NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 R 4.2279 8.2549 119.6943 56.2570 31.5143 174.4311 6 H 4.6322 7.9658 116.0874 53.5085 32.0978 172.4679 7 F 4.9078 8.8557 121.3563 55.6717 43.5851 174.1325 8 V 4.6752 8.2687 121.9114 61.6176 35.3233 173.5941 9 H 5.4111 8.8145 124.2800 54.9584 33.0793 171.9535 10 Q 4.9192 9.0873 123.5244 54.8341 33.4310 173.5970 11 F 5.0852 8.0466 117.0379 58.5825 42.3512 173.3411 12 K 4.1082 7.7614 125.0336 54.1932 35.6129 175.0808 13 G 3.9769 8.2096 111.9309 44.5336 0.0000 172.0593 14 E 4.5810 8.6294 126.3464 54.2014 32.3960 174.7688 15 C 4.8785 8.2732 120.8216 55.3104 44.2065 172.8325 16 Y 4.5392 8.7164 122.9486 56.3262 39.4463 174.8622 17 F 5.2013 8.8728 123.0397 55.9454 41.3411 174.9088 18 T 4.5142 8.5253 120.7458 61.9970 71.2483 173.6703 19 N 4.2329 9.6312 124.3417 54.8644 38.4514 175.9379 20 G 4.1953 8.2322 112.8611 46.1599 0.0000 176.8750 21 T 4.2313 8.7379 117.0617 62.7621 69.5721 176.4526 22 Q 4.0038 8.1372 120.3074 58.4889 29.0194 176.8982 23 R 4.5306 8.0769 118.2953 55.1734 33.1769 173.7436 24 I 4.9928 8.4168 126.7546 59.4629 40.7208 175.0286 25 R 4.6731 8.8059 125.3313 54.4117 34.1217 173.6630 26 L 5.0687 8.6538 126.1031 53.5677 45.0199 175.6250 27 V 5.0237 8.2612 126.1002 61.3930 35.0188 174.9839 28 T 4.5219 8.0514 117.7257 63.1175 72.5567 172.9019 29 R 4.9433 8.4913 127.0544 54.5319 33.0653 174.7607 30 Y 4.8108 8.5359 122.4891 56.9682 39.6998 174.8603 31 I 4.7416 8.3864 124.9675 59.6026 40.8034 174.2148 32 Y 4.5445 9.3719 128.7160 58.9513 40.3998 176.2751 33 N 3.6399 8.2758 122.6399 54.4269 38.9347 175.1662 34 R 4.3549 9.1009 124.8409 56.4597 31.4635 173.5620 35 E 4.4759 8.5010 118.6646 54.7590 29.5224 174.9259 36 E 4.1947 8.7282 128.2027 56.4427 30.5142 175.8085 37 Y 4.9451 8.4344 121.9271 56.6503 40.6520 174.7769 38 L 5.0613 6.5669 120.1295 53.2519 46.3998 175.2521 39 R 5.4807 8.0576 116.7433 56.5094 34.4667 173.0364 40 F 4.4539 8.8548 129.4168 57.2563 41.3514 173.6044 41 D 5.0571 7.2436 125.1141 52.2703 43.2316 176.0449 42 S 4.1717 8.9513 122.1993 61.7108 63.2002 175.8084 43 D 4.4233 7.9173 120.1170 57.2961 40.7783 177.9626 44 V 3.4972 7.6219 116.8640 65.5303 31.4541 177.0182 45 G 3.9116 9.5955 106.0515 44.7266 0.0000 171.9653 46 E 4.5503 6.8332 116.0527 55.2882 32.9859 173.8497 47 Y 4.6739 9.2178 118.6468 58.1765 38.9418 176.1413 48 R 4.7246 8.8741 121.2891 54.0994 34.0570 174.9109 49 A 4.5415 8.9741 125.7759 52.8177 18.7086 177.0399 50 V 4.5588 9.0759 117.2628 62.3695 34.0737 174.7958 51 T 4.7810 7.7757 108.7562 59.7250 71.8944 173.7755 52 E 4.1519 8.6603 120.8154 58.0563 29.9368 177.4212 53 L 3.9936 7.8225 120.6692 57.9027 41.9905 178.1007 54 G 4.3793 7.5634 106.6703 45.4864 0.0000 176.0365 55 R 3.7278 8.1743 120.8651 59.2485 30.9873 176.0311 56 H 4.9019 7.9420 113.4394 56.5910 29.2605 177.4162 57 S 4.3773 8.0329 117.5944 61.5819 62.8285 175.8880 58 A 4.1090 7.6963 123.1600 55.3053 17.9877 179.4223 59 E 3.9991 8.3243 116.4675 60.2660 29.5726 178.2889 60 Y 4.0232 7.7651 118.3121 60.7575 38.5649 177.3518 61 Y 4.0210 8.5046 118.4139 61.4222 38.1744 178.6497 62 N 4.7898 8.2057 116.1714 56.1491 38.7481 177.0744 63 K 3.9824 7.8551 119.9489 59.6543 32.5010 178.4877 64 Q 3.5828 7.9523 118.1925 58.2928 28.9051 177.5343 *66 Y 5.1708 7.5442 114.3708 57.9431 40.0447 176.3167 *68 L 4.6190 7.6579 121.3725 55.1597 44.2143 178.2659 69 E 3.9938 8.2278 118.4281 59.3470 29.7217 178.6069 70 R 3.8833 7.9849 118.2608 59.6857 30.4151 178.1623 71 T 3.7261 7.8392 115.1065 66.9080 68.2092 176.6764 72 R 3.8850 7.5746 118.4341 58.9574 30.2825 178.4062 73 A 4.2793 7.5573 119.5257 54.0136 18.8334 178.9744 74 E 4.3389 7.9318 118.8156 58.7104 29.4165 179.3090 75 L 3.9773 7.4494 118.3310 57.4891 41.4776 177.7939 76 D 4.7895 8.9070 117.8951 54.6567 41.8173 177.6718 77 T 4.4915 7.8837 108.5323 61.5385 69.8050 175.2946 78 A 4.3731 7.9854 122.8289 53.7235 20.6927 176.9514 79 C 4.6465 7.7697 113.5404 58.7563 40.4626 175.7210 80 R 4.0266 8.6463 120.1105 60.2815 29.8701 178.1784 81 H 4.1524 7.7985 114.1498 59.4632 29.8569 176.6057 82 N 4.2247 8.2859 118.1502 56.8599 38.3030 176.4343 83 Y 3.7879 8.2049 120.4993 60.8517 38.6398 177.9774 84 E 3.9169 8.4355 119.1500 58.7308 29.7292 178.3964 85 E 4.5133 8.3431 116.9537 56.4439 31.1492 176.8964 86 T 4.4464 7.6306 105.8970 61.7111 71.3275 174.8936 87 E 4.1192 8.4395 121.8548 58.5277 30.2296 178.5411 88 V 3.2340 7.6108 117.6776 65.4597 31.3689 175.1226 89 P 4.4951 0.0000 0.0000 63.2351 30.9534 175.5486 90 T 4.3663 7.2160 106.3676 63.3091 71.5097 176.6512 91 S 3.9186 7.8461 117.7526 60.7424 63.3395 177.0189 92 L 4.1439 7.7983 118.1021 57.5257 41.5574 178.6686 93 R 3.9586 7.3571 118.1054 58.6347 30.1982 176.8192 94 R 3.9941 7.6622 118.7312 56.2070 30.2316 175.5690 94A L 5.1237 8.4852 124.5345 53.1262 45.0064 175.3719 95 E 4.8798 9.4694 123.5531 54.5980 32.1843 175.7984 96 Q 4.7857 8.5843 122.4230 54.0658 30.1289 174.1196 97 P 4.9577 0.0000 0.0000 62.3004 32.5918 176.4201 98 N 4.9724 8.7948 118.0113 51.5270 38.1584 173.1604 99 V 4.2317 7.7670 119.1495 62.7231 32.7352 175.6014 100 A 4.4838 9.0905 131.2144 50.7802 21.5234 174.9672 101 I 3.8743 8.4536 122.6582 62.5155 37.8337 176.1779 102 S 5.0822 8.2836 122.2715 57.5063 65.4376 172.2197 103 L 4.6083 8.5797 118.7476 53.7537 44.7845 176.4400 104 S 4.1877 9.1347 122.4320 58.2649 63.4611 175.6247 105 R 3.6529 8.2833 117.0288 57.8184 29.6544 175.7765 *112 H 4.6096 7.8278 114.4069 55.4902 29.2961 172.6010 113 N 4.8883 9.0652 123.8630 52.4116 41.9337 173.8823 114 T 4.7194 7.8922 114.6008 61.8823 72.4278 175.0632 115 L 3.9975 7.5762 130.0768 52.6172 39.6104 176.6209 116 V 3.4797 7.5113 119.3026 63.9910 33.1497 175.8476 117 C 5.1097 8.6974 128.7793 54.8698 43.5997 172.6078 118 S 4.5460 8.4747 122.1522 58.4002 64.2655 173.8823 119 V 4.6772 8.8317 123.0928 61.4706 33.3467 174.1520 120 T 4.9178 8.3615 116.6357 59.7283 72.1542 172.9379 121 D 4.5612 8.9672 121.4511 55.0966 38.2746 172.3152 122 F 5.2173 7.1841 115.7417 55.6308 42.9630 173.7419 123 Y 4.9842 8.3732 116.2448 56.1126 41.5211 172.5573 124 P 3.7022 0.0000 0.0000 62.8222 33.2934 176.3412 125 A 4.3706 8.5719 120.2872 52.0651 19.8488 177.1840 126 K 4.0151 7.8368 118.0686 56.3019 32.6397 175.4008 127 I 4.4818 7.8563 124.5458 60.8241 41.4893 173.3921 128 K 4.3269 8.6482 123.6907 55.4328 36.3261 175.7698 129 V 4.5150 8.3651 126.1234 61.0254 31.4455 174.8078 130 R 4.3899 8.9524 125.0615 54.5267 32.6353 175.0101 131 W 5.1961 8.2230 119.8711 55.1536 32.4303 174.8918 132 F 5.5786 9.6324 120.2435 56.0788 43.5934 174.2611 133 R 4.9446 9.3366 121.7129 54.6920 32.2279 174.6861 134 N 4.4512 9.9660 126.6054 54.3168 36.6065 175.9669 135 G 3.8428 8.7631 103.4033 45.5093 0.0000 173.6461 136 Q 4.8124 7.8130 118.3081 53.5252 31.2733 174.9078 137 E 4.4484 9.0269 123.1795 55.9817 30.4970 175.5279 138 E 4.7615 8.3762 124.1886 54.8666 32.1541 176.0825 139 T 4.4897 8.5236 111.0168 61.0355 70.3697 173.7634 140 V 4.1861 7.5424 122.6119 62.3148 33.4038 176.1896 141 G 3.9408 8.8157 117.1930 46.0419 0.0000 173.2092 142 V 3.4787 7.6352 119.6167 63.5461 31.2251 176.0900 143 S 4.6480 8.4169 123.6493 57.8386 64.8548 171.7178 144 S 5.0860 8.1948 115.0535 57.8698 65.1618 172.7767 145 T 4.7562 7.7447 112.3735 59.3702 71.5602 173.9754 146 Q 4.0558 8.7461 121.3439 55.6667 29.3174 175.6746 147 L 3.6738 7.9487 123.2357 53.9565 42.7613 175.9955 148 I 4.3261 8.7692 128.1494 59.8762 38.8639 174.9142 149 R 4.7141 8.6226 128.7657 55.6372 29.8349 175.9429 150 N 4.4169 8.8062 125.7424 54.7302 38.9588 175.3084 151 G 4.0938 8.2518 104.8764 45.7296 0.0000 173.0768 152 D 4.7114 7.7939 118.5760 53.6412 39.9107 176.8391 153 W 3.4568 8.0551 115.2528 58.6966 26.8980 174.0966 154 T 4.7951 7.0774 107.1085 60.0740 72.1897 172.5385 155 F 5.6671 8.0022 120.6342 55.3983 43.0483 173.8770 156 Q 5.5635 8.4153 114.2598 56.7566 30.9383 173.2121 157 V 4.7198 8.1120 118.2475 60.8412 35.1808 172.2016 158 L 4.8581 8.5776 123.1734 53.3132 44.1906 175.7199 159 V 4.5728 8.1870 125.0779 60.9317 31.7778 175.1152 160 M 4.3235 8.0957 126.9216 55.7179 33.4063 175.4390 161 L 3.8985 7.6570 115.1411 54.4664 44.2301 172.6737 162 E 4.5390 8.5965 128.2311 56.2231 30.4123 175.3505 163 M 4.6761 9.0251 123.5790 54.9124 35.2688 173.0834 164 T 4.9177 8.4137 109.4825 59.2295 71.1988 172.0896 165 P 4.7806 0.0000 0.0000 61.4681 32.1724 174.5725 166 H 4.6425 8.3078 121.2278 54.3431 29.7680 174.8726 167 Q 4.0227 8.6386 124.1487 58.2355 29.0569 177.2219 168 G 3.9560 8.8541 112.9290 45.2190 0.0000 173.2644 169 E 4.0058 7.6898 120.9612 55.8010 30.3758 175.8228 170 V 4.4200 8.2524 125.0720 60.2921 34.0494 174.4236 171 Y 5.7647 8.3288 120.3136 56.1753 42.3672 174.7369 172 T 5.2453 8.9904 115.7527 62.9576 73.5785 173.4012 173 C 4.0775 9.1636 127.5024 55.2530 44.5282 171.8622 174 H 4.9607 9.2237 128.3366 54.7549 31.2689 172.9998 175 V 4.7090 8.3214 126.6924 61.0287 33.9868 174.0573 176 E 4.9918 9.1381 127.2959 54.8551 32.2310 174.5964 177 H 5.0673 8.4720 122.4399 54.0531 33.4549 172.3401 178 P 4.3021 0.0000 0.0000 65.2726 31.6885 178.0273 179 S 4.3945 8.3834 111.4288 59.2033 63.4556 173.1824 180 L 4.9954 7.3920 122.1016 52.8409 43.5448 176.5272 181 K 4.0340 8.9760 123.7588 58.9514 32.2908 177.1727 182 S 4.6538 7.7458 112.7329 55.4558 63.5159 171.4036 183 P 4.3546 0.0000 0.0000 63.3309 31.8717 176.1986 184 I 4.2003 8.4124 124.4440 61.5356 38.5124 175.2198 185 T 5.6964 8.2034 114.5578 59.5595 71.8383 173.1106 186 V 4.5061 8.4502 124.2116 61.1933 34.6918 174.0602 187 E 5.9147 8.8590 126.1583 54.2743 32.5440 175.0968 188 W 5.1439 8.6600 129.9384 56.4322 34.4969 174.6404 189 S 4.4216 7.8970 120.5379 58.3870 62.5924 173.7101 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 5 R 8.25 4.23 0.00 1.80 1.46 0.00 3.24 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 6 H 7.97 4.63 0.00 2.98 3.08 0.00 5.83 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 7 F 8.86 4.91 0.00 3.03 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 8 V 8.27 4.68 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 0.94 0.00 0.00 0.93 0.00 0.00 9 H 8.81 5.41 0.00 3.33 3.19 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 9.09 4.92 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 11 F 8.05 5.09 0.00 2.79 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 12 K 7.76 4.11 0.00 1.57 1.42 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.27 1.25 7.81 13 G 8.21 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 14 E 8.63 4.58 0.00 1.72 1.15 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 2.03 2.05 0.00 15 C 8.27 4.88 0.00 2.67 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 0.00 0.00 0.00 16 Y 8.72 4.54 0.00 2.69 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 17 F 8.87 5.20 0.00 2.57 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 18 T 8.53 4.51 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 19 N 9.63 4.23 0.00 2.87 2.92 0.00 0.00 7.22 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 20 G 8.23 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 0.00 0.00 0.00 21 T 8.74 4.23 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 1.43 0.00 0.00 22 Q 8.14 4.00 0.00 2.08 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 23 R 8.08 4.53 0.00 1.92 1.96 0.00 3.06 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 24 I 8.42 4.99 1.84 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.98 0.70 0.00 0.00 25 R 8.81 4.67 0.00 1.81 1.73 0.00 3.20 0.00 0.00 2.95 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 26 L 8.65 5.07 0.00 1.74 1.52 0.94 0.74 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 27 V 8.26 5.02 2.21 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 1.36 0.00 0.00 1.05 0.00 0.00 28 T 8.05 4.52 4.45 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 0.00 0.00 0.00 1.45 0.00 0.00 29 R 8.49 4.94 0.00 1.62 1.78 0.00 3.06 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.47 0.00 30 Y 8.54 4.81 0.00 2.39 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 31 I 8.39 4.74 1.93 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 1.11 0.97 1.05 0.00 0.00 32 Y 9.37 4.54 0.00 3.09 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 33 N 8.28 3.64 0.00 2.49 2.10 0.00 0.00 6.71 7.59 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 34 R 9.10 4.35 0.00 1.68 1.88 0.00 3.25 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 35 E 8.50 4.48 0.00 1.99 2.01 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 2.43 2.33 0.00 36 E 8.73 4.19 0.00 1.98 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 2.34 2.27 0.00 37 Y 8.43 4.95 0.00 3.14 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 L 6.57 5.06 0.00 1.53 1.09 0.95 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.06 5.48 0.00 2.24 1.74 0.00 3.17 0.00 0.00 3.18 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.36 0.00 40 F 8.85 4.45 0.00 2.59 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 41 D 7.24 5.06 0.00 2.51 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 0.00 0.00 0.00 0.00 42 S 8.95 4.17 0.00 4.14 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 0.00 43 D 7.92 4.42 0.00 2.68 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 44 V 7.62 3.50 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 0.66 0.00 0.00 0.83 0.00 0.00 45 G 9.60 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 46 E 6.83 4.55 0.00 2.24 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 0.00 2.19 2.25 0.00 47 Y 9.22 4.67 0.00 3.20 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 48 R 8.87 4.72 0.00 1.70 1.79 0.00 3.30 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 49 A 8.97 4.54 1.32 0.00 0.00 0.00 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131 W 8.22 5.20 0.00 3.12 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 0.00 132 F 9.63 5.58 0.00 3.22 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 0.00 133 R 9.34 4.94 0.00 2.00 1.93 0.00 3.53 0.00 0.00 3.59 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 134 N 9.97 4.45 0.00 2.94 2.89 0.00 0.00 7.07 7.17 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 0.00 135 G 8.76 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 0.00 0.00 0.00 0.00 136 Q 7.81 4.81 0.00 2.47 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.94 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 137 E 9.03 4.45 0.00 2.20 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 0.00 2.18 1.91 0.00 138 E 8.38 4.76 0.00 1.99 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 2.29 2.40 0.00 139 T 8.52 4.49 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 0.00 140 V 7.54 4.19 2.05 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 1.05 0.00 0.00 0.92 0.00 0.00 141 G 8.82 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 0.00 142 V 7.64 3.48 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 0.94 0.00 0.00 0.99 0.00 0.00 143 S 8.42 4.65 0.00 3.92 3.71 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 0.00 144 S 8.19 5.09 0.00 3.89 3.68 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 0.00 145 T 7.74 4.76 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 0.00 146 Q 8.75 4.06 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 147 L 7.95 3.67 0.00 1.52 1.37 0.71 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 148 I 8.77 4.33 2.13 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 1.14 1.38 0.95 0.00 0.00 149 R 8.62 4.71 0.00 1.99 1.91 0.00 3.24 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 150 N 8.81 4.42 0.00 2.92 2.93 0.00 0.00 7.35 7.14 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 0.00 151 G 8.25 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 0.00 152 D 7.79 4.71 0.00 2.93 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 0.00 153 W 8.06 3.46 0.00 3.17 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 0.00 154 T 7.08 4.80 4.18 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 1.27 0.00 0.00 155 F 8.00 5.67 0.00 1.51 2.17 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 0.00 156 Q 8.42 5.56 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 157 V 8.11 4.72 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 0.66 0.00 0.00 0.98 0.00 0.00 158 L 8.58 4.86 0.00 1.65 1.62 0.94 0.57 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 0.00 159 V 8.19 4.57 2.01 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 1.09 0.00 0.00 0.86 0.00 0.00 160 M 8.10 4.32 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 161 L 7.66 3.90 0.00 0.32 0.29 0.49 -0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.60 4.54 0.00 1.89 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 2.22 2.44 0.00 163 M 9.03 4.68 0.00 1.85 2.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.79 0.00 164 T 8.41 4.92 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 1.23 0.00 0.00 165 P 0.00 4.78 0.00 2.35 2.45 0.00 3.53 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 166 H 8.31 4.64 0.00 3.23 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Q 8.64 4.02 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 168 G 8.85 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 0.00 169 E 7.69 4.01 0.00 2.05 1.63 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 1.96 2.14 0.00 170 V 8.25 4.42 2.05 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 0.74 0.00 0.00 1.01 0.00 0.00 171 Y 8.33 5.76 0.00 3.27 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 0.00 172 T 8.99 5.25 4.66 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 0.00 0.00 0.00 1.41 0.00 0.00 173 C 9.16 4.08 0.00 2.36 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 0.00 174 H 9.22 4.96 0.00 3.59 3.43 0.00 5.79 0.00 0.00 0.00 0.00 6.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 8.32 4.71 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 0.70 0.00 0.00 0.73 0.00 0.00 176 E 9.14 4.99 0.00 1.82 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 2.18 2.06 0.00 177 H 8.47 5.07 0.00 3.02 3.02 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.30 0.00 2.07 2.08 0.00 2.89 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 1.90 1.99 0.00 179 S 8.38 4.39 0.00 4.09 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 0.00 180 L 7.39 5.00 0.00 1.57 1.73 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 181 K 8.98 4.03 0.00 1.73 1.87 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.50 7.81 182 S 7.75 4.65 0.00 3.81 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 0.00 183 P 0.00 4.35 0.00 2.02 1.91 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 184 I 8.41 4.20 1.79 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 1.26 0.78 0.86 0.00 0.00 185 T 8.20 5.70 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 1.31 0.00 0.00 186 V 8.45 4.51 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 1.17 0.00 0.00 0.99 0.00 0.00 187 E 8.86 5.91 0.00 1.96 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 2.54 2.21 0.00 188 W 8.66 5.14 0.00 3.57 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 0.00 189 S 7.90 4.42 0.00 3.82 3.66 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.