NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 G 3.9168 8.3544 109.7399 43.9693 0.0000 173.9406 14 D 4.5981 7.1224 120.4779 52.6027 44.3734 175.4090 15 D 4.4384 8.2752 127.6689 56.5584 41.7526 178.1717 16 Q 3.6068 8.0543 119.8026 59.1224 29.0188 178.4295 17 V 3.8218 8.1010 119.3682 66.1339 31.6707 178.1015 18 S 4.1148 7.8738 114.1594 61.3983 62.7831 176.1296 19 E 3.9904 8.0562 122.8347 59.1053 29.3266 178.8556 20 F 4.8479 8.2061 118.1197 60.5039 38.8896 177.6558 21 K 3.5648 8.7182 119.8324 59.3378 31.9473 178.7195 22 E 3.8695 8.5029 118.9501 59.2785 29.3866 179.2555 23 A 3.5156 8.1365 120.6774 54.9628 18.2606 179.2942 24 F 3.4660 8.0419 117.8859 61.4198 39.7740 176.7872 25 E 4.0368 8.3359 118.1804 59.4610 29.0086 179.4183 26 L 4.0141 7.2802 117.9953 57.6353 41.7768 179.0104 27 F 4.7023 7.4062 115.5585 58.4904 40.1329 175.8398 28 D 4.7243 7.4649 119.8680 53.2015 38.9101 176.8663 29 S 4.3524 7.6929 112.6693 59.7805 64.0641 175.0478 30 E 4.1438 7.9731 119.5937 56.4217 29.8005 176.0741 31 R 3.9365 7.7261 117.1810 57.6167 27.6850 177.0774 32 T 4.0419 8.0725 108.1416 61.6039 69.6809 175.8132 33 G 4.1537 10.1786 110.5635 45.0178 0.0000 172.5980 34 F 5.5012 6.9888 111.6936 55.9588 41.4519 173.5900 35 I 4.6397 9.0299 121.1775 59.9617 39.4264 175.9478 36 T 5.1702 8.5298 117.3140 59.8761 71.1777 176.1208 37 K 3.5842 8.4631 120.6631 59.4719 31.8049 178.7846 38 E 4.0090 8.3422 119.1231 59.6084 29.3540 179.1472 39 G 3.6375 8.3257 105.4560 47.6725 0.0000 175.4579 40 L 4.0536 8.6192 123.1914 57.9367 42.2533 178.9061 41 Q 3.9633 8.3920 118.1292 59.4634 28.5781 179.2420 42 T 3.8938 7.7550 116.4139 66.4807 68.4798 176.9144 43 V 3.9931 8.0099 121.7326 65.6077 31.5667 178.0722 44 L 4.0897 8.2952 118.9333 57.7793 41.2349 179.7524 45 K 4.0113 8.0704 118.1502 59.3931 32.0290 179.3117 46 Q 3.9567 8.3932 118.5808 58.8547 28.5327 178.3450 47 F 4.6633 8.2464 114.9250 56.4302 39.4792 175.9279 48 G 3.8400 7.6583 106.6558 46.6012 0.0000 173.8608 49 V 4.1897 7.7767 119.6997 60.8885 32.4884 175.0204 50 R 4.5555 8.4837 126.5158 54.8910 31.3147 176.2655 51 V 4.4916 8.0678 115.0707 58.7429 35.3343 176.0366 52 E 4.2628 8.6522 123.6433 55.2001 31.4926 176.1093 53 P 4.2783 0.0000 0.0000 66.0868 31.4028 178.8486 54 A 4.0263 8.0470 118.4530 55.2470 18.3783 179.4263 55 A 4.0226 8.0313 118.7798 54.9422 18.4087 179.5699 56 F 4.0338 8.4839 119.6128 61.6750 39.5490 177.1330 57 N 4.3179 8.4031 116.1716 56.2070 38.2535 177.0152 58 E 3.9300 8.2435 120.9907 59.5084 29.6428 178.8523 59 M 4.2790 8.0824 118.5079 57.6806 31.2159 178.3562 60 F 3.7650 8.0587 121.7962 61.1232 39.3567 177.0114 61 N 4.3653 8.1628 114.8832 56.1148 38.1290 176.9352 62 E 4.0118 8.3240 120.1338 59.3281 29.3107 179.2043 63 A 4.0098 7.3413 119.5389 53.9418 20.2355 178.3973 64 D 4.3910 7.7737 118.7047 52.7404 38.1164 176.4944 65 A 3.9754 7.7763 125.6642 54.8766 19.1055 179.3466 66 T 3.9754 8.4101 104.8077 62.3161 69.1830 175.3788 67 G 3.8962 7.9634 110.4070 46.6840 0.0000 173.8516 68 N 4.6216 8.6071 114.4854 52.0830 37.6247 175.6678 69 G 4.1479 9.8422 108.5456 45.4281 0.0000 172.9673 70 K 5.0945 7.9981 118.1528 54.7099 35.8185 176.0903 71 I 4.3373 9.1776 127.5278 60.4870 38.1141 175.8239 72 Q 4.7385 9.6455 127.3547 55.2255 30.1715 177.2830 73 F 3.0137 8.7235 122.7419 61.0920 39.2142 175.6670 74 P 3.9514 0.0000 0.0000 65.4082 31.1158 178.5233 75 E 3.8179 7.8784 116.8851 59.2308 29.4317 178.7838 76 F 4.0602 8.0167 120.6487 61.1631 39.3816 176.7458 77 L 3.4566 7.7940 120.1057 58.0838 41.7947 178.7599 78 S 3.8958 7.7517 112.9158 61.5185 62.1050 175.9112 79 M 3.8166 7.5690 120.3044 58.8672 32.0241 178.1458 80 M 3.6560 7.5466 119.1928 58.0005 32.0090 178.8251 81 G 3.6724 7.7992 106.1548 47.9553 0.0000 175.7598 82 R 3.8883 7.5955 119.2697 59.0875 30.1988 178.9527 83 R 4.2413 7.4877 115.9881 57.6321 30.5802 177.2019 84 M 4.8117 7.9305 116.2200 54.5099 33.3117 177.5186 85 K 4.1003 8.0397 119.7537 59.7200 32.7628 178.0087 86 Q 4.2819 7.9548 116.0564 56.3556 29.1766 175.9055 87 T 4.2204 7.5762 108.9700 61.5838 69.4429 173.0328 88 T 4.7332 8.0069 111.6884 58.8400 72.2308 173.8935 89 S 4.4334 8.2708 116.1623 58.1440 64.8150 174.6280 90 E 3.0294 7.9977 122.4289 59.2295 29.2026 178.6685 91 D 4.2859 7.7524 118.4340 57.3306 41.0082 178.6711 92 I 3.7589 7.5834 119.9990 64.1204 37.1967 178.0622 93 L 3.9401 7.8543 120.9941 57.8602 41.9161 178.9166 94 R 4.0846 8.2371 118.8522 59.8262 29.9686 178.4655 95 Q 4.0311 8.2204 117.4799 59.0042 28.4163 178.9802 96 A 3.9542 7.6024 120.8219 55.1546 18.7125 179.4423 97 F 4.4318 8.2129 118.8283 61.2416 38.8489 178.7552 98 R 4.2672 8.0645 120.2298 61.3542 28.8710 181.8165 99 T 3.9118 7.3733 113.9197 66.4628 68.4170 174.9980 100 F 4.7557 7.6816 116.1697 57.4319 39.4787 176.5249 101 D 4.9169 7.6172 119.9446 52.4806 41.9420 172.7558 102 P 4.4462 0.0000 0.0000 64.9398 32.0076 177.1733 103 E 4.4000 8.0184 116.4460 55.7332 30.3141 175.6167 104 G 4.1599 8.2837 106.4954 46.4457 0.0000 175.7662 105 T 3.9298 8.3367 119.1007 64.4716 68.8004 176.2493 106 G 3.9691 8.9893 108.2051 45.3838 0.0000 172.0866 107 Y 4.9963 7.9964 115.7083 56.0383 41.7176 174.9462 108 I 4.8499 8.8906 123.0339 58.7209 41.3538 173.2403 109 P 4.6397 0.0000 0.0000 62.5670 31.9359 177.5676 110 K 4.1347 9.1024 125.5746 59.4590 31.8953 178.8519 111 A 4.1119 8.1064 120.5134 54.5272 18.2124 179.4041 112 A 3.9898 8.1121 119.7532 55.3626 18.4145 179.6633 113 L 3.6304 7.9015 118.4728 57.9664 42.2254 178.6687 114 Q 3.1375 7.9539 119.4275 58.9243 28.9337 178.0924 115 D 4.2272 7.7035 119.8020 56.2002 39.3575 178.3979 116 A 3.8643 7.5089 122.1136 55.1008 18.5172 179.6988 117 L 3.8852 8.6053 118.0314 56.9862 41.4549 179.0624 118 L 4.1661 7.4022 117.5483 55.5138 41.9805 177.0054 119 N 4.7489 7.7420 114.2764 53.2124 40.7081 174.8015 120 L 4.5298 7.7209 117.0650 53.3120 44.3763 178.3256 121 G 3.5398 8.1751 107.9562 47.2665 0.0000 176.0502 122 D 4.5754 8.3979 118.9474 51.9130 39.8863 175.0987 123 R 4.1250 8.1548 119.9143 56.2604 29.7444 176.8392 124 L 4.3854 8.3627 122.7008 54.6068 42.6168 177.1216 125 K 4.2394 9.2096 121.2466 55.5209 33.0757 176.4408 126 P 4.4369 0.0000 0.0000 67.1807 31.1103 179.4104 *127 H 4.2720 8.1678 117.0348 59.7070 27.9822 179.9664 128 E 4.1948 8.1405 120.8684 59.3041 29.4327 179.0533 129 F 4.2587 8.8405 120.8551 60.8365 39.4109 177.2325 130 A 3.9560 8.3025 121.2606 55.0425 17.6921 179.4431 131 E 3.9255 8.4599 117.3729 59.4182 29.5705 179.2915 132 F 4.1463 8.3521 120.8362 61.3187 39.4215 177.2469 133 L 3.6439 7.6722 118.7197 57.3676 41.1230 179.6074 134 G 3.6276 7.7479 104.7046 47.0476 0.0000 175.3741 135 I 4.0623 6.8455 120.4068 63.2758 37.9549 176.5481 136 T 4.2562 7.1150 110.1358 61.4358 68.6861 173.3560 137 E 5.0798 7.9297 122.7849 54.9667 28.1620 175.7975 138 T 3.9734 7.6151 112.2094 64.4197 70.0742 175.0191 139 E 4.4612 7.8245 124.6151 55.5761 31.0211 175.1866 140 K 4.3917 8.7594 113.7963 57.9593 33.4606 177.0288 141 G 4.4173 7.7876 105.0768 45.8349 0.0000 172.0485 142 Q 5.1664 8.3009 118.1267 53.6466 33.5318 174.0276 143 I 4.8518 8.5367 117.0010 59.2843 39.2212 176.2146 144 R 3.2681 9.5476 126.9876 56.1209 30.5830 175.9960 145 Y 3.5325 7.9197 112.1499 59.4064 39.2394 173.8970 146 D 4.3702 8.3203 121.9904 57.0152 40.4617 178.1925 147 N 4.2687 7.8529 116.2526 56.0141 38.7254 176.7609 148 F 4.5230 7.9816 121.5594 61.3764 39.6692 177.1091 149 I 3.5793 7.8518 119.3857 64.6070 36.8246 178.2799 150 N 4.4557 8.1839 115.1483 56.0389 38.4697 176.4770 151 T 4.1119 7.4582 113.5304 65.2316 68.7528 174.9721 152 M 4.2474 7.9641 120.2648 55.4221 33.8340 176.1413 153 F 4.7717 7.7484 116.0816 55.7409 39.4756 174.9267 154 T 4.2060 8.0199 119.8043 63.5628 68.4072 174.9792 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 13 G 8.35 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 0.00 0.00 0.00 0.00 14 D 7.12 4.60 0.00 2.80 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.28 4.44 0.00 2.70 2.66 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 16 Q 8.05 3.61 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.19 0.00 17 V 8.10 3.82 2.30 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 1.30 0.00 0.00 1.07 0.00 0.00 18 S 7.87 4.11 0.00 4.02 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 19 E 8.06 3.99 0.00 2.06 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 2.31 0.00 20 F 8.21 4.85 0.00 3.50 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.72 3.56 0.00 1.61 1.85 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.68 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.12 1.22 7.81 22 E 8.50 3.87 0.00 2.18 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 2.30 2.43 0.00 23 A 8.14 3.52 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 24 F 8.04 3.47 0.00 2.98 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 25 E 8.34 4.04 0.00 2.12 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 2.48 2.44 0.00 26 L 7.28 4.01 0.00 1.44 1.82 1.01 0.92 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 27 F 7.41 4.70 0.00 2.69 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 28 D 7.46 4.72 0.00 2.29 2.50 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 0.00 0.00 0.00 0.00 29 S 7.69 4.35 0.00 4.02 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 30 E 7.97 4.14 0.00 1.88 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 2.25 2.29 0.00 31 R 7.73 3.94 0.00 1.93 2.01 0.00 3.13 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 32 T 8.07 4.04 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 0.99 0.00 0.00 33 G 10.18 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 34 F 6.99 5.50 0.00 3.27 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 35 I 9.03 4.64 2.02 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.54 1.04 0.00 0.00 36 T 8.53 5.17 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 37 K 8.46 3.58 0.00 1.57 1.83 0.00 1.47 0.00 0.00 1.70 0.00 0.00 2.58 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.39 0.21 7.81 38 E 8.34 4.01 0.00 2.07 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 2.39 2.47 0.00 39 G 8.33 3.64 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 0.00 40 L 8.62 4.05 0.00 2.06 2.16 0.89 0.84 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 41 Q 8.39 3.96 0.00 2.23 2.01 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 2.38 2.29 0.00 42 T 7.76 3.89 4.43 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 0.00 0.00 0.00 1.22 0.00 0.00 43 V 8.01 3.99 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 0.92 0.00 0.00 1.09 0.00 0.00 44 L 8.30 4.09 0.00 1.91 1.97 1.19 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.07 4.01 0.00 1.99 1.85 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.63 7.81 46 Q 8.39 3.96 0.00 2.28 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.63 0.00 47 F 8.25 4.66 0.00 3.02 3.13 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 48 G 7.66 3.84 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 0.00 0.00 0.00 49 V 7.78 4.19 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 0.84 0.00 0.00 0.98 0.00 0.00 50 R 8.48 4.56 0.00 1.85 1.86 0.00 3.37 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 51 V 8.07 4.49 2.21 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 0.81 0.00 0.00 1.13 0.00 0.00 52 E 8.65 4.26 0.00 2.09 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 2.41 2.48 0.00 53 P 0.00 4.28 0.00 2.18 2.13 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 54 A 8.05 4.03 1.34 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 0.00 0.00 0.00 55 A 8.03 4.02 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 56 F 8.48 4.03 0.00 3.18 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 57 N 8.40 4.32 0.00 2.86 2.91 0.00 0.00 6.73 7.61 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 58 E 8.24 3.93 0.00 2.13 2.19 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 2.29 2.31 0.00 59 M 8.08 4.28 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 60 F 8.06 3.77 0.00 2.59 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 61 N 8.16 4.37 0.00 2.78 2.87 0.00 0.00 7.12 7.24 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 62 E 8.32 4.01 0.00 2.12 1.91 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 2.27 2.47 0.00 63 A 7.34 4.01 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 64 D 7.77 4.39 0.00 2.05 2.34 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 0.00 65 A 7.78 3.98 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 66 T 8.41 3.98 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 67 G 7.96 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 68 N 8.61 4.62 0.00 2.82 2.91 0.00 0.00 6.37 7.00 0.00 0.00 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 9.84 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 70 K 8.00 5.09 0.00 1.52 1.44 0.00 1.14 0.00 0.00 0.61 0.00 0.00 2.23 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.22 1.27 7.81 71 I 9.18 4.34 2.03 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.40 1.10 0.00 0.00 72 Q 9.65 4.74 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 73 F 8.72 3.01 0.00 2.09 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 74 P 0.00 3.95 0.00 2.09 1.97 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 75 E 7.88 3.82 0.00 2.17 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 2.33 2.31 0.00 76 F 8.02 4.06 0.00 3.27 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 77 L 7.79 3.46 0.00 0.64 1.25 1.07 0.75 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 78 S 7.75 3.90 0.00 3.84 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 79 M 7.57 3.82 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 80 M 7.55 3.66 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.32 0.00 81 G 7.80 3.67 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 0.00 82 R 7.60 3.89 0.00 1.90 1.94 0.00 3.09 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 83 R 7.49 4.24 0.00 1.63 1.93 0.00 3.22 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 84 M 7.93 4.81 0.00 2.22 2.32 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 85 K 8.04 4.10 0.00 1.93 2.09 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.42 7.81 86 Q 7.95 4.28 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.08 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 87 T 7.58 4.22 4.33 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 1.27 0.00 0.00 88 T 8.01 4.73 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 1.23 0.00 0.00 89 S 8.27 4.43 0.00 4.00 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 90 E 8.00 3.03 0.00 1.16 1.41 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 2.01 1.53 0.00 91 D 7.75 4.29 0.00 2.74 2.66 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 92 I 7.58 3.76 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 1.51 1.07 0.90 0.00 0.00 93 L 7.85 3.94 0.00 1.89 1.88 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 94 R 8.24 4.08 0.00 2.05 2.11 0.00 3.19 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 95 Q 8.22 4.03 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 96 A 7.60 3.95 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 97 F 8.21 4.43 0.00 2.92 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 0.00 0.00 0.00 98 R 8.06 4.27 0.00 1.84 1.94 0.00 3.28 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 99 T 7.37 3.91 3.84 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 0.59 0.00 0.00 100 F 7.68 4.76 0.00 3.24 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 0.00 101 D 7.62 4.92 0.00 2.81 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 0.00 102 P 0.00 4.45 0.00 2.10 2.10 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 103 E 8.02 4.40 0.00 2.02 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 2.34 2.34 0.00 104 G 8.28 4.16 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 0.00 0.00 0.00 105 T 8.34 3.93 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 1.33 0.00 0.00 106 G 8.99 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 0.00 0.00 0.00 107 Y 8.00 5.00 0.00 2.79 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 0.00 108 I 8.89 4.85 2.10 0.00 0.00 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 1.70 1.05 1.15 0.00 0.00 109 P 0.00 4.64 0.00 2.16 2.06 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 110 K 9.10 4.13 0.00 2.00 1.96 0.00 1.80 0.00 0.00 2.05 0.00 0.00 3.33 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.52 1.63 7.81 111 A 8.11 4.11 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.11 3.99 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 0.00 113 L 7.90 3.63 0.00 1.87 1.87 0.38 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 7.95 3.14 0.00 2.32 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.10 1.68 0.00 115 D 7.70 4.23 0.00 2.92 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 0.00 116 A 7.51 3.86 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 0.00 117 L 8.61 3.89 0.00 1.23 1.56 0.79 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 118 L 7.40 4.17 0.00 1.57 1.56 0.88 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 119 N 7.74 4.75 0.00 2.70 2.79 0.00 0.00 6.92 9.17 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 0.00 120 L 7.72 4.53 0.00 1.84 1.59 0.92 0.89 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 0.00 121 G 8.18 3.54 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 0.00 0.00 0.00 122 D 8.40 4.58 0.00 2.62 2.58 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 0.00 123 R 8.15 4.13 0.00 1.87 1.90 0.00 3.06 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 124 L 8.36 4.39 0.00 1.69 1.66 0.88 0.70 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 0.00 125 K 9.21 4.24 0.00 1.73 1.74 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.59 7.81 126 P 0.00 4.44 0.00 2.19 2.18 0.00 3.61 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 *127 H 8.17 4.27 0.00 2.92 3.07 0.00 7.19 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.14 4.19 0.00 2.19 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 0.00 2.42 2.39 0.00 129 F 8.84 4.26 0.00 3.10 3.23 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 0.00 130 A 8.30 3.96 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.46 3.93 0.00 2.19 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 2.34 2.52 0.00 132 F 8.35 4.15 0.00 2.88 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 0.00 133 L 7.67 3.64 0.00 1.72 1.58 0.88 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.75 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 0.00 135 I 6.85 4.06 1.91 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.75 0.99 0.00 0.00 136 T 7.11 4.26 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 0.46 0.00 0.00 137 E 7.93 5.08 0.00 1.81 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 2.43 2.32 0.00 138 T 7.62 3.97 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 1.15 0.00 0.00 139 E 7.82 4.46 0.00 1.98 1.91 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 2.26 2.39 0.00 140 K 8.76 4.39 0.00 1.79 1.85 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.42 7.81 141 G 7.79 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 0.00 0.00 0.00 0.00 142 Q 8.30 5.17 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 143 I 8.54 4.85 1.76 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 1.30 0.92 0.94 0.00 0.00 144 R 9.55 3.27 0.00 1.35 1.51 0.00 3.18 0.00 0.00 2.76 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.84 0.00 145 Y 7.92 3.53 0.00 1.79 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 0.00 146 D 8.32 4.37 0.00 2.42 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 0.00 147 N 7.85 4.27 0.00 2.56 2.90 0.00 0.00 6.86 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 0.00 148 F 7.98 4.52 0.00 3.16 3.46 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 0.00 149 I 7.85 3.58 1.97 0.00 0.00 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 1.88 1.07 1.03 0.00 0.00 150 N 8.18 4.46 0.00 2.78 2.90 0.00 0.00 7.16 7.79 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 0.00 151 T 7.46 4.11 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 1.22 0.00 0.00 152 M 7.96 4.25 0.00 1.12 1.80 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.14 0.00 153 F 7.75 4.77 0.00 2.94 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 0.00 154 T 8.02 4.21 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 1.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.