NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *6 H 4.6732 8.3027 117.3698 54.1579 30.4922 173.1205 7 R 4.4157 7.9588 123.6742 53.9157 28.5326 172.2818 8 L 3.4462 7.8867 119.9509 52.6881 41.7735 176.2801 9 S 4.6861 8.4283 120.9512 57.0048 66.4659 174.1305 10 A 3.2902 8.2624 116.9856 54.8048 18.3533 178.7151 11 E 3.7422 8.9603 122.1999 58.7611 30.3052 178.2194 12 E 3.9677 8.3608 118.0298 61.5248 29.5765 182.0057 13 R 4.3877 9.4194 119.4843 60.0302 29.4472 179.3553 14 D 4.4333 8.9352 122.0238 57.1443 39.6908 179.5951 15 Q 4.5256 8.8794 116.1752 59.1298 29.5511 177.7333 16 L 4.0780 8.8887 122.3923 57.0735 41.7359 179.0506 17 L 3.9650 8.2711 118.9580 57.4111 41.6758 177.7562 18 P 4.2231 0.0000 0.0000 66.4030 30.6074 177.8156 19 N 4.3028 7.5910 114.8639 55.8644 38.7588 177.1433 20 L 4.2385 7.7567 119.5658 57.6817 41.1300 178.8489 21 R 4.5830 8.2620 119.9665 59.1597 29.7336 178.0505 22 A 4.8799 7.6278 118.6013 54.2916 18.2273 177.9909 23 V 4.2171 8.1342 116.6006 62.6355 32.0182 176.4196 24 G 3.6330 9.7164 105.7054 44.2177 0.0000 174.7796 25 W 3.6530 7.6296 119.7482 56.5920 29.3642 175.5047 26 N 5.0612 7.9330 125.6267 52.7512 40.9194 172.5063 27 E 5.1864 8.7483 119.2998 54.2144 32.1884 175.5146 28 L 3.8867 8.7926 128.9225 54.6407 42.9520 176.0752 29 E 4.1450 8.6140 127.7471 58.9025 29.3783 174.2921 30 G 3.8934 8.6807 118.7439 45.9772 0.0000 173.1264 31 R 4.5016 7.6008 117.5222 54.4096 32.6251 176.4663 32 D 4.8551 8.1760 118.2475 52.8720 39.6587 174.6363 33 A 5.0398 7.8600 123.1217 50.0446 23.8045 174.8279 34 I 5.2451 8.3433 111.8246 59.2928 40.5313 174.6548 35 F 6.0458 9.3665 118.2514 55.9127 42.0257 173.0691 36 K 3.6412 9.8979 118.5465 54.9319 35.4733 173.7992 37 Q 5.1577 7.9603 127.3008 54.3030 31.8965 174.3517 38 F 4.6979 10.4460 124.3551 55.9014 42.3675 173.3283 39 H 4.8391 8.6777 124.1498 55.2908 30.7368 174.0715 40 F 4.6560 8.2314 124.6562 55.7311 41.4768 174.7608 41 K 4.2838 8.8815 118.8781 58.4797 32.8423 176.0340 42 D 4.2154 7.3540 116.9329 51.1422 43.4930 175.3662 43 F 4.1416 7.7917 119.8512 60.8923 38.7754 176.4033 44 N 4.1538 8.0897 116.3279 55.9609 38.6059 176.4187 45 R 3.7179 7.5290 120.0446 58.8932 29.5885 177.9580 46 A 3.0116 7.2968 120.4456 54.3879 18.1855 178.6195 47 F 4.2684 7.3360 117.9518 59.3078 39.3342 177.8192 48 G 3.5975 7.3791 104.2236 46.7075 0.0000 175.3256 49 F 4.2208 7.6266 123.0490 61.0860 39.5046 177.1447 50 M 3.1837 6.8944 118.6424 58.7201 31.6272 178.9963 51 T 3.6474 7.2438 115.3339 66.4895 67.2849 176.6830 52 R 4.1500 7.2412 116.4680 58.1345 30.0690 178.9492 53 V 4.1195 7.5289 117.8472 65.5416 31.6443 177.3770 54 A 4.4104 8.5205 120.8532 55.4658 18.1203 179.2658 55 L 3.7534 7.9207 118.0353 58.1794 42.1778 178.9174 56 Q 3.8844 7.5141 115.8677 58.0322 29.3769 177.3352 57 A 4.1465 8.7448 124.2791 54.0660 18.0701 178.6107 58 E 4.1656 8.0483 116.2614 57.7773 30.0242 177.8789 59 K 4.0983 7.5597 119.5158 58.1578 32.2949 177.5087 60 L 4.5401 7.2329 116.3018 54.3829 41.0520 175.7932 61 D 4.2642 8.0336 117.0265 55.5144 39.4416 172.6364 62 H 4.5796 7.9648 117.1310 54.1247 31.0556 172.0894 63 H 4.5493 8.1857 123.8494 53.6090 30.3454 173.3832 64 P 4.3920 0.0000 0.0000 62.1818 33.7150 175.9141 65 E 4.6405 8.4704 119.4187 54.0061 29.5493 175.6051 66 W 5.5541 8.3057 120.0498 54.6543 31.4713 175.2598 67 F 5.2574 9.2905 122.4220 56.6497 42.3704 173.2244 68 N 4.7832 7.7314 122.1196 52.9032 41.4301 172.0063 69 V 3.8196 8.2836 124.2952 62.1351 32.8253 175.0448 70 Y 4.6197 7.6090 120.5423 57.4923 42.1708 175.6053 71 N 4.8489 8.0418 117.4947 53.5678 39.4450 175.1136 72 K 4.8565 8.0790 119.5040 56.3408 33.5380 176.0166 73 V 4.9534 9.3038 122.0713 61.7721 35.4738 173.2789 74 H 5.5219 9.5870 127.4342 54.7536 32.0833 171.9639 75 I 5.1510 10.9750 126.8792 60.0526 39.6483 174.7814 76 T 5.2093 8.5895 122.5214 61.8940 71.0229 173.4374 77 L 4.9889 8.8498 125.4229 53.1272 45.5377 175.6756 78 S 5.3626 8.8113 116.5832 58.2558 65.9230 174.2656 79 T 4.3097 8.6522 113.4570 61.4867 69.5618 175.0806 80 H 4.4574 8.7621 124.9515 57.4491 29.9163 176.6273 81 E 3.8980 8.0271 120.2731 59.9959 29.7341 178.0108 82 C 4.1503 8.1006 114.5817 60.0451 29.5937 173.2830 83 A 3.4670 7.8134 122.3251 50.9757 15.7775 175.5138 84 G 4.2002 7.6627 110.6378 43.0344 0.0000 170.1760 85 L 4.4085 8.0489 120.4713 54.7923 41.1058 176.8580 86 S 5.6548 7.8726 123.4642 57.3779 64.8430 174.0706 87 E 3.9608 8.5447 117.5122 59.9698 29.4250 181.0827 88 R 3.2907 6.7088 116.3335 58.9222 30.9003 177.6640 89 D 4.4262 8.0514 117.4112 56.8792 40.9071 178.5637 90 I 3.3849 8.2395 119.6164 65.0991 37.0532 178.0203 91 N 4.4125 7.9833 117.0803 55.5062 37.3349 176.6864 92 L 4.0323 7.7798 122.5883 57.5246 42.0385 178.3790 93 A 3.6490 8.9143 121.9896 55.0283 18.2361 179.5292 94 S 4.2765 7.9012 111.5379 60.6437 63.4105 176.3720 95 F 4.3343 7.8981 124.5339 61.3623 38.7535 177.0551 96 I 3.8128 8.1979 119.2769 63.7157 36.6794 178.3463 97 E 4.4729 8.0193 120.1700 59.6186 29.3878 178.6655 98 Q 4.0213 7.9422 118.0118 59.8004 29.1333 178.0079 99 V 3.5437 7.9667 119.5831 64.8409 31.4906 177.6403 100 A 3.9741 8.5680 119.8080 55.2894 18.2099 180.0005 101 V 3.5263 7.5445 116.3317 66.3458 31.7373 177.7652 102 S 4.2698 7.8343 113.8263 61.9045 62.8035 176.0350 103 M 4.4367 8.0154 118.0613 56.2851 33.1750 176.1191 104 T 4.1652 8.5000 119.8599 63.6171 68.7784 174.4161 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 *6 H 8.30 4.67 0.00 2.85 3.13 0.00 7.13 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 7.96 4.42 0.00 1.81 1.86 0.00 3.22 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 8 L 7.89 3.45 0.00 1.94 1.62 0.90 0.75 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 9 S 8.43 4.69 0.00 4.07 3.99 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 0.00 0.00 0.00 10 A 8.26 3.29 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 11 E 8.96 3.74 0.00 2.04 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 2.37 2.38 0.00 12 E 8.36 3.97 0.00 2.01 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 2.32 1.97 0.00 13 R 9.42 4.39 0.00 2.04 2.22 0.00 2.83 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.68 0.00 14 D 8.94 4.43 0.00 2.65 2.64 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 15 Q 8.88 4.53 0.00 2.20 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 16 L 8.89 4.08 0.00 1.54 1.69 0.90 0.57 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 17 L 8.27 3.97 0.00 1.80 1.78 0.94 0.89 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 18 P 0.00 4.22 0.00 2.26 2.35 0.00 3.74 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 19 N 7.59 4.30 0.00 2.85 2.95 0.00 0.00 7.17 7.64 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 20 L 7.76 4.24 0.00 1.75 1.76 0.60 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.26 4.58 0.00 1.95 2.00 0.00 3.21 0.00 0.00 3.28 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 22 A 7.63 4.88 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.13 4.22 2.40 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 0.84 0.00 0.00 1.11 0.00 0.00 24 G 9.72 3.63 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 0.00 0.00 0.00 25 W 7.63 3.65 0.00 3.49 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 26 N 7.93 5.06 0.00 2.32 2.77 0.00 0.00 6.45 7.71 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 27 E 8.75 5.19 0.00 2.10 1.89 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 2.40 2.39 0.00 28 L 8.79 3.89 0.00 1.84 1.52 0.07 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.61 4.14 0.00 1.95 1.82 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 2.26 2.24 0.00 30 G 8.68 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 0.00 0.00 0.00 31 R 7.60 4.50 0.00 1.81 1.91 0.00 3.22 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 32 D 8.18 4.86 0.00 2.81 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 33 A 7.86 5.04 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 34 I 8.34 5.25 2.20 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.82 1.01 0.00 0.00 35 F 9.37 6.05 0.00 3.31 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 36 K 9.90 3.64 0.00 0.79 0.74 0.00 0.68 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.32 7.81 37 Q 7.96 5.16 0.00 2.11 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.48 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 38 F 10.45 4.70 0.00 2.71 2.20 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 39 H 8.68 4.84 0.00 3.11 3.07 0.00 5.70 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.23 4.66 0.00 3.01 2.87 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 41 K 8.88 4.28 0.00 1.75 1.87 0.00 1.83 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.46 7.81 42 D 7.35 4.22 0.00 2.86 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 43 F 7.79 4.14 0.00 2.61 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 44 N 8.09 4.15 0.00 2.77 2.74 0.00 0.00 6.85 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 45 R 7.53 3.72 0.00 1.94 1.55 0.00 3.27 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 46 A 7.30 3.01 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 47 F 7.34 4.27 0.00 1.83 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 0.00 0.00 0.00 0.00 48 G 7.38 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 0.00 0.00 0.00 49 F 7.63 4.22 0.00 2.38 2.41 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 50 M 6.89 3.18 0.00 1.06 1.28 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 1.60 0.00 51 T 7.24 3.65 4.07 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 0.00 0.00 0.00 1.17 0.00 0.00 52 R 7.24 4.15 0.00 1.89 1.97 0.00 3.10 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 53 V 7.53 4.12 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 1.09 0.00 0.00 0.38 0.00 0.00 54 A 8.52 4.41 1.48 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 0.00 0.00 55 L 7.92 3.75 0.00 2.03 1.74 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.51 3.88 0.00 1.67 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 1.16 1.95 0.00 57 A 8.74 4.15 1.11 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 58 E 8.05 4.17 0.00 1.99 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 2.28 2.34 0.00 59 K 7.56 4.10 0.00 1.77 1.78 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.37 7.81 60 L 7.23 4.54 0.00 1.73 1.62 0.83 1.00 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 61 D 8.03 4.26 0.00 2.78 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 62 H 7.96 4.58 0.00 3.16 3.05 0.00 5.82 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.19 4.55 0.00 3.01 3.00 0.00 5.94 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.39 0.00 1.33 1.78 0.00 3.16 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.06 0.00 65 E 8.47 4.64 0.00 2.05 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 2.20 2.21 0.00 66 W 8.31 5.55 0.00 3.40 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 67 F 9.29 5.26 0.00 3.25 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 68 N 7.73 4.78 0.00 2.60 2.46 0.00 0.00 6.84 7.71 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 69 V 8.28 3.82 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 0.85 0.00 0.00 0.86 0.00 0.00 70 Y 7.61 4.62 0.00 2.70 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 71 N 8.04 4.85 0.00 2.91 2.94 0.00 0.00 6.01 6.43 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 72 K 8.08 4.86 0.00 1.93 2.07 0.00 1.55 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.56 7.81 73 V 9.30 4.95 2.39 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 1.23 0.00 0.00 1.04 0.00 0.00 74 H 9.59 5.52 0.00 3.50 3.41 0.00 5.60 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 10.98 5.15 2.45 0.00 0.00 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 1.77 1.33 1.21 0.00 0.00 76 T 8.59 5.21 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 1.31 0.00 0.00 77 L 8.85 4.99 0.00 1.66 1.70 0.82 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.81 5.36 0.00 3.93 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 79 T 8.65 4.31 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 80 H 8.76 4.46 0.00 3.30 3.35 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.03 3.90 0.00 2.00 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 2.27 2.38 0.00 82 C 8.10 4.15 0.00 3.16 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 83 A 7.81 3.47 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 0.00 0.00 0.00 0.00 0.00 84 G 7.66 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 85 L 8.05 4.41 0.00 1.68 1.65 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 86 S 7.87 5.65 0.00 3.89 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 87 E 8.54 3.96 0.00 1.95 1.92 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 2.28 2.30 0.00 88 R 6.71 3.29 0.00 1.61 1.30 0.00 2.98 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 89 D 8.05 4.43 0.00 2.71 2.61 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 90 I 8.24 3.38 1.98 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 1.51 0.84 0.85 0.00 0.00 91 N 7.98 4.41 0.00 2.96 3.04 0.00 0.00 5.71 6.67 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 92 L 7.78 4.03 0.00 1.87 1.95 0.94 0.71 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 93 A 8.91 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 94 S 7.90 4.28 0.00 4.15 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 95 F 7.90 4.33 0.00 3.01 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 96 I 8.20 3.81 2.40 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.10 1.53 0.00 0.00 97 E 8.02 4.47 0.00 2.18 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 2.96 2.72 0.00 98 Q 7.94 4.02 0.00 2.09 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 99 V 7.97 3.54 2.25 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 1.18 0.00 0.00 0.24 0.00 0.00 100 A 8.57 3.97 1.64 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 0.00 101 V 7.54 3.53 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 0.89 0.00 0.00 0.98 0.00 0.00 102 S 7.83 4.27 0.00 4.08 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 0.00 103 M 8.02 4.44 0.00 1.99 2.27 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 104 T 8.50 4.17 4.19 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 1.02 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.