NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3868 8.1233 123.5860 52.0448 20.4621 178.7498 10 N 4.1519 8.8660 115.7039 54.7678 39.3157 174.9883 11 S 4.0915 8.8974 117.4276 61.8808 63.3405 176.4848 12 T 3.8926 7.8394 117.9721 66.6684 68.3662 176.9545 13 V 3.4145 7.4445 121.1179 64.7794 31.3036 178.3382 14 L 3.8272 8.5448 120.1726 57.3803 41.0543 179.4147 15 S 4.1126 8.5020 113.5836 61.2312 62.1197 175.9011 16 F 4.4087 8.0814 122.3813 61.7629 39.5846 176.6600 17 C 3.9442 8.2399 116.0356 62.3685 27.6846 175.6788 18 A 3.6673 8.1139 122.9761 54.9655 17.8429 178.2294 19 F 4.5860 7.2302 109.4270 57.3746 38.6486 176.2527 20 A 4.1875 7.4093 124.7931 51.6620 18.7302 179.4263 21 V 3.7292 8.2402 113.7029 63.5033 32.0366 176.7816 22 D 4.6513 7.4896 118.6801 50.6595 42.2702 173.4625 23 P 4.2115 0.0000 0.0000 65.2667 31.5550 178.0042 24 A 3.9900 8.0437 118.9702 55.1036 18.3744 179.4730 25 K 3.9597 8.6026 117.9722 59.4595 32.1420 178.9745 26 A 4.1011 8.0547 121.3496 55.1771 18.1682 178.9943 27 Y 4.3022 8.1575 118.1382 60.7624 38.8186 177.8217 28 K 3.7575 8.2396 120.5018 59.8759 32.1006 178.2226 29 D 4.3799 8.3992 118.4562 57.5807 41.0627 178.1296 30 Y 4.2484 8.4480 120.1814 60.8609 38.7818 178.2855 31 L 3.6453 8.1802 119.9536 57.5133 41.4822 179.0650 32 A 4.0401 7.9842 118.9867 53.8455 18.3584 178.5636 33 S 4.5050 7.5205 112.5198 57.8303 63.2037 174.8407 34 G 3.7463 7.8846 110.3646 45.3576 0.0000 174.4360 35 G 2.6314 6.9769 107.3342 44.4940 0.0000 173.4838 36 Q 4.1882 8.3483 122.0167 54.5130 29.8189 174.3636 37 P 4.7216 0.0000 0.0000 62.2667 32.1137 176.2701 38 I 3.9584 8.8112 123.1905 61.8858 37.4614 175.9922 39 T 4.6658 8.4003 115.5549 60.8213 71.1371 173.8745 40 N 4.3701 8.8220 117.6697 54.8552 35.5198 174.5117 41 C 4.4489 8.0268 114.6591 59.7367 29.2058 173.1948 42 V 4.4975 8.6625 115.7029 60.0352 33.2454 175.3223 43 K 4.7293 8.5981 123.6982 55.0568 34.1764 175.7436 44 M 4.3540 8.8334 123.2201 54.2624 33.6511 176.5303 45 L 4.2635 8.4050 124.5798 53.7944 41.3466 174.8287 46 C 4.8595 7.8984 119.9831 55.8005 31.2999 174.1148 47 T 3.8908 8.2374 112.8069 63.6014 66.9874 174.6498 48 H 4.2760 8.1784 115.8909 57.0860 25.9364 174.6156 49 T 4.5924 7.3635 105.6209 61.3333 69.0076 174.3114 50 G 3.9778 7.9720 112.7416 45.3219 0.0000 174.4867 51 T 3.8753 8.7331 109.3136 62.8758 68.7458 175.9831 52 G 3.9752 8.3311 109.5243 45.1876 0.0000 173.5882 53 Q 4.1338 7.4645 117.7687 55.5300 29.6733 176.5599 54 A 3.8741 8.8435 122.2133 54.6294 19.0952 177.7639 55 I 5.1229 7.4022 115.4895 59.8761 40.2609 174.8114 56 T 4.8255 9.0459 116.8218 59.8002 72.3074 175.3275 57 V 3.9462 8.6157 114.1820 63.0745 32.0528 176.4065 58 T 4.6553 7.4993 108.1745 58.7211 71.7277 171.7579 59 P 4.2035 0.0000 0.0000 63.3818 31.7451 176.3363 60 E 4.6508 9.3887 121.2499 55.7796 31.3109 175.4480 61 A 4.4666 7.7894 122.6551 52.4103 19.3588 178.2647 62 N 5.3784 8.6655 119.2552 51.5060 39.8740 175.4212 63 M 4.2048 8.6297 116.3929 58.1321 32.2896 176.8389 64 D 4.8502 9.0269 118.5295 53.9570 41.1554 175.1779 65 Q 5.1604 7.9201 117.4409 54.5449 33.5069 173.8238 66 E 4.7906 8.9746 118.3914 54.8010 33.7209 175.5051 67 S 5.2798 8.2500 117.7415 57.0167 65.3772 173.2436 68 F 5.3429 9.3255 123.8047 55.2172 41.9513 175.3036 69 G 3.8330 9.2690 109.8655 46.3427 0.0000 174.5897 70 G 3.8141 9.1917 113.1177 48.0902 0.0000 175.7803 71 A 4.0115 7.9922 123.6026 54.6052 18.1681 179.3791 72 S 4.2414 7.7238 110.3429 60.5239 63.6262 175.2816 73 C 4.4900 8.2272 119.8473 58.5555 28.5016 172.1670 74 C 4.6477 7.1884 122.6990 57.6293 32.2668 173.7669 75 L 3.5634 8.2593 128.9219 58.4492 41.5754 178.5421 76 Y 3.8452 6.9717 116.0037 60.9368 37.9626 177.8559 77 C 4.1592 7.8889 117.2231 63.0045 28.1454 176.2937 78 R 3.8471 8.0233 118.5514 58.5892 29.6685 177.8708 79 C 4.2306 7.5600 114.0553 58.7348 28.6912 172.9827 80 H 4.1017 7.6148 116.6294 56.9487 26.4603 174.1170 81 I 4.6236 7.3703 110.2519 58.3910 40.3955 174.7242 82 D 4.7539 8.4649 120.1342 54.9407 41.1712 176.1472 83 H 4.0678 8.6062 118.6559 54.2627 30.0693 173.4781 84 P 4.6837 0.0000 0.0000 62.4207 31.0320 175.7349 85 N 4.0261 7.1869 116.3067 55.9856 38.1712 176.2930 *89 F 4.8258 7.3130 124.1761 57.1107 42.1075 174.2176 90 C 4.5092 7.8014 118.9651 57.5111 34.2767 173.5366 91 D 4.7225 8.7555 125.3279 53.5630 39.7331 176.4195 92 L 4.4578 7.6225 120.5647 55.9776 43.7236 176.8020 93 K 3.8655 7.9182 118.7180 58.1863 32.1534 176.7179 94 G 3.8481 8.9072 114.0486 45.1642 0.0000 172.3521 95 K 4.4703 7.7956 119.3467 54.7102 35.8289 174.1863 96 Y 5.0622 8.7550 117.7117 56.5012 41.2936 175.2996 97 V 4.9009 8.9166 123.7236 61.4111 33.9672 174.2417 98 Q 5.1038 9.3624 128.2111 55.0489 29.8229 175.2375 99 I 4.2165 8.6276 125.1589 58.2960 40.5194 173.5238 100 P 4.5641 0.0000 0.0000 63.5139 32.0213 177.5973 101 T 3.8463 8.8669 120.7305 66.8596 68.2026 176.7489 102 T 4.1487 7.8427 109.3106 63.4476 69.2181 174.8663 103 C 4.6944 7.8215 118.3225 59.0999 29.1924 174.7276 104 A 4.1839 7.5876 122.0105 53.3063 18.0163 178.6536 105 N 4.5934 7.9306 115.1130 54.1214 39.2853 174.9187 106 D 4.7526 7.9876 120.6253 51.0954 41.7332 173.4471 107 P 3.9593 0.0000 0.0000 64.9760 31.4345 178.1187 108 V 4.3224 7.1051 118.0068 65.6537 31.5188 178.3115 109 G 3.9346 8.4459 106.0552 47.1092 0.0000 175.2453 110 F 3.8580 8.2316 123.3904 61.2941 39.1366 177.3366 111 T 3.8397 7.4195 107.1143 64.4374 68.7699 176.5367 112 L 4.1619 7.2478 121.0385 57.6742 41.7884 179.1211 113 R 4.1234 7.7810 116.0344 56.6252 30.3444 175.9309 114 N 4.9779 6.8840 114.4954 51.4115 41.6577 173.5734 115 T 4.8981 8.2389 114.8810 61.9018 72.1759 173.5834 116 V 4.0530 8.4450 125.8318 62.1418 32.7909 175.0152 117 C 4.4011 8.9696 129.5152 59.4552 31.7827 174.6773 118 T 3.9101 8.7269 116.8051 64.4355 68.8456 175.9219 119 V 3.7579 7.8122 121.4505 65.3930 31.7199 176.4074 120 C 4.3048 8.0284 112.5823 57.8075 30.5523 175.0593 121 G 3.7869 8.3089 109.4486 45.7876 0.0000 173.0417 122 M 4.6771 7.0891 119.2434 52.7012 34.3823 175.5611 123 W 4.8174 8.5054 120.7676 56.7211 29.7606 175.9156 124 K 4.2665 9.3936 125.8540 57.9295 31.9022 177.1586 125 G 3.8316 10.1744 114.6929 45.8260 0.0000 173.0602 126 Y 4.9122 8.3724 116.2823 55.5191 39.2529 173.2806 127 G 3.7235 8.5373 113.3776 45.9711 0.0000 173.1405 128 C 4.0779 8.1197 120.8442 60.3516 32.0951 173.3289 129 S 4.0997 8.7781 121.6802 59.2394 62.5818 171.9862 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 9 A 8.12 4.39 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 10 N 8.87 4.15 0.00 2.81 2.84 0.00 0.00 6.83 6.68 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 11 S 8.90 4.09 0.00 3.88 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 12 T 7.84 3.89 4.42 0.00 0.00 0.00 0.00 0.00 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 13 V 7.44 3.41 1.50 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 0.84 0.00 0.00 0.45 0.00 0.00 14 L 8.54 3.83 0.00 1.64 1.64 0.88 0.77 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 15 S 8.50 4.11 0.00 4.05 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 16 F 8.08 4.41 0.00 3.08 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 17 C 8.24 3.94 0.00 2.82 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 18 A 8.11 3.67 0.71 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 0.00 0.00 19 F 7.23 4.59 0.00 3.09 3.07 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 0.00 20 A 7.41 4.19 1.05 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 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.24 3.73 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 0.71 0.00 0.00 0.93 0.00 0.00 22 D 7.49 4.65 0.00 2.83 2.49 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 23 P 0.00 4.21 0.00 2.16 2.02 0.00 3.74 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.33 0.00 24 A 8.04 3.99 1.39 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 0.00 0.00 0.00 25 K 8.60 3.96 0.00 1.97 1.98 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.59 1.48 7.81 26 A 8.05 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.16 4.30 0.00 2.95 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 28 K 8.24 3.76 0.00 1.97 2.02 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.47 7.81 29 D 8.40 4.38 0.00 2.81 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 30 Y 8.45 4.25 0.00 3.30 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 31 L 8.18 3.65 0.00 1.65 1.49 0.54 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.98 4.04 1.29 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 33 S 7.52 4.51 0.00 3.89 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 34 G 7.88 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 0.00 0.00 0.00 35 G 6.98 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 0.00 0.00 0.00 36 Q 8.35 4.19 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 37 P 0.00 4.72 0.00 2.27 2.28 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 38 I 8.81 3.96 1.75 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.45 0.80 0.00 0.00 39 T 8.40 4.67 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 1.27 0.00 0.00 40 N 8.82 4.37 0.00 2.92 3.02 0.00 0.00 6.83 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 41 C 8.03 4.45 0.00 2.96 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 42 V 8.66 4.50 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 0.80 0.00 0.00 1.02 0.00 0.00 43 K 8.60 4.73 0.00 1.51 1.48 0.00 1.66 0.00 0.00 1.48 0.00 0.00 2.69 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.30 1.15 7.81 44 M 8.83 4.35 0.00 1.74 1.87 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.77 0.00 45 L 8.40 4.26 0.00 1.55 1.58 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 C 7.90 4.86 0.00 2.92 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 47 T 8.24 3.89 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 1.21 0.00 0.00 48 H 8.18 4.28 0.00 3.35 3.39 0.00 5.69 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.36 4.59 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 1.22 0.00 0.00 50 G 7.97 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 51 T 8.73 3.88 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 52 G 8.33 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 53 Q 7.46 4.13 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 54 A 8.84 3.87 -0.09 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 55 I 7.40 5.12 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.45 0.94 0.00 0.00 56 T 9.05 4.83 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 1.21 0.00 0.00 57 V 8.62 3.95 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 0.77 0.00 0.00 0.97 0.00 0.00 58 T 7.50 4.66 4.12 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 1.22 0.00 0.00 59 P 0.00 4.20 0.00 1.81 1.80 0.00 3.22 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.89 0.00 60 E 9.39 4.65 0.00 1.94 1.86 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 2.46 2.37 0.00 61 A 7.79 4.47 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 62 N 8.67 5.38 0.00 3.00 3.02 0.00 0.00 6.94 7.31 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 63 M 8.63 4.20 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.67 0.00 64 D 9.03 4.85 0.00 2.80 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 65 Q 7.92 5.16 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 66 E 8.97 4.79 0.00 1.81 1.28 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 2.21 2.37 0.00 67 S 8.25 5.28 0.00 3.63 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 68 F 9.33 5.34 0.00 3.04 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 69 G 9.27 3.83 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 0.00 0.00 0.00 70 G 9.19 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 0.00 0.00 0.00 71 A 7.99 4.01 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 72 S 7.72 4.24 0.00 4.09 4.04 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 73 C 8.23 4.49 0.00 3.10 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 74 C 7.19 4.65 0.00 2.92 2.90 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 75 L 8.26 3.56 0.00 1.31 0.76 0.36 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 6.97 3.85 0.00 2.55 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 77 C 7.89 4.16 0.00 3.17 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 78 R 8.02 3.85 0.00 1.72 1.81 0.00 3.22 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 79 C 7.56 4.23 0.00 2.80 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 80 H 7.61 4.10 0.00 3.30 3.36 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.37 4.62 1.86 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 1.24 0.75 0.85 0.00 0.00 82 D 8.46 4.75 0.00 2.72 2.72 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 83 H 8.61 4.07 0.00 2.80 2.83 0.00 5.84 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 84 P 0.00 4.68 0.00 1.97 1.82 0.00 2.67 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.30 0.00 85 N 7.19 4.03 0.00 2.66 2.69 0.00 0.00 6.96 7.45 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 *89 F 7.31 4.83 0.00 2.87 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 90 C 7.80 4.51 0.00 1.85 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 0.00 0.00 0.00 0.00 91 D 8.76 4.72 0.00 2.80 2.73 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 92 L 7.62 4.46 0.00 1.69 1.73 0.98 0.90 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 93 K 7.92 3.87 0.00 1.66 1.73 0.00 1.88 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.47 7.81 94 G 8.91 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 95 K 7.80 4.47 0.00 1.74 1.85 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.34 7.81 96 Y 8.76 5.06 0.00 2.98 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 97 V 8.92 4.90 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 1.46 0.00 0.00 1.05 0.00 0.00 98 Q 9.36 5.10 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.34 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 99 I 8.63 4.22 1.96 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.03 0.06 0.00 0.00 100 P 0.00 4.56 0.00 1.62 1.90 0.00 2.20 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 2.01 0.00 101 T 8.87 3.85 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 1.26 0.00 0.00 102 T 7.84 4.15 4.26 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 1.23 0.00 0.00 103 C 7.82 4.69 0.00 2.42 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 0.00 104 A 7.59 4.18 1.51 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 0.00 0.00 105 N 7.93 4.59 0.00 2.87 2.96 0.00 0.00 5.78 8.06 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 0.00 106 D 7.99 4.75 0.00 2.73 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.96 0.00 1.67 0.89 0.00 3.48 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 108 V 7.11 4.32 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 0.86 0.00 0.00 0.75 0.00 0.00 109 G 8.45 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 110 F 8.23 3.86 0.00 3.08 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 0.00 111 T 7.42 3.84 4.54 0.00 0.00 0.00 0.00 0.00 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 0.00 112 L 7.25 4.16 0.00 1.90 1.80 0.95 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 0.00 113 R 7.78 4.12 0.00 1.56 1.85 0.00 3.05 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 114 N 6.88 4.98 0.00 1.52 2.47 0.00 0.00 6.75 8.42 0.00 0.00 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 T 8.24 4.90 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 1.27 0.00 0.00 116 V 8.44 4.05 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 0.54 0.00 0.00 0.27 0.00 0.00 117 C 8.97 4.40 0.00 3.08 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 0.00 118 T 8.73 3.91 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 1.21 0.00 0.00 119 V 7.81 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 0.84 0.00 0.00 0.93 0.00 0.00 120 C 8.03 4.30 0.00 3.14 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 0.00 121 G 8.31 3.79 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 0.00 0.00 0.00 122 M 7.09 4.68 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.48 0.00 123 W 8.51 4.82 0.00 3.89 3.38 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 0.00 124 K 9.39 4.27 0.00 2.00 1.82 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.49 7.81 125 G 10.17 3.83 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 0.00 0.00 0.00 126 Y 8.37 4.91 0.00 3.19 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 0.00 127 G 8.54 3.72 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 0.00 128 C 8.12 4.08 0.00 3.09 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 0.00 129 S 8.78 4.10 0.00 4.06 3.83 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.