NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4631 8.2493 123.5828 52.5138 19.9651 176.2851 2 T 4.4454 8.4046 111.3490 60.5160 71.1671 171.9798 3 K 5.1887 9.0212 125.0690 55.0633 36.3869 176.5019 4 V 5.2522 9.1110 119.5768 59.7796 36.5163 174.5871 5 V 4.9693 8.8176 120.4153 60.5984 35.3040 173.7061 6 C 4.9335 9.1439 122.0552 57.9112 35.1950 172.6132 7 V 4.5425 8.4239 126.1432 61.5079 33.0784 174.2445 8 L 4.7774 8.9988 129.5113 54.0562 42.9826 176.2874 9 K 4.8686 9.1472 122.2480 55.4128 37.0949 176.3456 10 G 4.3211 7.9706 108.3033 45.4969 0.0000 172.0536 11 D 4.5908 8.7895 117.8875 55.4512 42.0406 177.3718 12 G 4.2909 7.6736 109.1226 44.7389 0.0000 171.9840 13 P 4.5064 0.0000 0.0000 63.0616 32.2092 175.6758 14 V 4.3310 7.5345 120.6297 62.9311 32.1393 174.9513 15 Q 4.8227 8.6051 124.5853 55.4769 32.4811 173.4720 16 G 4.2177 8.0772 106.5481 46.3000 0.0000 171.8896 17 I 5.1976 7.9763 119.3117 59.4467 40.8461 175.1000 18 I 4.7166 8.8025 127.5420 59.4802 40.4449 174.3232 19 N 5.0335 8.5548 124.0171 51.4469 41.1334 173.9286 20 F 5.2834 8.9425 120.0977 55.7444 43.1025 173.6434 21 E 5.1837 9.7642 123.7069 54.7656 33.2396 174.1819 22 Q 4.6573 9.3943 127.6343 54.3516 29.6150 174.5853 23 K 4.1928 8.8305 125.0353 57.7062 32.9016 177.3310 24 E 4.6954 7.8953 118.5845 53.8768 31.6897 175.4979 25 S 4.2328 8.6820 119.7064 60.3415 63.2735 174.1647 26 N 4.2097 8.9529 120.1117 53.8078 35.9969 174.3921 27 G 4.0224 7.9659 108.4668 43.4481 0.0000 171.9399 28 P 4.4736 0.0000 0.0000 62.6646 32.1783 176.4362 29 V 4.5905 8.9454 123.4990 61.4124 33.5493 174.6599 30 K 4.9392 9.1943 128.1576 55.5694 33.9810 175.8209 31 V 4.8219 9.1723 125.0967 60.7803 34.3615 174.2520 32 W 5.9683 7.7201 123.4924 55.4355 31.8103 175.2805 33 G 3.7993 7.7743 106.4137 46.2032 0.0000 170.8781 34 S 5.0977 7.7153 114.0788 57.0163 66.6559 174.4331 35 I 5.1167 8.7689 125.6009 59.3700 41.0899 174.6138 36 K 4.8303 9.3811 125.1827 55.4957 36.2378 176.9645 37 G 3.9475 8.9050 106.2615 46.5682 0.0000 173.4403 38 L 4.4407 7.6002 119.9748 53.1332 42.9892 176.4261 39 T 4.2452 8.1644 111.5595 61.0644 69.5058 174.0482 40 E 4.0976 8.6734 125.0235 57.5574 30.5477 175.1203 41 G 3.7884 8.2803 110.4424 44.1126 0.0000 172.1356 42 L 4.9736 8.2118 119.2138 54.2770 43.2593 176.3686 43 H 4.9832 9.2124 119.4082 53.7335 33.0563 173.3499 44 G 4.0973 9.2972 111.2443 46.7687 0.0000 172.3637 45 F 5.5521 8.7551 124.2386 56.8175 42.5578 173.0934 46 H 5.3710 9.0213 122.9684 54.0430 33.4536 172.8981 47 V 4.3247 8.8944 123.1089 62.8198 32.7897 174.8698 48 H 5.2226 9.4538 125.2320 54.0014 31.2350 175.4268 49 E 3.7412 8.9388 121.9847 58.6791 29.6292 177.1035 50 F 4.9307 8.3479 118.3215 54.8026 41.6385 177.0559 51 G 4.3967 8.2976 113.3489 44.0121 0.0000 174.2762 52 D 4.7281 7.8003 116.6115 52.7867 42.9130 174.0936 53 N 5.0828 8.5787 124.5901 53.4653 39.1794 175.6390 54 T 3.9386 8.5271 109.7262 63.4533 69.2594 174.2785 55 A 4.7264 7.9864 124.9435 51.5401 19.6609 175.6432 56 G 3.8211 7.8887 113.1911 47.2909 0.0000 176.1267 57 C 4.4341 8.6094 116.2363 59.2783 40.6129 175.5621 58 T 3.8358 7.5786 110.3130 63.5772 68.2567 175.5546 59 S 4.6115 7.6064 115.5989 58.4575 63.4104 175.3764 60 A 4.2433 7.3898 126.4749 53.8707 18.2054 178.7713 61 G 4.1530 7.8064 105.7754 43.7786 0.0000 171.1756 62 P 4.6448 0.0000 0.0000 62.3320 33.0449 175.3815 63 H 4.0456 8.6621 117.0211 56.0275 29.2898 175.3437 64 F 4.2446 9.1057 126.0100 58.4746 40.0576 174.8179 65 N 4.6960 7.9287 123.3036 51.8400 40.0663 171.7584 66 P 4.2296 0.0000 0.0000 62.4668 32.3910 177.0167 67 L 4.3652 7.9550 121.4863 53.1311 41.3675 175.3098 *80 H 4.6850 7.9997 119.0025 54.9717 30.2115 174.6234 81 V 3.4232 8.5116 123.1261 66.2414 31.4069 177.4522 82 G 3.8858 8.3766 106.3468 46.0371 0.0000 172.6175 83 D 4.9311 8.0531 121.2427 54.1142 40.6642 176.1353 84 L 4.5169 8.7889 124.0478 54.2728 42.8214 178.1479 85 G 3.9055 8.1600 106.3249 44.3948 0.0000 171.6176 86 N 5.4214 8.4374 116.3988 51.8904 40.8422 175.1726 87 V 4.2475 8.5823 115.6407 60.2711 34.8212 175.0639 88 T 4.9376 8.2107 118.9974 61.8608 71.0548 173.0981 89 A 4.8084 9.1684 129.8182 51.0721 20.7394 177.1986 90 D 5.1003 8.6294 121.9565 52.0987 41.8421 177.1405 91 K 3.9645 8.5313 117.1515 59.4393 32.0514 177.5643 92 D 4.5448 8.3847 117.0228 54.0368 41.2002 177.2229 93 G 4.1684 8.6150 108.6710 44.4581 0.0000 172.5661 94 V 4.7340 7.8175 119.4906 60.8604 33.8099 174.1851 95 A 5.4060 9.0539 130.1275 49.5974 20.8482 175.1162 96 D 4.7971 8.6508 122.8576 54.1241 42.2698 176.2612 97 V 4.2949 8.7491 123.5387 61.1195 34.1801 174.6195 98 S 4.8270 8.5798 122.7080 57.5459 64.2191 172.7067 99 I 4.8362 9.3397 128.1740 59.3136 41.4929 174.1401 100 E 5.2255 8.8559 125.1739 54.5217 32.2722 174.5096 101 D 4.8389 9.3170 125.7362 52.7055 44.6184 175.6514 102 S 4.7175 8.9575 120.0911 58.4598 63.6531 174.4560 103 V 4.1485 8.3889 121.6803 64.3451 32.3127 176.5208 104 I 4.0824 7.8269 110.8676 61.2017 38.3088 174.2646 105 S 4.6041 8.3842 114.3136 57.7827 65.3699 174.1875 106 L 4.3991 8.8333 122.5631 54.2093 41.4287 176.2361 107 S 4.4681 7.9000 112.6592 58.0571 66.4984 175.0517 108 G 3.8872 8.5179 107.8916 45.2480 0.0000 173.8304 109 D 4.4288 8.7933 117.5418 57.2899 41.0756 176.8146 110 H 5.0879 8.0275 114.7314 55.4810 29.0704 173.8266 111 C 4.4060 8.0786 121.1449 59.8919 31.7259 173.4680 112 I 3.8593 8.1163 119.0900 60.2630 37.9996 175.5665 113 I 3.7197 7.3403 123.0939 62.8397 37.5136 176.3069 114 G 3.7894 9.1756 113.1419 45.7101 0.0000 173.2430 115 R 4.7505 7.3877 119.6366 54.9093 33.4597 174.6649 116 T 4.9969 7.9725 115.1243 62.1007 71.5044 173.4939 117 L 4.8467 8.5311 128.2434 53.8115 44.1552 175.2758 118 V 5.0366 8.8944 125.9335 60.9972 35.1478 174.1573 119 V 5.0852 8.6160 126.9420 60.5709 33.4587 174.7117 120 H 5.2866 9.0668 122.1133 54.0470 30.5483 174.7309 121 E 4.2075 9.3210 122.4661 58.7752 30.0135 177.2890 122 K 4.5862 8.0246 117.0069 54.0626 34.8992 175.3279 123 A 4.5956 8.1414 123.1902 52.2369 19.3724 178.4702 124 D 4.5568 8.9989 122.3602 53.4590 39.1294 175.3485 *142 S 4.3184 7.5172 117.0228 58.3180 65.7968 174.0982 143 R 4.5907 8.3296 118.6300 54.8827 29.9977 176.7485 144 L 4.2935 8.8758 125.8379 57.5457 42.9871 177.2091 145 A 4.9765 7.7491 117.6930 51.4761 22.7136 173.9972 146 C 5.5851 8.6051 113.4381 55.9597 45.9963 172.7427 147 G 4.6845 8.0887 104.4010 46.1579 0.0000 172.4812 148 V 4.4795 8.2468 120.7597 62.2997 32.7991 175.4851 149 I 4.1827 8.7913 129.2859 60.7724 38.0066 175.2222 150 G 4.4524 8.9150 114.6411 43.8200 0.0000 171.9762 151 I 4.2275 8.3587 121.9723 61.4096 36.9866 175.8021 152 A 4.5880 8.5221 128.3241 52.3655 21.5876 176.3135 153 Q 4.1841 7.7777 121.0136 57.0040 29.2120 173.2394 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 A 8.25 4.46 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 2 T 8.40 4.45 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 1.24 0.00 0.00 3 K 9.02 5.19 0.00 1.89 1.66 0.00 1.90 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.35 1.62 7.81 4 V 9.11 5.25 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 0.63 0.00 0.00 0.77 0.00 0.00 5 V 8.82 4.97 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 0.84 0.00 0.00 0.95 0.00 0.00 6 C 9.14 4.93 0.00 3.06 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 7 V 8.42 4.54 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 9.00 4.78 0.00 1.71 1.60 1.05 0.48 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 9 K 9.15 4.87 0.00 1.64 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 7.97 4.32 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 0.00 11 D 8.79 4.59 0.00 2.68 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 12 G 7.67 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 13 P 0.00 4.51 0.00 2.22 2.29 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.94 0.00 14 V 7.53 4.33 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 0.83 0.00 0.00 0.93 0.00 0.00 15 Q 8.61 4.82 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.45 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 16 G 8.08 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 0.00 0.00 0.00 0.00 17 I 7.98 5.20 1.83 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 1.21 1.08 0.84 0.00 0.00 18 I 8.80 4.72 1.88 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 1.27 1.32 0.49 0.00 0.00 19 N 8.55 5.03 0.00 1.44 1.48 0.00 0.00 6.43 8.17 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 20 F 8.94 5.28 0.00 2.83 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 21 E 9.76 5.18 0.00 2.39 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 2.33 2.57 0.00 22 Q 9.39 4.66 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.79 0.00 0.00 0.00 0.00 0.00 2.49 2.64 0.00 23 K 8.83 4.19 0.00 1.82 1.89 0.00 1.81 0.00 0.00 1.90 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.44 7.81 24 E 7.90 4.70 0.00 2.06 1.84 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 2.30 2.36 0.00 25 S 8.68 4.23 0.00 3.87 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 26 N 8.95 4.21 0.00 2.89 2.95 0.00 0.00 6.98 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 27 G 7.97 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.47 0.00 1.99 2.14 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.95 4.59 2.32 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 1.31 0.00 0.00 1.05 0.00 0.00 30 K 9.19 4.94 0.00 1.98 1.89 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.77 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.47 1.44 7.81 31 V 9.17 4.82 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 0.42 0.00 0.00 0.99 0.00 0.00 32 W 7.72 5.97 0.00 3.49 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 33 G 7.77 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 34 S 7.72 5.10 0.00 3.87 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 35 I 8.77 5.12 1.77 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.62 0.93 0.00 0.00 36 K 9.38 4.83 0.00 1.72 1.87 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.34 7.81 37 G 8.91 3.95 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 0.00 0.00 0.00 38 L 7.60 4.44 0.00 1.82 1.44 0.80 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.16 4.25 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 1.24 0.00 0.00 40 E 8.67 4.10 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 2.30 2.45 0.00 41 G 8.28 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 42 L 8.21 4.97 0.00 1.50 1.58 0.92 0.92 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 43 H 9.21 4.98 0.00 2.99 3.32 0.00 5.63 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 44 G 9.30 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 45 F 8.76 5.55 0.00 2.93 2.99 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 46 H 9.02 5.37 0.00 3.10 2.87 0.00 5.86 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.89 4.32 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 0.81 0.00 0.00 0.85 0.00 0.00 48 H 9.45 5.22 0.00 3.01 3.41 0.00 5.68 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.94 3.74 0.00 1.71 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 1.47 2.00 0.00 50 F 8.35 4.93 0.00 3.11 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 51 G 8.30 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.80 4.73 0.00 2.61 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 53 N 8.58 5.08 0.00 2.69 2.74 0.00 0.00 7.26 7.70 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 54 T 8.53 3.94 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 1.24 0.00 0.00 55 A 7.99 4.73 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 56 G 7.89 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 57 C 8.61 4.43 0.00 2.97 3.09 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 58 T 7.58 3.84 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 1.22 0.00 0.00 59 S 7.61 4.61 0.00 4.08 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 60 A 7.39 4.24 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.81 4.15 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 0.00 62 P 0.00 4.64 0.00 2.11 2.22 0.00 3.77 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 2.18 2.05 0.00 63 H 8.66 4.05 0.00 2.55 3.02 0.00 5.72 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 64 F 9.11 4.24 0.00 2.78 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 65 N 7.93 4.70 0.00 2.62 2.59 0.00 0.00 7.24 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 66 P 0.00 4.23 0.00 1.93 1.89 0.00 2.84 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 1.63 1.57 0.00 67 L 7.96 4.37 0.00 1.58 1.58 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 *80 H 8.00 4.69 0.00 3.54 3.41 0.00 5.84 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 81 V 8.51 3.42 1.70 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 0.45 0.00 0.00 0.57 0.00 0.00 82 G 8.38 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 83 D 8.05 4.93 0.00 2.88 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 84 L 8.79 4.52 0.00 1.84 1.85 0.78 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.16 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 86 N 8.44 5.42 0.00 2.62 2.74 0.00 0.00 6.69 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 87 V 8.58 4.25 1.80 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 -0.16 0.00 0.00 0.73 0.00 0.00 88 T 8.21 4.94 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 1.20 0.00 0.00 89 A 9.17 4.81 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 0.00 0.00 0.00 0.00 0.00 90 D 8.63 5.10 0.00 2.89 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 91 K 8.53 3.96 0.00 1.75 1.92 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.71 7.81 92 D 8.38 4.54 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 93 G 8.62 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 0.00 0.00 0.00 94 V 7.82 4.73 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 1.04 0.00 0.00 0.92 0.00 0.00 95 A 9.05 5.41 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 96 D 8.65 4.80 0.00 2.56 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 97 V 8.75 4.29 2.01 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 0.88 0.00 0.00 0.66 0.00 0.00 98 S 8.58 4.83 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 99 I 9.34 4.84 1.97 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.55 1.00 0.00 0.00 100 E 8.86 5.23 0.00 1.97 1.83 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 2.21 2.31 0.00 101 D 9.32 4.84 0.00 2.78 2.54 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 0.00 102 S 8.96 4.72 0.00 3.91 3.88 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 0.00 103 V 8.39 4.15 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 0.79 0.00 0.00 0.96 0.00 0.00 104 I 7.83 4.08 1.93 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.81 1.04 0.00 0.00 105 S 8.38 4.60 0.00 3.83 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 0.00 106 L 8.83 4.40 0.00 1.77 1.64 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.90 4.47 0.00 3.92 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 0.00 108 G 8.52 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 0.00 109 D 8.79 4.43 0.00 2.61 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 0.00 110 H 8.03 5.09 0.00 3.23 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.08 4.41 0.00 3.10 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 0.00 112 I 8.12 3.86 1.51 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.19 0.90 0.00 0.00 113 I 7.34 3.72 1.78 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 1.23 0.42 0.84 0.00 0.00 114 G 9.18 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 0.00 115 R 7.39 4.75 0.00 1.53 1.78 0.00 2.21 0.00 0.00 2.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.30 0.00 116 T 7.97 5.00 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 1.23 0.00 0.00 117 L 8.53 4.85 0.00 1.78 1.53 0.39 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.89 5.04 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 0.72 0.00 0.00 0.74 0.00 0.00 119 V 8.62 5.09 2.28 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 0.76 0.00 0.00 0.95 0.00 0.00 120 H 9.07 5.29 0.00 3.15 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.32 4.21 0.00 2.07 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 2.37 2.35 0.00 122 K 8.02 4.59 0.00 1.88 1.70 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.43 7.81 123 A 8.14 4.60 1.23 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 0.00 0.00 124 D 9.00 4.56 0.00 2.70 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 *142 S 7.52 4.32 0.00 3.95 4.09 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 0.00 143 R 8.33 4.59 0.00 1.67 1.83 0.00 3.24 0.00 0.00 3.10 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.65 0.00 144 L 8.88 4.29 0.00 1.73 1.70 0.95 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.75 4.98 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 0.00 146 C 8.61 5.59 0.00 3.01 3.11 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 0.00 147 G 8.09 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.25 4.48 2.05 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 0.81 0.00 0.00 0.91 0.00 0.00 149 I 8.79 4.18 1.79 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.43 0.54 0.00 0.00 150 G 8.91 4.45 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 0.00 151 I 8.36 4.23 1.85 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 1.25 0.54 0.90 0.00 0.00 152 A 8.52 4.59 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 0.00 153 Q 7.78 4.18 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 * Residues marked with a * may have inaccurate shift predictions.