NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 Q 4.2305 8.3444 121.7104 55.7115 31.1010 175.9868 29 S 4.3752 7.7296 109.7812 57.3771 62.6631 173.7191 30 R 3.8904 8.6762 122.4962 60.6172 30.1745 177.6480 31 T 3.8325 7.8385 114.8208 66.5861 68.4587 176.1743 32 L 3.9567 7.8565 121.6671 58.0758 42.1015 178.8021 33 L 3.9408 8.0813 118.6913 57.7606 41.5040 179.1839 34 A 4.0754 8.3244 121.0901 55.3694 18.2351 179.9731 35 G 3.5343 8.0900 103.9370 47.5255 0.0000 176.2749 36 I 3.7133 8.0213 122.4383 64.3978 37.1688 178.5833 37 V 3.5690 7.9931 119.2775 65.9633 31.2952 177.8168 38 Q 3.9416 8.3718 119.6360 59.2580 28.8757 178.0681 39 Q 3.9792 8.3606 120.7475 59.1245 28.9615 178.0961 40 Q 3.9990 8.3575 119.4715 58.9810 28.6798 178.5412 41 Q 3.9500 8.0833 120.5146 59.2209 29.0199 178.3741 42 Q 3.9883 8.1423 119.0172 59.0526 28.7363 178.8966 43 L 3.9739 8.3142 120.3640 57.6014 41.5626 179.1734 44 L 3.9252 8.2105 120.6115 58.3537 41.9968 178.7590 45 D 4.3376 8.4508 119.0824 57.3077 40.7693 178.9172 46 V 3.5852 7.9313 118.6746 66.3280 31.4935 178.6276 47 V 3.8559 8.0348 112.0691 63.9839 31.3360 178.7960 48 K 3.9414 8.3702 118.8761 59.6783 31.9466 179.6216 49 R 3.9893 8.1299 118.2185 59.1778 29.8787 179.0816 50 Q 4.0246 8.6333 118.4777 58.9681 28.6654 178.6031 51 Q 3.9804 8.3325 120.8553 59.1498 29.0431 178.1717 52 E 3.9721 8.1461 119.6047 59.4163 29.4937 179.1660 53 L 4.0129 8.0213 120.3784 57.8563 42.0613 178.7002 54 L 3.9941 8.3776 120.8960 58.2131 41.9991 179.1414 55 R 4.1355 8.4991 118.4362 59.4215 29.9941 179.0873 56 L 4.1527 8.0645 118.7511 58.1009 41.5293 179.7334 57 T 4.0352 8.2070 115.9881 66.5194 68.2672 177.0073 58 V 3.8469 8.2751 120.5356 65.6017 31.5067 177.7436 59 W 4.2940 8.6488 128.4420 60.5996 30.5032 178.0409 60 G 3.5291 8.5950 105.5224 48.1278 0.0000 175.5933 61 T 3.7995 8.1522 118.2679 66.2324 68.5205 176.7503 62 K 3.7720 8.2964 120.5212 59.4139 32.1907 178.7667 63 N 3.8419 7.4907 117.1969 56.6237 38.7064 176.8704 64 L 3.8101 7.7084 120.4177 57.6214 41.5739 179.2014 65 Q 3.3429 7.7464 119.6101 59.3354 28.8003 178.6578 66 T 3.6852 7.4847 116.6101 66.5574 68.4233 177.0327 67 R 3.8783 7.6593 119.6136 58.9428 29.9844 179.2492 68 V 3.5147 8.2011 118.5245 66.1373 31.4530 178.1220 69 T 4.0330 8.1489 116.7843 66.0021 68.1901 176.3487 70 A 3.9375 7.9729 122.5094 55.1339 18.2963 179.7734 71 I 3.5907 7.7050 118.2858 64.5301 36.9106 178.5005 72 E 3.7004 8.3722 119.6627 59.1247 29.2407 179.2259 73 K 3.8156 8.1233 119.7121 59.6024 32.1534 177.9934 74 Y 3.9289 8.0209 119.7114 60.8868 38.6544 178.2856 75 L 3.5228 7.8580 120.0928 57.2807 41.4928 179.4093 76 K 3.5646 7.3607 119.9106 59.2116 31.9810 178.3886 77 D 4.1546 7.9765 118.5515 57.3267 41.1438 178.0554 78 Q 3.6879 7.8290 120.0447 58.8880 28.8867 177.9661 79 A 4.0090 8.0407 122.0722 55.2681 18.4187 179.6678 80 Q 3.9735 8.2403 116.6514 59.0092 28.5658 178.6905 81 L 3.9670 7.8912 120.5338 58.1725 42.3985 178.4837 82 N 4.4954 8.3815 116.2504 56.2589 38.2773 177.0008 83 A 4.0472 8.0540 121.2004 55.2014 18.5280 179.2704 84 W 4.2448 8.2891 125.6443 58.2874 30.9487 178.3882 85 G 3.6346 8.4934 104.9724 47.3097 0.0000 175.2493 *94 A 4.2487 9.3103 125.6305 51.8059 19.8254 177.0257 95 A 4.5714 8.3864 118.1464 50.4219 21.2893 175.9250 96 V 3.5670 8.6530 123.0007 62.6130 31.6428 174.0381 97 P 4.2764 0.0000 0.0000 62.3474 31.6239 175.9738 98 W 4.4717 8.8467 133.3574 56.6697 30.6619 174.0984 99 P 4.2257 0.0000 0.0000 65.3175 31.0461 176.7251 100 N 4.3371 6.6228 115.0040 52.4309 39.2137 174.3423 101 A 4.2916 8.2599 122.6173 51.7870 19.4001 178.7966 102 S 4.1308 8.9480 117.8127 61.8224 63.1815 176.3820 103 L 4.3026 7.9141 118.7390 57.8702 41.1908 178.9207 104 T 4.1572 9.1150 118.5782 66.4390 68.2960 174.3689 105 P 4.3141 0.0000 0.0000 65.3861 31.3082 178.4772 106 K 3.9798 8.1309 117.8624 59.2912 32.2067 178.3387 107 W 4.4406 8.4359 128.5742 60.7856 30.6910 177.3929 108 N 4.3067 8.6710 117.3260 56.5420 38.3530 176.3334 109 N 4.4003 8.5074 118.6023 56.8171 39.1403 176.8096 110 E 4.0978 8.7286 120.3728 59.7482 29.5755 179.4174 111 T 3.9266 8.5089 116.2203 66.6162 68.5548 176.6700 112 W 4.1835 8.5564 120.3122 59.2481 29.1232 178.7842 113 Q 4.2705 8.4742 118.6544 58.8471 28.1015 178.3620 114 E 4.0267 8.3404 119.7597 59.0409 29.4300 179.0632 115 W 4.0430 8.3670 128.4238 60.4788 30.6641 177.5466 116 E 3.9660 9.1593 119.7754 59.2796 29.1210 178.8966 117 R 3.9445 8.1479 116.1299 59.2836 29.4184 179.0672 118 K 3.9317 8.1157 119.2790 59.1819 32.0156 179.6150 119 V 3.3281 7.5335 118.7516 65.9410 31.2899 177.8365 120 D 4.2865 8.3597 119.1455 57.0460 40.5249 178.5347 121 F 4.2001 8.2279 121.4074 61.2589 39.3111 177.2594 122 L 3.6597 8.0659 118.6783 57.6378 41.3718 179.3838 123 E 3.8615 8.3305 118.8552 59.3791 29.3824 179.2257 124 E 3.8779 8.0110 118.6036 59.3646 29.4395 178.9686 125 N 4.0688 7.7760 117.2823 56.6156 38.8256 177.0765 126 I 3.6485 7.8552 121.5507 64.4056 37.1540 178.3821 127 T 3.7896 7.8916 116.4764 66.6613 68.2518 176.3090 128 A 3.9796 7.8642 122.4538 55.2655 18.3075 179.7476 129 L 4.0954 8.1080 117.5652 57.8772 41.6095 179.7372 130 L 3.9893 8.2262 119.3361 57.7294 41.4967 179.4316 131 E 3.9535 8.1613 118.6453 59.4642 29.3631 179.2557 132 E 3.9813 8.4592 118.5737 59.2394 29.3905 179.2684 133 A 3.9762 8.3881 121.3701 54.9908 18.4240 179.4086 134 Q 3.8910 8.2933 118.2609 59.4197 29.0636 178.6217 135 I 3.6894 7.7330 120.7934 64.5048 37.0707 178.1994 136 Q 3.9294 8.2835 120.4438 59.0587 28.7267 178.0207 137 Q 3.9588 8.3436 121.0284 59.3015 29.0062 178.2775 138 E 3.9833 8.2631 119.4769 59.3110 29.5013 179.3950 139 K 3.9472 8.2814 118.6810 59.6854 32.0910 179.1579 140 N 4.3984 8.5218 116.9859 56.4693 38.4017 177.2032 141 M 4.0480 8.4088 119.9527 58.6540 32.3512 177.4650 142 Y 4.0473 8.3918 120.0539 61.0233 38.7420 178.2387 143 E 4.0071 8.2918 118.0470 59.1763 29.9582 178.7541 144 L 4.0828 8.3061 120.9992 58.2805 41.9382 179.1156 145 Q 3.9881 8.2315 117.4778 58.4340 28.5202 178.0325 146 K 3.9570 7.8482 120.3597 58.8909 31.9631 177.3077 147 L 3.6953 7.4345 118.6750 59.3147 41.7896 177.5098 148 N 4.3763 8.0191 118.4879 54.8651 39.6873 175.1446 149 S 4.5104 7.1271 115.8885 59.1679 64.2548 176.2530 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 28 Q 8.34 4.23 0.00 2.03 2.20 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 2.24 2.35 0.00 29 S 7.73 4.38 0.00 4.00 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 30 R 8.68 3.89 0.00 1.91 1.91 0.00 3.23 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 31 T 7.84 3.83 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 1.21 0.00 0.00 32 L 7.86 3.96 0.00 1.75 1.80 0.92 0.65 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 33 L 8.08 3.94 0.00 1.91 1.70 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.32 4.08 1.37 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 35 G 8.09 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.02 3.71 2.01 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 1.41 0.76 0.91 0.00 0.00 37 V 7.99 3.57 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 1.00 0.00 0.00 0.99 0.00 0.00 38 Q 8.37 3.94 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 39 Q 8.36 3.98 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 40 Q 8.36 4.00 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 41 Q 8.08 3.95 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 42 Q 8.14 3.99 0.00 2.38 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 43 L 8.31 3.97 0.00 1.65 1.71 0.92 0.38 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 44 L 8.21 3.93 0.00 1.80 1.90 0.91 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.45 4.34 0.00 2.88 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 46 V 7.93 3.59 2.23 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 0.99 0.00 0.00 1.00 0.00 0.00 47 V 8.03 3.86 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 0.75 0.00 0.00 1.00 0.00 0.00 48 K 8.37 3.94 0.00 1.93 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.65 7.81 49 R 8.13 3.99 0.00 1.83 1.97 0.00 3.29 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 50 Q 8.63 4.02 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 51 Q 8.33 3.98 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 52 E 8.15 3.97 0.00 2.22 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 0.00 2.32 2.50 0.00 53 L 8.02 4.01 0.00 1.79 1.84 0.95 0.54 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 L 8.38 3.99 0.00 1.93 1.85 0.96 0.88 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 55 R 8.50 4.14 0.00 2.05 2.01 0.00 3.17 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.84 0.00 56 L 8.06 4.15 0.00 1.93 1.79 0.91 0.69 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 57 T 8.21 4.04 4.49 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 1.31 0.00 0.00 58 V 8.28 3.85 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 1.23 0.00 0.00 1.03 0.00 0.00 59 W 8.65 4.29 0.00 3.53 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 60 G 8.60 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.15 3.80 4.65 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 1.20 0.00 0.00 62 K 8.30 3.77 0.00 1.79 1.78 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.28 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.89 2.02 7.81 63 N 7.49 3.84 0.00 1.44 2.12 0.00 0.00 7.29 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 64 L 7.71 3.81 0.00 1.66 1.52 0.89 0.97 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 65 Q 7.75 3.34 0.00 1.32 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 66 T 7.48 3.69 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 1.11 0.00 0.00 67 R 7.66 3.88 0.00 1.85 1.86 0.00 3.04 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 68 V 8.20 3.51 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 1.04 0.00 0.00 0.87 0.00 0.00 69 T 8.15 4.03 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 1.14 0.00 0.00 70 A 7.97 3.94 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 71 I 7.70 3.59 1.94 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.69 0.88 0.00 0.00 72 E 8.37 3.70 0.00 2.18 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 2.69 2.52 0.00 73 K 8.12 3.82 0.00 1.86 2.01 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.42 7.81 74 Y 8.02 3.93 0.00 3.05 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 75 L 7.86 3.52 0.00 0.47 0.78 0.77 0.91 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 76 K 7.36 3.56 0.00 1.54 1.74 0.00 1.82 0.00 0.00 1.62 0.00 0.00 3.11 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.70 7.81 77 D 7.98 4.15 0.00 2.68 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.83 3.69 0.00 1.62 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 79 A 8.04 4.01 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.24 3.97 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.64 0.00 81 L 7.89 3.97 0.00 1.51 1.75 0.84 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.38 4.50 0.00 3.06 2.88 0.00 0.00 6.88 6.75 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 83 A 8.05 4.05 1.47 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 0.00 0.00 84 W 8.29 4.24 0.00 3.56 3.30 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 85 G 8.49 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 *94 A 9.31 4.25 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 95 A 8.39 4.57 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 96 V 8.65 3.57 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 0.89 0.00 0.00 0.96 0.00 0.00 97 P 0.00 4.28 0.00 2.11 2.04 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 98 W 8.85 4.47 0.00 3.24 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 99 P 0.00 4.23 0.00 1.95 2.00 0.00 3.16 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 1.26 1.70 0.00 100 N 6.62 4.34 0.00 2.54 2.73 0.00 0.00 6.89 7.35 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 0.00 101 A 8.26 4.29 1.31 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 0.00 0.00 102 S 8.95 4.13 0.00 3.90 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 0.00 103 L 7.91 4.30 0.00 1.93 1.95 1.04 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 104 T 9.11 4.16 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 1.27 0.00 0.00 105 P 0.00 4.31 0.00 2.23 2.16 0.00 3.81 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 2.21 2.26 0.00 106 K 8.13 3.98 0.00 1.90 2.11 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.62 1.57 7.81 107 W 8.44 4.44 0.00 3.51 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 0.00 108 N 8.67 4.31 0.00 2.72 2.82 0.00 0.00 6.92 6.39 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 0.00 109 N 8.51 4.40 0.00 3.02 3.09 0.00 0.00 7.20 7.16 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 0.00 110 E 8.73 4.10 0.00 2.41 2.11 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 2.41 2.55 0.00 111 T 8.51 3.93 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 1.01 0.00 0.00 112 W 8.56 4.18 0.00 3.52 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 0.00 113 Q 8.47 4.27 0.00 2.47 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.63 0.00 114 E 8.34 4.03 0.00 2.27 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 2.39 2.61 0.00 115 W 8.37 4.04 0.00 3.04 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 0.00 116 E 9.16 3.97 0.00 2.48 2.38 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 2.43 2.53 0.00 117 R 8.15 3.94 0.00 2.11 2.39 0.00 2.81 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.66 0.00 118 K 8.12 3.93 0.00 1.78 1.81 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.61 7.81 119 V 7.53 3.33 1.12 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 0.76 0.00 0.00 -0.28 0.00 0.00 120 D 8.36 4.29 0.00 2.79 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 0.00 121 F 8.23 4.20 0.00 3.08 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 0.00 122 L 8.07 3.66 0.00 1.76 1.60 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.33 3.86 0.00 2.06 1.94 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 2.28 2.48 0.00 124 E 8.01 3.88 0.00 2.06 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 2.29 2.42 0.00 125 N 7.78 4.07 0.00 1.85 2.47 0.00 0.00 7.25 8.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 I 7.86 3.65 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.50 0.93 0.00 0.00 127 T 7.89 3.79 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 1.18 0.00 0.00 128 A 7.86 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 0.00 129 L 8.11 4.10 0.00 1.82 1.70 0.94 0.59 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 0.00 130 L 8.23 3.99 0.00 1.82 1.70 0.90 1.16 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 0.00 131 E 8.16 3.95 0.00 2.19 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 0.00 2.31 2.62 0.00 132 E 8.46 3.98 0.00 2.24 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 0.00 2.32 2.37 0.00 133 A 8.39 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 0.00 134 Q 8.29 3.89 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 135 I 7.73 3.69 1.98 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 1.39 0.56 0.89 0.00 0.00 136 Q 8.28 3.93 0.00 2.25 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 137 Q 8.34 3.96 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 138 E 8.26 3.98 0.00 2.22 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 2.34 2.54 0.00 139 K 8.28 3.95 0.00 1.95 1.87 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.61 7.81 140 N 8.52 4.40 0.00 2.90 2.88 0.00 0.00 6.70 7.92 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 0.00 141 M 8.41 4.05 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 142 Y 8.39 4.05 0.00 3.17 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 0.00 143 E 8.29 4.01 0.00 2.18 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 2.73 2.54 0.00 144 L 8.31 4.08 0.00 1.79 1.84 0.91 0.51 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 0.00 145 Q 8.23 3.99 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 146 K 7.85 3.96 0.00 1.54 1.78 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.31 7.81 147 L 7.43 3.70 0.00 1.68 1.69 0.91 0.76 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 0.00 148 N 8.02 4.38 0.00 2.68 2.80 0.00 0.00 6.77 7.63 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 0.00 149 S 7.13 4.51 0.00 3.73 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 * Residues marked with a * may have inaccurate shift predictions.