3.85 3.84 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 1.21 0.00 0.00 139 F 8.01 4.78 0.00 3.10 3.16 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 0.00 140 N 8.41 4.62 0.00 2.86 2.85 0.00 0.00 6.98 7.36 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 * Residues marked with a * may have inaccurate shift predictions.