NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 P 4.5064 0.0000 0.0000 62.8999 32.6432 176.0530 11 S 4.9741 8.4895 111.8900 58.4244 67.5181 174.2767 12 F 3.0702 9.1993 124.6769 60.6413 39.7009 174.4058 13 P 3.6488 0.0000 0.0000 62.5804 29.9725 175.2324 14 Y 4.1523 6.5241 119.8693 57.8974 36.3828 175.7188 15 G 4.0967 7.9644 109.0931 44.6658 0.0000 171.8896 16 S 4.6298 7.4831 113.6346 55.2859 67.0987 172.2086 17 P 4.1431 0.0000 0.0000 65.8869 30.8873 179.0827 18 G 3.9681 7.8693 104.4362 48.0949 0.0000 174.9462 19 E 4.1324 7.8928 119.9864 58.9857 29.8299 178.4159 20 L 3.1064 7.6609 120.4218 58.1502 41.8126 178.3088 21 N 4.8260 8.1812 112.1024 54.0070 38.4220 175.5929 22 S 4.6047 7.5356 115.1319 57.9495 64.1531 173.6010 23 F 4.7670 8.3679 125.3509 56.7877 39.3111 175.7152 24 L 3.8437 8.6999 130.6667 58.0710 41.8780 176.8919 25 P 4.3202 0.0000 0.0000 64.3706 31.2339 177.7534 26 Y 4.1440 7.5623 119.4875 60.1096 38.7671 177.1832 27 L 3.6247 7.7717 119.3324 57.8924 41.8014 179.0331 28 L 3.8356 8.1527 119.1089 58.3196 41.5044 180.0262 29 T 3.8912 7.2962 114.3989 66.4665 68.6639 177.3559 30 R 3.7876 7.5300 119.8800 59.2644 29.9952 179.3215 31 I 3.7412 7.9323 119.8961 64.5485 36.9772 178.4630 32 T 3.8714 7.6138 116.3673 67.0121 68.2860 176.0086 33 H 4.1437 8.1753 119.8753 59.2454 29.8804 177.1677 34 I 3.6160 7.6137 121.1090 64.1726 37.0596 178.1747 35 W 4.0297 8.0239 128.7696 60.5917 30.5853 178.1720 36 S 4.0718 7.9576 114.3892 60.9788 62.6035 176.5266 37 S 3.9972 7.7478 117.7573 61.1444 62.8304 176.3107 38 E 3.7170 7.7882 122.1356 58.9827 29.1366 179.3722 39 L 3.2260 7.0047 118.5569 57.1876 41.5633 178.5048 40 N 4.0578 7.8118 117.1754 57.2554 38.6583 176.1024 41 Q 3.9210 7.9818 120.2891 58.7058 28.8975 177.6206 42 A 4.0486 8.1558 122.2163 55.3944 18.8438 178.8793 43 L 4.3621 8.2580 115.0032 54.9616 41.6591 178.6981 44 A 4.0232 8.1278 124.2559 55.0148 17.9518 180.3401 45 S 4.1207 7.9302 111.0992 61.0670 63.5920 174.9045 46 E 4.1655 8.2209 118.1901 55.7088 29.6050 176.5347 47 K 3.8436 7.2256 118.2377 58.0199 30.2504 176.6050 48 L 4.7103 7.1711 116.3582 52.0253 42.4681 175.3312 49 P 4.6430 0.0000 0.0000 61.4067 32.5582 177.7804 50 T 3.8762 8.6360 110.4691 64.5089 68.6722 174.1780 51 P 4.2274 0.0000 0.0000 65.4794 31.3111 178.3253 52 K 3.9383 7.9377 116.4919 59.5842 32.1315 179.1611 53 L 3.9744 7.8035 120.1189 58.0676 42.0192 179.1073 54 R 3.9586 8.2014 118.2166 59.2323 30.0206 179.0796 55 L 3.9263 7.8125 118.2169 57.8663 41.6563 179.3560 56 L 3.9822 7.8160 118.8628 57.9244 41.6637 179.3788 57 S 4.1309 8.5624 113.2486 61.8919 62.2483 176.6679 58 S 4.3117 8.0667 117.5225 61.5028 62.5131 176.6234 59 L 4.0581 8.5224 122.1596 57.6645 41.1053 179.2966 60 S 4.0861 8.2809 112.3634 61.6880 62.4445 176.0079 61 A 4.1441 7.7902 121.1407 54.4289 18.2255 178.3541 62 Y 4.1797 8.4835 114.4076 60.1141 38.9967 175.9053 63 G 4.2778 8.6549 109.4556 45.5438 0.0000 173.8019 64 E 4.7534 7.6257 119.3129 55.2549 31.9890 174.3425 65 L 5.0762 8.2994 126.0057 52.7186 46.3193 176.7404 66 T 4.8328 8.7197 112.2896 60.7599 69.6046 175.3828 67 V 3.7560 8.6952 121.9344 64.9831 31.0173 178.5177 68 G 3.6422 7.9727 105.7942 47.5028 0.0000 175.7229 69 Q 4.2408 8.3765 120.2689 58.4837 28.8685 178.5378 70 L 3.9569 7.9177 119.8336 57.4172 41.3294 179.3183 71 A 4.1498 7.2686 120.8725 55.4040 18.7190 179.1993 72 T 3.8179 7.7843 113.5209 66.9096 68.3117 176.4169 73 L 3.8177 7.8296 121.5673 57.5202 41.9206 178.7950 74 G 3.8490 7.8498 104.0915 44.3359 0.0000 174.1284 75 V 3.1084 7.6064 111.6608 61.7543 29.1847 172.2284 *77 E 4.1212 7.6325 119.2582 55.8128 32.1443 176.1463 78 Q 4.2728 8.7476 122.0394 58.9103 28.6521 179.9211 79 S 4.1179 7.9159 114.8723 61.8304 63.5857 176.4622 80 T 3.8488 7.8327 119.6626 66.1901 68.0458 176.6892 81 T 3.8366 8.4171 118.0470 66.7552 68.3271 176.6851 82 S 4.1166 8.0547 115.0051 61.4027 62.3514 176.4648 83 R 4.0148 8.1379 120.8667 59.1679 29.7112 178.8712 84 T 3.8618 8.3035 115.9862 66.6797 68.4253 176.7178 85 V 3.5961 8.6274 121.1868 66.1937 31.0898 177.6918 86 D 4.4848 7.8170 118.1054 56.7437 40.6879 178.8192 87 Q 4.0533 7.9900 118.8448 58.9860 28.7079 178.6517 88 L 4.1335 7.6876 119.7944 57.6392 41.3938 179.6757 89 V 4.1978 7.4877 118.4164 64.8099 31.5200 176.9859 90 D 4.6695 7.4477 115.7433 55.3443 41.3789 177.6299 91 E 4.2737 8.5250 117.8492 55.9865 30.3926 175.9563 92 G 3.7415 8.3480 106.0344 46.6770 0.0000 173.7297 93 L 4.9916 8.5157 115.4689 53.8343 45.0069 177.0592 94 A 4.9359 7.7794 119.3586 51.2108 23.3147 175.0092 95 A 4.7202 8.6113 120.2129 50.5931 22.9717 175.9574 96 R 4.5219 8.7057 122.2290 56.0169 30.5138 175.7150 97 S 4.9133 8.9139 121.7859 57.6776 65.6964 172.7515 98 I 4.6030 8.1250 117.2499 59.6520 40.8147 175.4657 99 S 4.5222 8.0435 123.3935 58.1228 63.5079 174.1379 100 D 4.5678 8.3805 128.4880 54.3468 40.0266 176.0400 *103 Q 4.3145 7.3558 117.4028 55.2399 30.1203 177.4727 104 R 4.7112 8.1743 109.4480 56.5271 28.9444 176.0266 105 K 4.3869 7.7957 118.3435 55.7672 35.1608 177.3024 106 R 4.3285 8.7488 123.5528 56.8654 30.8886 175.5322 107 T 4.9786 8.3394 114.3608 59.8010 72.9973 172.9572 108 V 4.9231 8.3190 119.6975 61.7222 35.1753 174.1331 109 V 4.7043 8.4439 119.3506 59.1968 36.0132 174.8359 110 L 4.7623 8.4766 121.5562 55.1032 42.7266 177.2060 111 T 4.3998 8.0187 112.6934 60.5701 71.4642 175.8151 112 R 3.9138 8.5890 119.3759 59.4069 29.9212 179.1696 113 K 4.0812 8.0604 119.0973 59.2693 32.4206 178.9629 114 G 3.6135 8.3118 106.2106 47.7162 0.0000 175.7093 115 K 3.9807 8.3844 121.6022 59.3042 32.1495 179.7042 116 K 4.0735 8.1411 118.3700 58.8388 31.8239 179.5479 117 K 3.9176 8.1031 120.4035 59.6156 32.2864 178.9579 118 L 4.0199 7.8551 118.4653 57.4975 41.1948 179.5524 119 A 3.9831 7.5177 120.0962 55.2066 18.4686 179.0037 120 E 4.0219 8.4254 116.9590 59.4456 29.8819 178.7417 121 I 3.9864 7.9945 120.0948 63.7160 37.1443 178.1770 122 S 4.1598 7.9299 115.1096 61.2597 62.5925 174.9218 123 P 4.3515 0.0000 0.0000 64.8825 30.9974 178.4089 124 L 3.9112 8.2547 119.7747 58.1328 42.0919 178.9195 125 I 3.8936 7.7880 119.2299 64.7567 37.2175 178.1587 126 N 4.6968 8.7684 117.5789 56.1069 38.2214 177.4586 127 D 4.3072 8.1645 120.6180 57.4045 40.8655 178.5710 128 F 4.1347 8.6419 118.6435 60.9565 38.8836 177.3069 129 H 4.5702 9.2526 118.0850 59.2126 29.2309 177.0672 130 A 3.9489 8.5340 123.0320 55.2294 17.9891 179.0647 131 E 3.9527 8.2896 116.1027 59.8074 29.6993 179.0788 132 L 4.2636 8.2914 118.7733 57.9653 42.2390 179.1094 133 V 4.4846 7.5501 109.2781 60.8853 32.3655 177.6478 134 G 3.6973 7.9863 108.2077 48.2233 0.0000 175.0598 135 N 4.7571 7.8863 114.8742 52.1507 38.9484 175.4709 136 V 3.6954 7.5178 118.9138 62.1114 32.3680 175.6426 137 D 4.3320 8.8341 124.7202 54.8011 42.1014 176.0979 138 P 4.2604 0.0000 0.0000 65.1339 31.4113 178.1425 139 D 4.4616 8.7035 118.2752 56.5681 41.0626 178.7741 140 K 3.9644 8.1380 118.5995 59.3103 31.9606 178.9883 141 L 3.9164 8.1846 120.8256 57.9675 41.9703 178.4984 142 Q 3.9379 7.9338 119.3924 59.6091 28.9276 178.5727 143 T 3.8173 7.7951 116.4273 66.8709 68.5391 175.7355 144 C 3.9215 8.1703 120.5380 62.8720 31.4452 175.9422 145 I 3.6718 7.9823 121.2971 64.3584 36.6139 178.1575 146 E 3.9312 8.4294 119.8015 59.4517 29.3177 179.7292 147 V 3.5567 7.9135 118.0698 66.0950 31.5381 178.1045 148 L 4.2441 7.9565 118.8215 57.6832 41.4701 179.7559 149 G 3.5903 8.0338 105.7965 47.4530 0.0000 175.2359 150 E 3.9107 8.4929 121.9898 58.9402 29.4642 178.6355 151 I 3.6755 8.0910 119.9987 64.5451 37.6470 177.8284 152 L 4.0431 7.7436 120.7251 58.0704 42.0197 178.4862 153 K 3.9692 7.8716 119.7005 59.8749 31.9091 178.4966 154 G 3.7723 7.6576 104.0857 47.2816 0.0000 175.1318 155 K 4.2639 8.2828 120.0602 58.6806 32.6409 178.1534 156 T 4.4116 7.6980 114.2386 63.1347 70.2667 174.9028 157 D 4.5012 7.8619 115.7392 53.7839 39.3248 172.9325 158 Y 4.3017 7.6479 125.3439 58.6301 39.2488 173.6425 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 10 P 0.00 4.51 0.00 2.07 2.06 0.00 3.68 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 1.93 2.09 0.00 11 S 8.49 4.97 0.00 4.42 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 12 F 9.20 3.07 0.00 2.77 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 13 P 0.00 3.65 0.00 1.93 1.99 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.13 0.00 14 Y 6.52 4.15 0.00 2.63 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 15 G 7.96 4.10 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 0.00 0.00 0.00 16 S 7.48 4.63 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 17 P 0.00 4.14 0.00 2.14 2.05 0.00 3.60 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 18 G 7.87 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 19 E 7.89 4.13 0.00 2.21 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 0.00 2.44 2.37 0.00 20 L 7.66 3.11 0.00 1.61 1.11 0.45 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.18 4.83 0.00 2.65 2.94 0.00 0.00 6.93 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 22 S 7.54 4.60 0.00 3.96 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 23 F 8.37 4.77 0.00 2.22 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 24 L 8.70 3.84 0.00 1.74 1.52 0.89 0.92 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 25 P 0.00 4.32 0.00 1.50 1.84 0.00 2.20 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.83 0.00 26 Y 7.56 4.14 0.00 3.22 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 27 L 7.77 3.62 0.00 1.78 1.64 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.15 3.84 0.00 1.53 1.65 0.84 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 29 T 7.30 3.89 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 1.17 0.00 0.00 30 R 7.53 3.79 0.00 1.58 1.76 0.00 3.03 0.00 0.00 2.81 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.53 0.00 31 I 7.93 3.74 1.85 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 1.48 1.26 0.89 0.00 0.00 32 T 7.61 3.87 4.39 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 0.00 0.00 0.00 1.22 0.00 0.00 33 H 8.18 4.14 0.00 3.27 3.52 0.00 5.79 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 34 I 7.61 3.62 2.07 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 1.45 0.84 0.97 0.00 0.00 35 W 8.02 4.03 0.00 3.38 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 36 S 7.96 4.07 0.00 4.02 4.16 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 37 S 7.75 4.00 0.00 3.94 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 38 E 7.79 3.72 0.00 1.64 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 2.26 2.53 0.00 39 L 7.00 3.23 0.00 1.14 1.25 -1.33 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 40 N 7.81 4.06 0.00 2.82 2.75 0.00 0.00 6.90 6.35 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 41 Q 7.98 3.92 0.00 2.35 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.44 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 42 A 8.16 4.05 1.43 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 0.00 0.00 0.00 43 L 8.26 4.36 0.00 1.74 1.65 0.91 0.76 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 44 A 8.13 4.02 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 45 S 7.93 4.12 0.00 3.99 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 46 E 8.22 4.17 0.00 2.08 2.02 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 2.33 2.42 0.00 47 K 7.23 3.84 0.00 1.76 1.79 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.38 7.81 48 L 7.17 4.71 0.00 1.55 1.55 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.64 0.00 2.15 2.05 0.00 3.87 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 2.09 2.01 0.00 50 T 8.64 3.88 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 1.16 0.00 0.00 51 P 0.00 4.23 0.00 2.17 2.08 0.00 3.57 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 2.10 2.16 0.00 52 K 7.94 3.94 0.00 1.78 1.86 0.00 1.66 0.00 0.00 1.97 0.00 0.00 2.88 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.53 1.50 7.81 53 L 7.80 3.97 0.00 1.74 1.81 0.94 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.20 3.96 0.00 2.16 1.96 0.00 3.24 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 55 L 7.81 3.93 0.00 1.87 1.70 0.91 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.82 3.98 0.00 1.86 1.75 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.56 4.13 0.00 3.93 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 58 S 8.07 4.31 0.00 4.05 3.76 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 59 L 8.52 4.06 0.00 1.83 1.76 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.28 4.09 0.00 3.87 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 61 A 7.79 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 62 Y 8.48 4.18 0.00 3.06 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 63 G 8.65 4.28 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 0.00 64 E 7.63 4.75 0.00 1.97 1.85 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 2.19 2.32 0.00 65 L 8.30 5.08 0.00 1.65 1.50 0.88 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 66 T 8.72 4.83 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 1.20 0.00 0.00 67 V 8.70 3.76 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 0.93 0.00 0.00 0.93 0.00 0.00 68 G 7.97 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.38 4.24 0.00 2.16 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 70 L 7.92 3.96 0.00 1.91 1.70 0.92 0.78 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 71 A 7.27 4.15 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 72 T 7.78 3.82 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 1.25 0.00 0.00 73 L 7.83 3.82 0.00 1.53 1.52 0.04 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.85 3.85 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 0.00 0.00 0.00 75 V 7.61 3.11 2.06 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 0.68 0.00 0.00 0.91 0.00 0.00 *77 E 7.63 4.12 0.00 2.07 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 2.47 0.00 78 Q 8.75 4.27 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 79 S 7.92 4.12 0.00 4.04 4.10 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 80 T 7.83 3.85 4.30 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 1.21 0.00 0.00 81 T 8.42 3.84 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 1.27 0.00 0.00 82 S 8.05 4.12 0.00 4.09 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 83 R 8.14 4.01 0.00 2.07 1.95 0.00 3.18 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 1.64 1.82 0.00 84 T 8.30 3.86 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 1.18 0.00 0.00 85 V 8.63 3.60 2.31 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 1.03 0.00 0.00 0.95 0.00 0.00 86 D 7.82 4.48 0.00 2.84 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 87 Q 7.99 4.05 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 88 L 7.69 4.13 0.00 1.81 1.72 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.49 4.20 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 1.22 0.00 0.00 0.98 0.00 0.00 90 D 7.45 4.67 0.00 2.93 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 91 E 8.53 4.27 0.00 1.94 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 2.33 2.42 0.00 92 G 8.35 3.74 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 0.00 0.00 0.00 93 L 8.52 4.99 0.00 1.52 1.63 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.78 4.94 1.25 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 0.00 0.00 0.00 95 A 8.61 4.72 1.22 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 0.00 0.00 96 R 8.71 4.52 0.00 1.71 1.89 0.00 3.15 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 97 S 8.91 4.91 0.00 3.79 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 4.60 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 1.23 0.70 0.91 0.00 0.00 99 S 8.04 4.52 0.00 4.10 3.74 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 0.00 100 D 8.38 4.57 0.00 2.71 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 *103 Q 7.36 4.31 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.45 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 104 R 8.17 4.71 0.00 1.68 1.83 0.00 3.24 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 105 K 7.80 4.39 0.00 1.86 1.91 0.00 1.55 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.46 7.81 106 R 8.75 4.33 0.00 1.79 1.95 0.00 3.07 0.00 0.00 3.39 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 107 T 8.34 4.98 4.35 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 1.29 0.00 0.00 108 V 8.32 4.92 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 0.94 0.00 0.00 109 V 8.44 4.70 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 0.81 0.00 0.00 0.99 0.00 0.00 110 L 8.48 4.76 0.00 1.55 1.61 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.02 4.40 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 1.21 0.00 0.00 112 R 8.59 3.91 0.00 1.88 2.03 0.00 3.13 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 113 K 8.06 4.08 0.00 1.82 2.00 0.00 1.73 0.00 0.00 2.03 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.51 7.81 114 G 8.31 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.38 3.98 0.00 2.01 1.89 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.67 7.81 116 K 8.14 4.07 0.00 1.98 1.87 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 117 K 8.10 3.92 0.00 1.92 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 118 L 7.86 4.02 0.00 1.78 1.73 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.52 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 0.00 120 E 8.43 4.02 0.00 2.01 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 0.00 2.33 2.36 0.00 121 I 7.99 3.99 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.81 0.94 0.00 0.00 122 S 7.93 4.16 0.00 4.10 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 0.00 123 P 0.00 4.35 0.00 2.18 2.15 0.00 3.77 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 2.12 2.15 0.00 124 L 8.25 3.91 0.00 1.89 1.77 0.95 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 125 I 7.79 3.89 2.01 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 1.89 0.79 1.19 0.00 0.00 126 N 8.77 4.70 0.00 2.86 2.93 0.00 0.00 7.10 7.65 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 0.00 127 D 8.16 4.31 0.00 3.03 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 0.00 128 F 8.64 4.13 0.00 3.11 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 0.00 129 H 9.25 4.57 0.00 3.54 3.67 0.00 5.61 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 0.00 130 A 8.53 3.95 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 0.00 131 E 8.29 3.95 0.00 2.19 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 2.35 2.41 0.00 132 L 8.29 4.26 0.00 2.16 1.94 0.71 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.55 4.48 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 0.82 0.00 0.00 0.87 0.00 0.00 134 G 7.99 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 0.00 135 N 7.89 4.76 0.00 2.70 2.85 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 0.00 136 V 7.52 3.70 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 0.75 0.00 0.00 0.93 0.00 0.00 137 D 8.83 4.33 0.00 2.78 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 0.00 138 P 0.00 4.26 0.00 2.19 2.08 0.00 3.63 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 2.10 2.16 0.00 139 D 8.70 4.46 0.00 2.83 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 0.00 140 K 8.14 3.96 0.00 2.00 1.86 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.50 7.81 141 L 8.18 3.92 0.00 1.74 1.79 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 7.93 3.94 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 143 T 7.80 3.82 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 1.21 0.00 0.00 144 C 8.17 3.92 0.00 3.04 3.15 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 0.00 145 I 7.98 3.67 1.98 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 1.48 0.71 0.87 0.00 0.00 146 E 8.43 3.93 0.00 2.13 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 2.32 2.50 0.00 147 V 7.91 3.56 2.27 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 0.91 0.00 0.00 0.93 0.00 0.00 148 L 7.96 4.24 0.00 1.87 1.66 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 149 G 8.03 3.59 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 0.00 0.00 0.00 150 E 8.49 3.91 0.00 2.19 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 0.00 2.31 2.35 0.00 151 I 8.09 3.68 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 1.40 0.73 0.89 0.00 0.00 152 L 7.74 4.04 0.00 1.77 1.63 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 153 K 7.87 3.97 0.00 2.00 2.00 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.53 7.81 154 G 7.66 3.77 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 0.00 155 K 8.28 4.26 0.00 1.81 1.87 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.61 7.81 156 T 7.70 4.41 4.47 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 1.26 0.00 0.00 157 D 7.86 4.50 0.00 2.98 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 0.00 158 Y 7.65 4.30 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.