NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 N 4.8209 8.2827 119.2158 53.3893 40.0968 174.3389 6 Y 3.9312 9.2229 127.5486 60.0301 38.9892 176.3036 7 F 4.1264 8.5505 120.7094 61.2261 40.1625 175.8347 8 S 4.1272 8.1996 114.5170 61.0091 63.3810 176.7829 9 R 3.8043 7.7550 118.2136 56.5967 29.0546 178.3164 *11 L 3.9608 7.9483 120.2257 54.1684 43.3643 177.8923 12 R 4.3249 7.4688 112.0501 55.7027 29.4332 177.0267 13 G 3.8166 8.1012 104.3284 46.7868 0.0000 174.3101 14 E 4.4421 8.2254 116.8534 55.6842 29.8273 175.5973 15 A 4.6858 7.2287 120.6171 49.6081 22.1797 174.5742 16 P 4.3773 0.0000 0.0000 62.2941 32.0554 176.7758 17 V 3.7783 8.1916 121.9740 61.9440 32.3526 173.9014 18 P 4.3927 0.0000 0.0000 62.4676 32.1379 177.0892 19 A 4.0649 8.9273 124.2406 55.5804 18.1420 180.5428 20 V 3.6084 7.8708 116.7223 64.8843 31.4204 178.3492 21 A 4.1977 8.0972 121.2101 54.7630 18.2467 179.4445 22 G 3.7936 8.2559 103.8688 48.6905 0.0000 175.5774 23 T 4.0397 7.8811 117.2083 66.0825 68.8457 175.8731 24 L 4.6832 8.4339 118.6366 54.1308 41.7117 177.3259 25 G 4.1246 8.2601 107.1679 46.4085 0.0000 174.2309 26 G 4.0757 8.5897 107.8817 44.7215 0.0000 174.6305 27 V 4.3835 7.6993 124.5030 61.0564 34.8720 174.2502 28 I 4.2425 8.4769 129.6823 61.8185 36.8732 176.1376 29 R 4.5746 8.7800 125.6894 56.7963 32.1348 176.3844 30 A 4.6652 7.5865 118.2968 50.9139 22.4801 175.4153 31 V 4.8004 8.3244 119.9624 61.4862 35.3429 174.7631 32 D 4.5326 9.0914 126.3573 52.9923 42.7941 175.6300 33 L 4.0060 8.5911 126.6630 57.0850 42.2971 178.7190 34 E 4.0470 8.3288 118.5699 58.8702 29.8266 177.6104 35 A 3.9889 8.0939 120.5832 53.1509 19.1026 176.9287 36 G 3.6884 8.8500 104.1249 46.2029 0.0000 172.5302 37 S 5.1922 7.3483 111.4166 56.9060 67.6002 173.5830 38 L 4.9498 8.4301 120.6098 54.1924 45.9459 173.3828 39 E 5.2285 9.3712 124.9898 54.6188 33.2519 174.1944 40 S 4.9962 9.3047 120.3792 56.6799 66.5205 172.8028 41 D 5.1034 8.9720 125.8237 54.3711 42.3912 174.9808 42 Y 5.3285 8.9726 117.5705 56.4842 43.0418 174.2892 43 V 4.8965 9.0709 121.2811 61.1738 34.2132 174.6314 44 A 4.8699 9.1465 130.8986 51.3862 20.3210 176.9717 45 T 4.4273 7.1639 113.0034 60.0609 70.7727 175.7310 46 D 4.3330 8.5201 120.4633 56.9230 40.8942 178.4737 47 A 4.1700 7.2436 119.4044 53.7453 18.5805 177.8658 48 F 5.0982 8.0348 114.1477 57.0864 39.4796 175.2533 49 L 4.8683 7.3841 120.8444 53.5323 42.7102 176.5540 50 N 4.7410 9.0121 120.5169 51.3004 38.5730 174.2718 51 P 4.2521 0.0000 0.0000 65.3928 31.2994 177.9566 52 V 3.9079 7.8922 114.9256 61.5485 31.6914 176.6990 53 G 3.8939 8.3251 108.7913 45.7007 0.0000 173.4778 54 Q 4.7101 8.0308 118.6530 54.0292 31.2523 175.2617 55 V 4.1529 8.1687 121.9933 62.7226 32.0773 175.7918 56 Q 3.8587 8.9067 130.1074 56.3713 29.1255 176.5166 57 G 3.0193 8.7113 115.3137 48.5786 0.0000 177.0781 58 G 3.9034 7.3118 108.4139 45.4043 0.0000 175.3195 *60 L 4.2245 8.1256 121.3523 54.3342 43.7636 178.7524 61 G 3.7569 8.4138 107.4971 48.6118 0.0000 175.8427 62 A 4.2220 7.8931 122.0698 52.1675 17.9659 179.2966 *64 L 4.1866 8.0570 121.5353 56.4469 44.0094 179.0589 65 D 4.2855 8.4565 117.9628 57.2884 40.8469 177.8680 66 D 4.3636 7.7124 117.4772 57.4032 41.3950 178.2760 67 V 3.9642 7.7320 118.1396 64.9383 31.7650 178.0383 68 T 4.0788 7.9322 109.9468 64.3517 68.8002 178.1244 69 A 3.9214 7.8694 123.2564 51.4974 18.4665 179.1243 *71 L 3.9835 7.9000 123.9399 56.7208 44.2163 178.8987 72 V 3.6020 7.7506 117.6031 66.4132 31.3302 178.0148 73 T 3.8423 8.0656 115.1757 66.6868 68.0938 176.1534 74 A 3.2364 6.8840 120.8592 55.0464 18.1772 179.0329 75 T 4.0815 7.3700 105.6162 62.0070 69.6959 175.2277 76 L 4.3260 7.1875 122.5013 53.7508 42.2748 176.4722 77 E 4.2645 8.4061 119.4623 55.7443 30.4607 175.8904 78 D 4.5387 8.3495 119.8807 55.8313 41.3413 175.7624 79 G 4.0514 9.0876 110.9187 45.6065 0.0000 173.9284 80 A 4.3241 7.0996 120.0141 51.8578 19.4530 176.5086 81 S 4.5580 8.0844 112.6837 56.7804 65.6308 172.4403 82 C 4.6715 8.5286 126.5779 57.9912 31.9370 172.6627 83 S 4.5303 8.3786 120.9597 56.4970 63.6848 172.7288 84 T 4.5274 8.4662 125.3762 63.5318 68.9823 174.4272 85 L 4.4793 8.9390 126.8575 56.2354 43.1373 176.7189 86 N 5.0622 7.8362 115.3773 51.8165 42.9559 173.0994 87 L 5.0068 8.3796 125.6509 53.5793 45.2373 174.4675 88 N 4.9089 9.2386 125.9901 51.8216 41.0032 173.1482 89 L 5.0544 8.3656 125.5515 52.8932 44.5241 175.8763 90 S 4.3947 8.6364 119.2388 56.4938 66.2578 172.9179 91 F 5.1109 8.5357 122.8188 56.3009 40.0510 174.4728 92 L 4.6623 9.3322 123.6797 55.9307 43.2376 177.4554 93 R 4.7441 7.7726 114.4621 53.3867 34.2061 172.9902 94 P 4.5403 0.0000 0.0000 62.9910 32.2617 175.3545 95 A 4.9794 8.6008 123.2747 50.5655 22.1040 175.3416 96 Q 4.9748 9.3217 118.1894 53.3044 32.2072 175.7134 97 A 4.0501 8.6233 123.2998 53.1671 19.0522 177.5065 98 G 3.8571 8.1550 107.0105 43.6437 0.0000 172.9414 99 L 4.7408 8.1466 119.7773 55.0042 42.3340 176.8280 100 L 5.0780 9.2999 121.3493 53.0859 46.8654 175.2726 101 R 4.8880 9.2924 121.5247 54.7173 32.6448 174.4624 102 G 4.6237 9.7647 114.9136 44.8850 0.0000 172.3584 103 R 5.3083 9.2574 123.2939 54.1913 33.7744 174.4294 104 A 5.3064 9.1932 125.4821 50.1848 22.5792 175.0494 105 R 4.9853 8.8686 120.1403 54.4118 34.0017 174.1940 106 L 4.5797 8.6984 126.8779 54.9300 41.3795 176.9601 107 E 4.2464 9.1513 125.1975 58.8462 30.4731 177.5636 108 R 4.5098 7.7507 118.2177 55.2108 33.8356 174.1643 109 R 4.6138 8.7567 125.7490 54.7318 31.0097 176.0396 110 G 3.9416 8.9693 114.4951 43.7021 0.0000 172.2875 111 R 4.0263 8.6620 118.6319 59.0954 29.8370 176.9554 112 N 4.9572 8.0557 110.1412 52.4075 40.9107 174.2798 113 V 4.7530 7.5828 118.2499 61.0753 35.1083 173.7093 114 C 5.2926 9.1091 124.4632 58.0274 31.6600 172.4934 115 N 5.3711 9.0590 121.0561 51.6478 40.3360 174.0461 116 V 4.8246 8.7109 123.7254 61.0606 35.0795 174.5207 117 V 4.8530 9.0342 119.9128 59.5397 34.8143 174.9443 118 G 4.5244 9.0002 110.4731 44.5268 0.0000 171.4378 119 E 5.2244 9.2920 121.2064 54.1171 34.1635 174.3987 120 L 5.2249 9.0401 125.1329 53.4756 45.0779 175.3443 121 S 5.4196 9.2328 122.0159 56.9913 66.9160 172.9276 122 Q 4.6589 8.7982 122.6067 55.4355 32.7154 174.4714 123 D 4.1246 9.9670 125.2452 55.5399 38.6156 174.6672 124 G 3.9807 8.5922 103.8554 45.4826 0.0000 174.0150 125 K 4.6583 7.7761 118.6406 53.7870 35.2254 175.6843 126 L 4.5715 8.5023 122.6157 55.2888 42.2088 177.2561 127 V 4.3630 9.2267 117.1416 62.9334 33.5634 175.8897 128 A 5.1428 7.7123 119.6590 50.9653 22.6115 175.2790 129 T 5.1606 8.9440 109.7402 59.9755 72.8000 172.5212 130 A 5.1804 8.9328 122.3953 50.7980 23.3989 175.1647 131 T 4.9547 8.7669 115.5607 61.6494 72.0327 172.9890 132 A 5.1382 8.9651 128.2412 50.3698 22.2063 174.9744 133 T 4.8234 8.7454 119.1419 62.4050 70.8376 173.4630 134 C 5.2055 8.4044 125.3113 56.8951 32.6074 175.0908 *136 V 4.8678 8.2213 111.7207 62.6571 31.5875 175.4685 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 5 N 8.28 4.82 0.00 2.89 2.95 0.00 0.00 6.68 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 6 Y 9.22 3.93 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 7 F 8.55 4.13 0.00 3.13 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 8 S 8.20 4.13 0.00 4.06 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 0.00 9 R 7.75 3.80 0.00 1.92 1.86 0.00 3.14 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 *11 L 7.95 3.96 0.00 1.58 1.58 0.81 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.47 4.32 0.00 1.88 1.92 0.00 3.10 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.47 0.00 13 G 8.10 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 14 E 8.23 4.44 0.00 1.89 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 2.39 2.34 0.00 15 A 7.23 4.69 1.03 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 0.00 0.00 16 P 0.00 4.38 0.00 2.25 2.11 0.00 3.88 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 17 V 8.19 3.78 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 0.85 0.00 0.00 0.90 0.00 0.00 18 P 0.00 4.39 0.00 2.29 2.01 0.00 3.77 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 19 A 8.93 4.06 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 20 V 7.87 3.61 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 0.86 0.00 0.00 0.94 0.00 0.00 21 A 8.10 4.20 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 22 G 8.26 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 23 T 7.88 4.04 4.51 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 1.37 0.00 0.00 24 L 8.43 4.68 0.00 1.94 1.91 0.90 0.59 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 25 G 8.26 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 0.00 0.00 0.00 0.00 26 G 8.59 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.70 4.38 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 0.78 0.00 0.00 0.88 0.00 0.00 28 I 8.48 4.24 1.83 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.89 1.05 0.00 0.00 29 R 8.78 4.57 0.00 1.64 1.95 0.00 3.33 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 30 A 7.59 4.67 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.32 4.80 2.17 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 0.84 0.00 0.00 1.17 0.00 0.00 32 D 9.09 4.53 0.00 2.71 2.48 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 33 L 8.59 4.01 0.00 1.67 1.69 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.33 4.05 0.00 1.92 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 2.28 2.30 0.00 35 A 8.09 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.85 3.69 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 0.00 0.00 0.00 37 S 7.35 5.19 0.00 3.93 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 38 L 8.43 4.95 0.00 1.73 1.51 1.01 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 39 E 9.37 5.23 0.00 2.04 1.73 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 2.20 2.40 0.00 40 S 9.30 5.00 0.00 3.83 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.97 5.10 0.00 2.45 2.48 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 42 Y 8.97 5.33 0.00 2.91 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 43 V 9.07 4.90 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 0.75 0.00 0.00 0.95 0.00 0.00 44 A 9.15 4.87 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 45 T 7.16 4.43 3.92 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 0.90 0.00 0.00 46 D 8.52 4.33 0.00 2.66 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 47 A 7.24 4.17 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.03 5.10 0.00 3.13 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 49 L 7.38 4.87 0.00 1.74 1.60 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 50 N 9.01 4.74 0.00 2.87 2.94 0.00 0.00 6.95 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 51 P 0.00 4.25 0.00 2.05 2.16 0.00 3.65 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 2.02 2.07 0.00 52 V 7.89 3.91 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 0.73 0.00 0.00 0.93 0.00 0.00 53 G 8.33 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 54 Q 8.03 4.71 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 55 V 8.17 4.15 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 0.78 0.00 0.00 1.03 0.00 0.00 56 Q 8.91 3.86 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.68 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 57 G 8.71 3.02 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 58 G 7.31 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 0.00 0.00 0.00 *60 L 8.13 4.22 0.00 2.00 1.86 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.41 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 0.00 0.00 0.00 62 A 7.89 4.22 1.17 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 *64 L 8.06 4.19 0.00 1.84 1.72 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.46 4.29 0.00 2.81 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.71 4.36 0.00 2.84 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 67 V 7.73 3.96 2.37 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 1.00 0.00 0.00 1.08 0.00 0.00 68 T 7.93 4.08 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 1.26 0.00 0.00 69 A 7.87 3.92 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.90 3.98 0.00 1.74 1.85 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.75 3.60 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 0.96 0.00 0.00 0.99 0.00 0.00 73 T 8.07 3.84 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 1.45 0.00 0.00 74 A 6.88 3.24 0.30 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 75 T 7.37 4.08 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 1.17 0.00 0.00 76 L 7.19 4.33 0.00 1.77 1.65 0.92 0.78 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 77 E 8.41 4.26 0.00 2.13 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 0.00 2.37 2.28 0.00 78 D 8.35 4.54 0.00 2.70 2.68 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 79 G 9.09 4.05 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 0.00 80 A 7.10 4.32 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 81 S 8.08 4.56 0.00 3.78 3.62 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 0.00 0.00 0.00 0.00 82 C 8.53 4.67 0.00 2.96 2.81 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 83 S 8.38 4.53 0.00 3.83 3.66 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 84 T 8.47 4.53 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 85 L 8.94 4.48 0.00 1.55 1.70 0.91 0.94 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 86 N 7.84 5.06 0.00 2.69 2.56 0.00 0.00 6.56 6.66 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 87 L 8.38 5.01 0.00 1.58 1.45 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 88 N 9.24 4.91 0.00 2.72 2.59 0.00 0.00 6.56 6.38 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 89 L 8.37 5.05 0.00 1.13 0.88 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.64 4.39 0.00 3.57 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 91 F 8.54 5.11 0.00 2.95 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 92 L 9.33 4.66 0.00 1.59 1.71 0.96 0.85 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 93 R 7.77 4.74 0.00 1.76 1.79 0.00 3.42 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 94 P 0.00 4.54 0.00 2.08 2.16 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 95 A 8.60 4.98 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 96 Q 9.32 4.97 0.00 1.87 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 97 A 8.62 4.05 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 98 G 8.15 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 0.00 0.00 0.00 99 L 8.15 4.74 0.00 1.57 1.64 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 100 L 9.30 5.08 0.00 1.71 1.71 1.06 0.71 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 0.00 101 R 9.29 4.89 0.00 1.89 1.80 0.00 3.15 0.00 0.00 3.37 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 102 G 9.76 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 R 9.26 5.31 0.00 1.73 1.82 0.00 3.10 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 104 A 9.19 5.31 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 0.00 105 R 8.87 4.99 0.00 1.83 1.71 0.00 3.09 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 106 L 8.70 4.58 0.00 1.55 1.59 0.89 0.97 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 0.00 107 E 9.15 4.25 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 2.32 2.39 0.00 108 R 7.75 4.51 0.00 1.84 1.70 0.00 3.13 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 109 R 8.76 4.61 0.00 1.70 1.86 0.00 3.23 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 110 G 8.97 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 0.00 0.00 0.00 111 R 8.66 4.03 0.00 1.78 1.97 0.00 3.17 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 112 N 8.06 4.96 0.00 2.70 2.78 0.00 0.00 6.59 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 0.00 113 V 7.58 4.75 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 0.87 0.00 0.00 0.92 0.00 0.00 114 C 9.11 5.29 0.00 2.84 2.75 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 0.00 115 N 9.06 5.37 0.00 2.60 2.71 0.00 0.00 6.14 8.45 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 0.00 116 V 8.71 4.82 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 1.08 0.00 0.00 0.92 0.00 0.00 117 V 9.03 4.85 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 0.67 0.00 0.00 0.92 0.00 0.00 118 G 9.00 4.52 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 0.00 0.00 0.00 119 E 9.29 5.22 0.00 1.88 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 0.00 2.21 2.22 0.00 120 L 9.04 5.22 0.00 1.73 1.51 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 121 S 9.23 5.42 0.00 3.79 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 0.00 122 Q 8.80 4.66 0.00 2.13 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.23 0.00 0.00 0.00 0.00 0.00 2.28 2.56 0.00 123 D 9.97 4.12 0.00 2.84 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 0.00 124 G 8.59 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 0.00 125 K 7.78 4.66 0.00 1.82 1.68 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.37 7.81 126 L 8.50 4.57 0.00 1.65 1.64 0.93 0.98 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 0.00 127 V 9.23 4.36 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 0.75 0.00 0.00 1.03 0.00 0.00 128 A 7.71 5.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.94 5.16 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 1.19 0.00 0.00 130 A 8.93 5.18 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 0.00 131 T 8.77 4.95 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 1.19 0.00 0.00 132 A 8.97 5.14 1.19 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 0.00 0.00 133 T 8.75 4.82 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 1.20 0.00 0.00 134 C 8.40 5.21 0.00 2.83 2.81 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 *136 V 8.22 4.87 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 0.78 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.