NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.2106 8.1545 120.6327 62.8721 32.7925 175.1276 3 Q 4.4842 8.7262 126.6337 53.4858 32.8302 170.2655 4 L 5.1096 8.7299 122.1608 52.4739 45.2724 175.1287 5 V 4.4455 8.5737 123.4301 61.1951 34.1789 174.3950 6 E 5.7609 8.7697 126.5755 55.0282 31.4691 175.2201 7 S 4.5480 8.6516 115.0550 57.9149 66.4995 174.8761 8 G 4.0012 8.6093 107.4126 46.1095 0.0000 174.0850 9 G 3.9087 6.9855 107.6447 44.3373 0.0000 172.6183 10 G 4.0860 7.6523 106.3766 44.2189 0.0000 171.6037 11 S 5.3378 7.9298 116.2402 57.4205 64.3147 174.6450 12 V 4.5708 8.7444 122.4343 60.1472 35.1370 174.3693 13 Q 4.5264 8.6391 120.6445 55.1291 30.1854 175.4745 14 A 4.1526 8.9083 125.8719 54.3730 18.7394 178.4928 15 G 3.9220 9.6186 112.0634 45.1012 0.0000 173.8501 16 G 4.1275 7.9949 107.7100 45.5184 0.0000 172.5390 17 S 5.3088 8.2498 112.8057 57.0788 66.5111 173.3055 18 L 4.5907 8.4862 118.8695 53.3850 46.3161 174.7520 19 R 4.7795 8.3860 121.6316 54.6158 32.6337 174.5319 20 L 4.7526 8.4212 126.5603 53.6795 44.0711 175.7827 21 S 5.3191 9.2552 117.6215 57.0296 66.9706 172.6757 22 C 5.2341 9.3824 123.1001 54.8528 46.4510 172.1086 23 A 4.6760 8.8759 129.4800 50.6226 20.1146 175.8165 24 V 4.5477 8.4877 124.4842 61.8323 32.4471 175.4901 25 S 4.6139 9.4132 123.3553 57.6316 66.0316 175.1425 26 G 3.9785 9.9060 107.1341 44.8084 0.0000 172.3465 27 S 4.5855 7.8474 110.8479 57.5273 65.4179 173.8375 28 T 4.4543 8.1196 119.4510 62.2665 69.6960 173.4783 *29 Y 4.4554 8.3451 124.5210 56.7625 37.6529 175.5016 30 S 4.7472 7.6840 116.1391 58.2417 64.1133 172.5967 31 P 4.5901 0.0000 0.0000 63.2499 32.5724 175.7456 32 C 5.5235 8.5540 117.3914 55.8260 45.7944 173.1676 33 T 4.7750 8.8889 117.8068 62.1836 71.0203 173.4386 34 T 4.8916 9.0932 122.9693 61.7660 71.3045 173.7095 35 G 4.6809 9.3064 112.4160 44.2593 0.0000 171.1223 36 W 5.4736 9.2675 119.8577 55.0503 32.4642 174.7111 37 Y 5.4378 9.9755 120.7670 56.6138 42.5982 174.2810 38 R 5.1118 9.2273 116.4256 55.0584 33.6232 173.9923 39 Q 4.9337 9.1239 121.6059 54.6423 32.4176 174.0798 40 A 4.6052 8.7081 128.2474 50.5645 20.3699 174.7392 41 P 4.3096 0.0000 0.0000 64.3890 31.6774 177.2557 42 G 3.9004 8.9970 110.2328 45.7064 0.0000 172.6522 43 K 4.7213 7.7715 119.3515 54.0652 34.9561 175.2510 44 E 4.3584 8.4030 116.9777 56.3298 31.0181 176.3119 45 R 4.5944 8.4813 122.2386 55.7980 30.6709 175.2257 46 E 4.9283 9.4033 125.5107 54.3501 32.5009 175.1119 47 W 4.2705 8.9553 131.5985 57.7306 31.2707 175.0845 48 V 3.8129 7.6011 125.8739 63.9442 33.5481 175.0066 49 S 4.4539 6.5576 111.5471 57.6586 65.7696 173.6551 50 S 5.3907 8.8353 118.8184 57.2519 67.8288 173.0181 51 I 5.1158 9.0357 122.4407 60.3374 41.5847 172.7073 52 S 4.7813 9.0423 120.6831 58.4100 62.2929 177.2002 53 S 4.3527 9.1357 114.3219 56.6681 63.9435 171.9660 54 P 4.3876 0.0000 0.0000 64.2260 31.1597 177.5334 55 G 3.8701 8.8312 110.3601 46.0581 0.0000 174.0533 56 T 4.1741 7.6283 117.6290 62.2299 68.0428 173.1547 57 I 4.8409 7.3999 124.9604 59.3509 40.9454 174.1818 58 Y 5.0662 8.4176 121.9285 56.7651 42.6091 173.8554 59 Y 4.9927 8.6838 117.3468 56.0841 42.5368 174.9695 60 Q 4.2203 8.4553 124.5011 56.1698 30.0328 176.8846 61 D 4.4520 9.1841 126.0545 57.5741 41.0835 178.8260 62 S 4.2118 8.0466 111.7856 60.2013 63.1773 174.9050 63 V 3.7767 7.5345 113.1876 60.3689 32.4145 175.5958 64 K 3.8273 7.4162 120.6921 57.6588 32.1711 177.5775 65 G 3.9408 8.6009 111.5427 45.2237 0.0000 173.9023 66 R 4.5083 7.6003 117.2166 56.6679 32.9959 175.8940 67 F 5.5478 8.0835 116.0902 56.0914 41.4880 175.9347 68 T 4.7743 8.7906 118.2669 61.9706 72.0379 172.7420 69 I 5.0556 9.0675 127.5334 60.0030 39.8643 174.4913 70 S 4.9368 8.9538 122.0444 57.7283 66.9296 172.5455 71 R 5.1310 8.4763 114.8905 54.8642 32.6917 174.4378 72 D 4.7954 9.2062 120.6954 52.6248 42.9852 176.0737 73 N 4.2943 8.9784 124.5582 56.2458 38.9404 177.7490 74 A 4.0144 8.1569 119.5895 54.7122 18.5371 178.0296 75 K 4.3044 8.2299 112.4173 55.6714 32.8589 176.1189 76 N 4.1808 7.9397 116.6086 54.7352 36.9029 173.7379 77 T 4.9679 7.8077 112.3932 61.7098 73.2688 174.4976 78 V 4.7292 8.4719 124.6241 61.3323 34.6672 173.9564 79 Y 5.4556 9.1182 123.8038 56.1803 42.1759 174.6835 80 L 4.6199 8.4714 122.9063 53.2480 44.9101 175.1917 81 Q 4.2428 9.0883 130.0013 55.5208 30.3628 174.5158 82 M 3.9481 8.6997 128.2622 53.7903 33.2881 175.2929 83 N 4.9843 8.8839 121.2983 50.9389 41.4676 174.9317 84 S 3.8379 8.4606 113.4302 59.5468 60.7349 173.3561 85 L 4.4049 8.0227 119.4933 55.1642 42.3987 177.1052 86 Q 4.8588 9.3475 122.9195 54.2410 33.0491 177.1040 87 R 3.9375 8.8420 119.1340 60.3522 29.2500 178.2456 88 E 4.2174 8.1657 112.4689 58.3022 29.7863 179.5844 89 D 4.9043 8.1430 115.3365 55.7150 41.4469 176.9354 90 T 4.3231 7.9719 117.4714 62.6589 69.2442 174.3760 91 G 4.1096 8.4308 113.2835 46.4548 0.0000 170.4456 92 M 4.8766 8.4741 120.8461 54.9082 33.4243 174.3736 93 Y 5.1507 9.2835 124.9371 56.9842 40.3046 174.3683 94 Y 5.6623 9.8287 121.7660 56.4652 41.8273 172.4919 95 C 4.8783 9.0647 117.3266 54.1070 39.9392 172.2184 96 Q 4.7578 8.3735 119.8175 54.7638 32.5928 173.0655 97 I 5.0484 8.4049 118.7830 59.7573 41.5249 174.6494 98 Q 5.0430 9.0079 124.3699 54.2323 31.4605 173.3313 99 C 5.4430 9.6158 121.5207 54.8306 44.8776 172.8947 100 G 4.2882 8.0746 106.2332 45.0117 0.0000 172.9938 101 V 4.1310 8.1272 117.4907 65.1688 33.1767 177.5426 102 R 4.0622 7.6372 117.5074 57.6319 30.0018 178.2536 103 S 4.8211 7.8189 114.0923 56.8476 65.1879 173.6074 104 I 4.8194 7.9639 123.5583 59.0380 38.1258 176.0971 105 R 4.5680 8.8043 121.2418 54.7163 33.6210 174.1899 106 E 5.1329 8.5223 123.8066 54.6318 32.8511 174.4476 107 Y 4.8768 8.6260 121.6946 56.1350 42.6554 174.0450 108 W 4.9902 8.9083 122.4251 54.6009 31.9472 175.9026 109 G 4.1545 9.1379 112.4981 45.7919 0.0000 173.5367 110 Q 4.3485 8.8459 116.9094 56.7992 29.2836 177.0077 111 G 3.4170 9.2520 105.5549 45.9287 0.0000 172.5187 112 T 4.6406 8.4641 115.7825 60.0273 71.2444 172.6200 113 Q 4.4751 8.7664 129.8636 55.9807 30.8121 174.4637 114 V 4.8243 8.9084 125.5676 61.4977 34.6163 174.0862 115 T 4.8221 8.8074 124.8156 61.7498 71.4839 173.1498 116 V 4.7913 8.5125 127.7537 61.7700 32.9085 175.7142 117 S 4.3790 8.9073 122.7757 58.0418 62.2139 174.2755 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 V 8.15 4.21 0.75 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 0.36 0.00 0.00 0.65 0.00 0.00 3 Q 8.73 4.48 0.00 1.71 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.62 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 4 L 8.73 5.11 0.00 1.60 1.51 0.78 0.66 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 5 V 8.57 4.45 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 1.08 0.00 0.00 0.94 0.00 0.00 6 E 8.77 5.76 0.00 2.09 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 2.32 2.13 0.00 7 S 8.65 4.55 0.00 3.88 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 8 G 8.61 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.99 3.91 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 0.00 0.00 0.00 10 G 7.65 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 11 S 7.93 5.34 0.00 3.75 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 12 V 8.74 4.57 2.03 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 0.81 0.00 0.00 0.89 0.00 0.00 13 Q 8.64 4.53 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.03 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 14 A 8.91 4.15 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 15 G 9.62 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 16 G 7.99 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 17 S 8.25 5.31 0.00 3.78 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 18 L 8.49 4.59 0.00 1.32 1.33 0.76 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.39 4.78 0.00 1.72 1.66 0.00 2.80 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 20 L 8.42 4.75 0.00 0.82 1.41 0.44 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.26 5.32 0.00 3.83 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 22 C 9.38 5.23 0.00 2.61 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 23 A 8.88 4.68 1.27 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 24 V 8.49 4.55 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 0.66 0.00 0.00 0.81 0.00 0.00 25 S 9.41 4.61 0.00 3.83 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 26 G 9.91 3.98 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 0.00 0.00 0.00 27 S 7.85 4.59 0.00 3.75 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 28 T 8.12 4.45 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 1.16 0.00 0.00 *29 Y 8.35 4.46 0.00 2.36 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 0.00 0.00 0.00 30 S 7.68 4.75 0.00 3.78 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 31 P 0.00 4.59 0.00 2.12 2.17 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 32 C 8.55 5.52 0.00 2.79 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 33 T 8.89 4.77 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 1.28 0.00 0.00 34 T 9.09 4.89 4.21 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 1.01 0.00 0.00 35 G 9.31 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.27 5.47 0.00 3.20 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 37 Y 9.98 5.44 0.00 3.32 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 38 R 9.23 5.11 0.00 0.94 0.94 0.00 2.52 0.00 0.00 2.92 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.44 0.00 39 Q 9.12 4.93 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 40 A 8.71 4.61 1.28 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 0.00 0.00 41 P 0.00 4.31 0.00 2.08 2.06 0.00 3.80 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 2.07 2.14 0.00 42 G 9.00 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 43 K 7.77 4.72 0.00 1.87 1.78 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.50 7.81 44 E 8.40 4.36 0.00 1.99 1.96 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 2.31 2.29 0.00 45 R 8.48 4.59 0.00 1.76 1.83 0.00 2.71 0.00 0.00 2.69 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 46 E 9.40 4.93 0.00 2.13 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 2.38 2.27 0.00 47 W 8.96 4.27 0.00 3.40 3.26 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 48 V 7.60 3.81 2.10 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 1.13 0.00 0.00 0.92 0.00 0.00 49 S 6.56 4.45 0.00 3.89 3.70 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 50 S 8.84 5.39 0.00 4.22 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 51 I 9.04 5.12 1.90 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 1.29 1.58 0.96 0.00 0.00 52 S 9.04 4.78 0.00 4.01 3.37 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 53 S 9.14 4.35 0.00 4.03 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 54 P 0.00 4.39 0.00 2.06 2.06 0.00 3.76 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 2.03 2.10 0.00 55 G 8.83 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 56 T 7.63 4.17 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 1.19 0.00 0.00 57 I 7.40 4.84 1.72 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 0.50 0.51 0.00 0.00 58 Y 8.42 5.07 0.00 3.31 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 59 Y 8.68 4.99 0.00 2.81 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 60 Q 8.46 4.22 0.00 1.88 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 61 D 9.18 4.45 0.00 2.78 2.73 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 62 S 8.05 4.21 0.00 3.89 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 63 V 7.53 3.78 0.67 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 0.08 0.00 0.00 0.77 0.00 0.00 64 K 7.42 3.83 0.00 1.79 1.67 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.55 1.60 7.81 65 G 8.60 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 66 R 7.60 4.51 0.00 1.74 2.26 0.00 3.24 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 67 F 8.08 5.55 0.00 2.67 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 68 T 8.79 4.77 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 1.29 0.00 0.00 69 I 9.07 5.06 2.02 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.29 0.86 0.00 0.00 70 S 8.95 4.94 0.00 4.02 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 71 R 8.48 5.13 0.00 1.79 1.92 0.00 2.99 0.00 0.00 3.34 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 72 D 9.21 4.80 0.00 2.99 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 73 N 8.98 4.29 0.00 2.81 2.86 0.00 0.00 6.93 7.47 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 74 A 8.16 4.01 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 75 K 8.23 4.30 0.00 1.84 1.88 0.00 2.10 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.64 7.81 76 N 7.94 4.18 0.00 2.83 2.86 0.00 0.00 6.72 6.92 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 77 T 7.81 4.97 4.01 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 0.66 0.00 0.00 78 V 8.47 4.73 2.03 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 1.33 0.00 0.00 0.90 0.00 0.00 79 Y 9.12 5.46 0.00 2.93 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 80 L 8.47 4.62 0.00 0.27 0.23 0.83 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.09 4.24 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.54 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 82 M 8.70 3.95 0.00 0.95 1.49 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.81 0.00 83 N 8.88 4.98 0.00 2.79 2.72 0.00 0.00 7.22 7.13 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 84 S 8.46 3.84 0.00 3.97 3.89 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 85 L 8.02 4.40 0.00 1.80 1.61 0.82 1.00 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 86 Q 9.35 4.86 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 87 R 8.84 3.94 0.00 1.73 1.96 0.00 3.25 0.00 0.00 3.37 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.22 0.00 88 E 8.17 4.22 0.00 1.98 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 2.23 1.90 0.00 89 D 8.14 4.90 0.00 2.91 3.06 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 90 T 7.97 4.32 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 1.27 0.00 0.00 91 G 8.43 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 92 M 8.47 4.88 0.00 2.26 2.02 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 2.06 2.48 0.00 93 Y 9.28 5.15 0.00 3.17 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 94 Y 9.83 5.66 0.00 3.34 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 95 C 9.06 4.88 0.00 2.05 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 96 Q 8.37 4.76 0.00 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 1.28 1.16 0.00 97 I 8.40 5.05 1.82 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.66 0.77 0.00 0.00 98 Q 9.01 5.04 0.00 1.71 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 99 C 9.62 5.44 0.00 2.89 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 0.00 100 G 8.07 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 0.00 0.00 0.00 0.00 101 V 8.13 4.13 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 0.83 0.00 0.00 0.93 0.00 0.00 102 R 7.64 4.06 0.00 1.87 1.76 0.00 3.27 0.00 0.00 3.15 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 103 S 7.82 4.82 0.00 3.81 3.70 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 0.00 104 I 7.96 4.82 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.90 0.91 0.00 0.00 105 R 8.80 4.57 0.00 1.91 1.71 0.00 3.14 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.41 0.00 106 E 8.52 5.13 0.00 1.86 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 1.93 2.35 0.00 107 Y 8.63 4.88 0.00 2.84 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 0.00 108 W 8.91 4.99 0.00 3.12 3.14 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 0.00 109 G 9.14 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 0.00 0.00 0.00 0.00 110 Q 8.85 4.35 0.00 2.26 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 111 G 9.25 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.46 4.64 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 1.37 0.00 0.00 113 Q 8.77 4.48 0.00 2.25 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.62 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 114 V 8.91 4.82 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 0.85 0.00 0.00 0.53 0.00 0.00 115 T 8.81 4.82 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 0.00 116 V 8.51 4.79 2.18 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 0.80 0.00 0.00 0.98 0.00 0.00 117 S 8.91 4.38 0.00 3.88 3.81 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.