NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.9011 8.2833 118.1635 52.1964 38.9090 175.0303 2 L 3.9215 8.1659 118.0050 57.0724 41.3508 177.8304 3 Y 3.9428 8.8932 120.4076 61.0253 39.0043 178.0741 4 Q 3.8629 8.7088 119.0246 58.7749 28.7386 178.4480 5 F 4.3075 8.4149 121.8671 60.9928 39.4030 176.6844 6 K 3.4340 8.1148 119.7147 59.9286 31.9191 178.4166 7 N 4.2319 7.7135 116.1526 56.2659 38.4179 177.3808 8 M 4.0988 8.1508 120.4164 58.4589 32.0278 178.8407 9 I 3.4711 7.4004 119.7566 64.5023 37.0383 178.4783 10 Q 4.0613 7.6943 117.4972 59.0859 28.5125 178.0536 11 C 4.4212 7.8854 118.9569 59.4022 43.8310 174.9479 12 T 4.1305 7.6770 109.3552 61.8875 69.2672 175.1148 13 V 4.4640 8.1930 121.4283 60.4307 31.1658 173.9397 14 P 4.5758 0.0000 0.0000 64.6628 32.4551 178.9007 15 S 4.0702 7.5978 112.8203 60.8171 63.0950 174.4547 *17 R 4.8969 7.5031 114.4690 55.4291 30.4373 174.9799 18 S 4.3870 8.0196 113.1726 57.6845 63.3059 175.1819 19 W 4.5356 8.9539 122.4435 59.6197 27.9285 178.2991 20 A 3.3150 6.9535 120.9069 54.5377 17.4244 179.0151 21 D 4.1375 7.5315 116.4117 56.5913 40.7978 177.7726 22 F 4.7044 7.9196 115.3593 57.3073 40.0442 176.2457 23 A 4.5574 7.8659 121.2196 53.3488 19.1986 176.9626 24 D 4.8025 7.5511 113.5127 53.3583 42.9025 172.2112 25 Y 4.6195 8.5107 122.7727 56.1389 42.7537 175.9734 26 G 3.9068 7.9109 115.8551 46.5570 0.0000 172.5621 27 C 4.3774 9.4775 114.9801 58.1956 40.8348 174.8220 28 Y 4.6352 8.4765 115.2781 57.5280 39.9778 175.2075 29 C 4.6865 8.4405 118.1497 59.0668 41.0065 171.8126 30 G 4.2921 8.8703 112.4611 44.7314 0.0000 173.1767 31 K 3.5223 8.3069 121.4097 60.1376 32.0901 176.7383 32 G 3.8035 7.8148 105.9706 46.3050 0.0000 172.8844 33 G 4.3672 7.8641 107.8699 43.1751 0.0000 171.8361 34 S 4.4176 7.1283 114.0588 58.6988 66.6809 177.3389 35 G 3.8007 8.4836 109.2364 45.2318 0.0000 172.1720 36 T 4.4078 8.3097 116.1043 61.6739 69.3371 173.0767 37 P 4.7642 0.0000 0.0000 62.9283 31.7957 177.1532 38 V 3.8413 8.8709 116.4231 63.5788 32.2752 175.0886 39 D 4.5661 7.4077 117.0099 51.8541 41.7711 175.4286 40 D 4.3777 8.6841 117.8776 57.6941 40.8058 178.4170 41 L 3.9271 7.9555 120.3755 58.2402 42.1049 178.2196 42 D 4.5607 8.9403 118.2847 57.6506 41.0822 178.5625 43 R 3.8505 8.1193 118.5138 59.2012 30.0439 178.1035 44 C 4.2787 8.3143 116.4482 60.6616 37.2239 175.8080 45 C 4.4791 8.3143 117.3182 59.8899 40.6689 175.9977 46 Q 3.5904 8.1972 121.4387 59.3288 28.4599 178.3679 47 T 3.7725 7.9312 116.7834 66.7807 68.4896 176.0033 48 H 3.9279 8.2546 119.9846 59.3131 29.8898 176.8387 49 D 4.2416 8.4449 120.9089 57.5914 40.7411 178.6337 50 N 4.3221 8.2811 116.8619 56.4627 38.5360 176.5163 51 C 4.2381 8.4049 120.0296 60.0124 44.4688 175.2789 52 Y 4.1488 8.0329 118.1790 61.2433 37.2031 178.3439 53 N 4.5701 8.0363 116.2950 56.3046 38.9302 176.9972 54 E 4.0980 8.3575 119.6573 59.5549 29.6427 179.3374 55 A 4.0141 8.1410 120.5581 55.1350 18.1641 179.2843 56 E 4.3352 8.0024 117.2181 58.4459 29.5253 178.7412 57 N 4.5258 7.9834 115.9949 54.5319 39.1068 175.4856 58 I 3.8810 7.3704 122.7828 60.3576 37.7891 175.3067 59 S 4.1774 8.7474 119.8083 60.0386 62.3209 174.0366 60 G 3.8004 8.8326 114.6685 46.2440 0.0000 173.1346 61 C 4.5488 8.1189 120.7431 54.9254 43.6839 172.9261 62 R 4.4726 8.1559 126.8034 53.3122 30.6395 174.1931 63 P 3.8754 0.0000 0.0000 65.1982 31.7246 178.4739 64 K 3.9805 7.7329 116.4737 57.9715 32.2315 178.1693 65 F 4.7176 7.6535 115.0168 57.2320 41.0153 175.7041 66 K 4.0276 8.1994 123.0001 56.4748 32.2173 176.0598 67 T 4.2412 8.4859 123.8583 62.7149 68.9236 173.7502 68 Y 4.7756 7.5607 124.5655 55.1735 40.7832 174.3815 69 S 5.0838 9.8653 115.0951 56.8378 64.2158 172.4555 70 Y 5.4457 8.5410 123.8432 56.0042 41.2539 173.4006 71 E 4.4554 9.6475 120.0919 54.5304 33.7502 173.6099 72 C 5.4579 8.5661 124.4283 55.4056 47.2189 173.0593 73 T 4.7111 8.8092 115.7588 61.4471 71.5555 173.5995 74 Q 3.5001 9.7376 120.3156 57.2702 26.3649 175.0017 75 G 3.9557 8.4943 102.5803 45.7892 0.0000 173.6605 76 T 4.5505 7.8845 116.6642 61.2261 71.0284 172.4307 77 L 5.2196 8.5168 127.7663 53.6607 44.1859 175.4480 78 T 4.7414 9.0248 122.6367 61.9720 72.4685 172.2634 79 C 5.0105 8.8065 123.3449 56.0961 41.3629 173.9332 80 K 4.3980 8.8325 123.7647 55.4623 32.4605 177.7381 81 G 3.7047 8.7360 109.8640 48.1237 0.0000 174.4978 82 D 4.7124 8.0158 118.5687 53.5083 39.6042 175.4277 83 N 4.7870 7.5574 117.3193 52.5773 39.8579 175.7212 84 N 4.6925 8.4875 120.5507 51.9738 39.9971 175.8656 85 A 3.9821 8.4604 121.3569 55.4439 18.2723 180.0860 86 C 4.0966 8.2310 116.0532 59.9404 41.4835 175.5125 87 A 3.9914 8.7979 122.4484 55.0631 17.9734 179.5016 88 A 3.8723 8.5217 119.6220 55.3397 18.4619 180.0408 89 S 3.9974 7.9489 113.6586 61.7147 62.8972 177.1690 90 V 3.4551 7.7790 120.8073 66.0826 31.2240 176.9597 91 C 2.7446 8.0790 118.5966 59.4486 44.3639 175.1857 92 D 4.1097 7.9352 119.3176 57.2830 40.8823 177.3623 93 C 4.1651 8.2007 117.1279 60.1843 40.7808 175.8525 94 D 3.9147 8.0203 120.1612 57.2486 40.4578 178.7694 95 R 3.7924 8.0135 119.3516 59.6265 30.1025 178.5581 96 L 3.9514 8.0166 118.4474 57.5717 41.4960 179.4694 97 A 3.7410 7.8026 120.3957 54.9423 18.1315 179.5456 98 A 3.4566 7.9561 119.4712 55.0811 18.1474 179.9824 99 I 3.6351 7.4479 117.5581 64.5341 37.2146 177.4619 100 C 4.4437 8.1049 119.3081 59.8169 39.0502 175.5676 101 F 4.3132 8.6695 119.5837 60.7519 38.2147 177.5706 102 A 4.1876 7.8529 119.6461 54.4098 18.2760 178.9319 103 G 3.8627 7.7568 101.1420 43.9492 0.0000 173.3668 104 A 4.7029 7.1636 124.5384 49.6261 20.5205 175.5800 105 P 4.3637 0.0000 0.0000 62.7243 32.0431 175.2580 106 Y 4.1851 8.5112 123.0350 55.7745 39.9140 174.3279 107 N 4.8706 8.4702 126.7642 51.6855 39.7395 174.6497 108 D 4.5174 8.9649 126.8863 57.4302 41.1873 179.2205 109 A 4.0153 8.3239 121.3202 54.8307 18.5122 177.8661 110 N 4.2949 8.0836 111.9856 53.4919 38.9476 174.3833 111 Y 4.1643 7.3885 120.4162 58.3255 39.6853 174.6151 112 N 4.1233 7.9858 124.6117 53.1188 37.8477 173.8044 113 I 3.8756 7.0543 109.2703 59.9785 39.3183 175.8001 114 D 4.4731 8.2120 120.7507 53.3733 40.1099 176.5522 115 L 3.9738 8.3039 127.5911 57.5110 42.0792 180.2167 116 K 3.9251 8.1347 116.7055 59.1444 32.2158 177.9942 117 A 4.2229 7.7433 119.3890 53.7405 18.7791 178.1231 118 R 4.5448 7.9546 112.0867 56.2856 31.7870 175.8169 119 C 4.9541 7.9464 115.7832 56.5136 40.9959 173.7031 120 N 4.5143 8.1746 122.1274 53.5165 38.3231 175.3916 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 N 8.28 4.90 0.00 3.06 3.15 0.00 0.00 6.14 5.79 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 2 L 8.17 3.92 0.00 1.71 1.77 1.10 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 8.89 3.94 0.00 2.99 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 4 Q 8.71 3.86 0.00 1.88 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 5 F 8.41 4.31 0.00 3.27 3.22 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 6 K 8.11 3.43 0.00 1.63 1.53 0.00 1.22 0.00 0.00 1.12 0.00 0.00 2.41 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.48 0.44 7.81 7 N 7.71 4.23 0.00 2.78 2.84 0.00 0.00 7.13 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 8 M 8.15 4.10 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 9 I 7.40 3.47 1.79 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.15 0.60 0.00 0.00 10 Q 7.69 4.06 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.98 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 11 C 7.89 4.42 0.00 3.14 3.35 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 12 T 7.68 4.13 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 1.26 0.00 0.00 13 V 8.19 4.46 2.14 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 1.17 0.00 0.00 0.92 0.00 0.00 14 P 0.00 4.58 0.00 2.23 2.26 0.00 3.84 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 1.99 1.96 0.00 15 S 7.60 4.07 0.00 3.98 4.17 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 *17 R 7.50 4.90 0.00 1.88 1.78 0.00 2.42 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.74 0.00 18 S 8.02 4.39 0.00 3.80 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 19 W 8.95 4.54 0.00 3.68 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 20 A 6.95 3.32 0.72 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 0.00 0.00 21 D 7.53 4.14 0.00 2.08 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 0.00 0.00 0.00 22 F 7.92 4.70 0.00 3.23 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 23 A 7.87 4.56 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 24 D 7.55 4.80 0.00 2.66 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 0.00 0.00 0.00 0.00 25 Y 8.51 4.62 0.00 3.02 2.67 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 0.00 0.00 0.00 0.00 26 G 7.91 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 27 C 9.48 4.38 0.00 2.89 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 28 Y 8.48 4.64 0.00 3.27 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 29 C 8.44 4.69 0.00 3.41 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 30 G 8.87 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 31 K 8.31 3.52 0.00 1.75 1.75 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.50 7.81 32 G 7.81 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 0.00 0.00 0.00 33 G 7.86 4.37 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 34 S 7.13 4.42 0.00 3.90 3.73 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 35 G 8.48 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 0.00 0.00 0.00 36 T 8.31 4.41 4.27 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 1.24 0.00 0.00 37 P 0.00 4.76 0.00 2.06 2.02 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 38 V 8.87 3.84 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 0.69 0.00 0.00 0.93 0.00 0.00 39 D 7.41 4.57 0.00 2.89 2.79 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 40 D 8.68 4.38 0.00 2.74 2.79 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 41 L 7.96 3.93 0.00 1.74 1.66 0.54 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.94 4.56 0.00 3.16 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 43 R 8.12 3.85 0.00 2.12 1.95 0.00 3.21 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.91 0.00 44 C 8.31 4.28 0.00 3.48 3.56 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 45 C 8.31 4.48 0.00 3.37 3.48 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 46 Q 8.20 3.59 0.00 1.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 47 T 7.93 3.77 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 1.18 0.00 0.00 48 H 8.25 3.93 0.00 3.19 3.41 0.00 5.60 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 49 D 8.44 4.24 0.00 2.91 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 50 N 8.28 4.32 0.00 2.86 2.86 0.00 0.00 6.71 7.50 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 51 C 8.40 4.24 0.00 3.09 3.20 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 52 Y 8.03 4.15 0.00 3.08 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 53 N 8.04 4.57 0.00 2.93 2.92 0.00 0.00 7.10 7.69 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 54 E 8.36 4.10 0.00 2.20 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 2.48 2.48 0.00 55 A 8.14 4.01 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 56 E 8.00 4.34 0.00 2.20 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 2.35 2.18 0.00 57 N 7.98 4.53 0.00 2.87 2.88 0.00 0.00 7.01 7.03 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 58 I 7.37 3.88 1.97 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 1.17 0.71 0.91 0.00 0.00 59 S 8.75 4.18 0.00 3.82 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 60 G 8.83 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 0.00 0.00 0.00 61 C 8.12 4.55 0.00 3.00 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 62 R 8.16 4.47 0.00 2.00 2.02 0.00 3.21 0.00 0.00 3.33 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 63 P 0.00 3.88 0.00 0.89 0.67 0.00 3.54 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 2.00 1.82 0.00 64 K 7.73 3.98 0.00 1.34 1.20 0.00 1.62 0.00 0.00 1.81 0.00 0.00 3.16 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.52 1.49 7.81 65 F 7.65 4.72 0.00 3.03 3.04 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 0.00 0.00 0.00 66 K 8.20 4.03 0.00 1.78 1.74 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.54 7.81 67 T 8.49 4.24 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 68 Y 7.56 4.78 0.00 3.20 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 69 S 9.87 5.08 0.00 3.95 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 70 Y 8.54 5.45 0.00 3.23 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 71 E 9.65 4.46 0.00 1.88 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 2.14 2.13 0.00 72 C 8.57 5.46 0.00 3.05 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 73 T 8.81 4.71 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 1.23 0.00 0.00 74 Q 9.74 3.50 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.98 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 75 G 8.49 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 76 T 7.88 4.55 4.37 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 1.22 0.00 0.00 77 L 8.52 5.22 0.00 1.63 1.55 1.14 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.02 4.74 4.27 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 1.22 0.00 0.00 79 C 8.81 5.01 0.00 2.82 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 80 K 8.83 4.40 0.00 1.76 1.84 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.43 7.81 81 G 8.74 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 0.00 0.00 0.00 82 D 8.02 4.71 0.00 2.82 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 83 N 7.56 4.79 0.00 2.75 2.90 0.00 0.00 6.88 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 84 N 8.49 4.69 0.00 3.00 2.99 0.00 0.00 6.14 7.39 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 85 A 8.46 3.98 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 86 C 8.23 4.10 0.00 3.00 3.27 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 87 A 8.80 3.99 1.45 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 0.00 0.00 0.00 88 A 8.52 3.87 1.36 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 0.00 0.00 89 S 7.95 4.00 0.00 3.99 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 90 V 7.78 3.46 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 1.02 0.00 0.00 0.79 0.00 0.00 91 C 8.08 2.74 0.00 2.37 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 92 D 7.94 4.11 0.00 2.92 2.66 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 93 C 8.20 4.17 0.00 3.25 3.10 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 0.00 0.00 0.00 0.00 94 D 8.02 3.91 0.00 2.67 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 95 R 8.01 3.79 0.00 1.82 1.96 0.00 3.20 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 96 L 8.02 3.95 0.00 1.65 1.64 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.80 3.74 0.94 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 98 A 7.96 3.46 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 99 I 7.45 3.64 2.03 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 1.38 0.59 0.90 0.00 0.00 100 C 8.10 4.44 0.00 3.19 3.32 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 0.00 101 F 8.67 4.31 0.00 2.95 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 0.00 102 A 7.85 4.19 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 0.00 103 G 7.76 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 0.00 104 A 7.16 4.70 1.32 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 0.00 0.00 0.00 105 P 0.00 4.36 0.00 2.09 2.04 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 106 Y 8.51 4.19 0.00 2.84 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 0.00 107 N 8.47 4.87 0.00 2.79 2.70 0.00 0.00 6.75 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 0.00 108 D 8.96 4.52 0.00 2.79 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 0.00 109 A 8.32 4.02 1.32 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 0.00 0.00 0.00 110 N 8.08 4.29 0.00 2.08 1.86 0.00 0.00 6.54 8.01 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 0.00 111 Y 7.39 4.16 0.00 2.98 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 0.00 112 N 7.99 4.12 0.00 1.93 2.43 0.00 0.00 7.19 8.78 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 0.00 113 I 7.05 3.88 1.75 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.57 0.73 0.00 0.00 114 D 8.21 4.47 0.00 2.64 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 0.00 115 L 8.30 3.97 0.00 1.68 1.62 0.86 0.72 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 0.00 116 K 8.13 3.93 0.00 1.71 1.85 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.40 7.81 117 A 7.74 4.22 1.26 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 0.00 118 R 7.95 4.54 0.00 1.86 1.90 0.00 3.07 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 119 C 7.95 4.95 0.00 3.00 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 0.00 120 N 8.17 4.51 0.00 2.69 2.70 0.00 0.00 7.00 7.56 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 * Residues marked with a * may have inaccurate shift predictions.