NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1844 8.0249 114.2850 59.8373 38.8325 175.0782 2 P 4.4086 0.0000 0.0000 61.9219 32.1126 173.4375 3 E 4.2059 9.5536 119.5851 58.8436 30.6618 176.4719 4 Y 4.6956 7.7170 114.6868 55.8776 41.4797 175.4010 5 V 3.9827 7.8874 123.3372 60.9553 35.1972 174.1126 6 D 4.7980 7.9693 126.3731 52.5681 42.9420 175.2915 7 W 4.2915 9.2501 127.3952 59.2996 29.7839 179.2990 8 R 3.9861 8.5578 119.6687 59.4588 29.5443 178.8524 9 Q 4.1222 7.8265 114.5602 57.6807 28.7324 177.0251 10 K 4.4278 7.8815 116.5194 55.9724 32.4138 176.8299 11 G 3.8915 8.4808 105.7479 46.3157 0.0000 174.8404 12 A 4.4843 8.4923 121.7087 51.7937 19.3408 177.5043 13 V 4.3789 7.5710 115.9815 60.9836 33.9180 175.4344 14 T 4.4040 8.3841 117.2117 59.7368 70.1934 172.3904 15 P 4.4997 0.0000 0.0000 62.1800 31.8766 176.6260 16 V 3.7564 8.3443 120.6525 63.3729 32.2137 175.4546 17 K 4.7503 8.6696 126.3676 54.6965 35.9801 174.1111 18 N 5.4126 8.4107 118.7524 52.3141 40.5333 174.3163 19 Q 3.3028 8.7734 124.5672 56.2029 30.1931 177.2686 20 G 3.9520 8.0088 107.5921 47.0734 0.0000 174.5656 21 S 4.5630 8.7323 120.0919 57.9192 63.3739 174.2999 22 C 4.7630 7.4953 120.8230 55.4182 43.6215 174.5490 23 G 3.8527 8.6126 116.8539 45.0678 0.0000 174.9728 24 S 4.3102 7.5886 114.1712 56.1120 63.8660 174.9421 *26 W 4.8011 8.3071 124.0378 56.4902 30.2217 177.9815 27 A 3.4865 6.4966 120.2967 54.7257 17.5877 179.4314 28 F 3.5887 7.8511 116.0175 60.5403 38.6768 177.7749 29 S 4.0855 8.1238 111.9800 61.3141 62.2150 175.7321 30 A 4.0561 7.8093 122.8784 55.4156 18.0939 179.6012 31 V 3.4983 7.6186 116.6020 66.3154 31.4393 178.4129 32 V 3.6305 7.6490 118.2429 66.1164 31.3327 178.1822 33 T 3.9424 7.6761 108.3496 64.5636 68.6474 176.7951 34 I 3.5902 7.7363 122.6524 64.4028 37.2593 178.2241 35 E 4.3616 8.6880 119.8173 59.2841 29.2328 179.8661 36 G 3.3970 8.1415 105.8011 48.6797 0.0000 175.7208 37 I 3.5927 8.0099 122.4307 63.5382 37.8632 178.0715 38 I 3.7607 7.7713 120.8254 63.9680 36.8512 178.2916 39 K 4.5907 7.8582 121.4101 59.2603 31.8710 178.9794 40 I 3.7106 7.5453 118.8045 64.2496 37.0104 178.0776 41 R 4.2524 7.9557 118.0537 57.8349 30.3869 177.9189 42 T 4.5083 8.4660 107.4561 60.8930 70.1966 175.5466 43 G 3.9916 8.6279 109.9864 45.2005 0.0000 172.7733 44 N 4.8741 8.1590 117.7132 51.1046 40.8303 173.4275 45 L 4.4570 8.4836 124.8313 53.7921 42.2801 174.7918 46 N 4.9834 8.4975 122.5501 51.4597 42.3018 173.8780 47 Q 4.6995 8.0766 118.6108 54.6748 30.8535 174.7946 48 Y 5.1393 8.4013 121.5274 56.0202 40.7539 175.8012 49 S 4.2491 8.5788 116.2436 57.7943 62.6268 174.9883 50 E 3.5514 8.4130 128.7927 59.2746 29.0289 179.0170 51 Q 3.9725 7.8286 119.1752 58.8074 29.1439 177.7132 52 E 3.0821 7.5959 120.7324 58.8746 29.5111 178.8208 53 L 3.9855 7.1603 118.8631 57.3573 41.3711 179.1525 54 L 4.0569 7.3336 119.4843 58.5245 42.1618 178.6332 55 D 4.5426 8.1438 117.3830 56.8100 40.8385 177.1826 56 C 4.9613 7.9684 114.6635 56.1315 41.1412 173.4129 57 D 4.5003 8.3076 121.7561 53.6077 40.2924 176.1967 58 R 4.3741 8.3782 122.6317 56.3962 29.9058 177.1782 59 R 4.0679 7.9344 117.3306 56.8513 30.6655 176.2816 60 S 3.9205 6.9243 112.3227 56.7853 65.1619 173.0815 61 Y 4.6970 7.5310 117.3560 57.8499 39.3764 178.6096 62 G 4.0162 7.8750 114.5334 47.6199 0.0000 176.9224 63 C 4.6793 9.0446 123.4153 57.6371 40.2627 173.4282 64 N 4.5108 8.0883 118.2710 53.4026 38.5834 174.1658 65 G 3.9711 7.7765 103.9816 43.7595 0.0000 173.7930 66 G 2.8176 6.6084 104.7696 44.5304 0.0000 171.2738 67 Y 4.6196 6.3663 116.4093 55.2972 40.9314 175.3905 68 P 4.4738 0.0000 0.0000 65.1043 31.5619 179.0048 69 W 3.6486 7.8555 115.7575 59.3270 28.1041 178.4319 70 S 3.1288 6.5447 114.0452 59.9128 62.6576 176.0498 71 A 4.0139 7.5229 124.4948 54.9387 17.8906 179.5258 72 L 4.0472 7.9080 117.5524 57.6067 41.6521 179.7514 73 Q 3.9228 7.8175 118.3998 58.7075 28.6283 178.0270 74 L 3.9770 7.7280 121.4262 58.5300 41.9214 179.3422 75 V 3.6098 7.4385 116.1531 65.1368 31.2164 177.1662 76 A 4.5401 7.2248 119.8955 52.6769 18.8594 178.4229 77 Q 4.0306 7.5410 115.5414 57.6158 29.5334 174.7051 78 Y 4.2624 9.1790 113.6301 55.8896 41.4024 179.0127 79 G 3.4781 6.1625 109.9806 45.3258 0.0000 170.5770 80 I 4.8064 7.5763 118.7825 59.6817 42.0300 175.2932 81 H 4.9693 9.8262 125.5801 55.1891 30.7263 174.3284 82 Y 4.7768 8.3488 117.0736 57.9919 38.6799 177.2961 83 R 3.9572 9.2046 123.3565 59.6735 29.9753 178.9230 84 N 4.4963 8.1429 115.4097 56.1432 37.3385 176.7990 85 T 4.3100 7.8685 116.9461 64.9367 70.1672 174.2205 86 Y 4.8371 7.7457 120.7290 54.8977 38.6398 172.6408 87 P 4.7184 0.0000 0.0000 61.1503 33.1757 176.5348 88 Y 4.3790 8.5903 121.3024 57.9292 38.0721 175.9374 89 E 4.2350 9.6520 126.4939 55.3983 31.5377 177.7960 90 G 3.9074 7.7764 105.9448 44.1751 0.0000 173.3788 91 V 4.4265 6.6741 117.4034 59.6099 34.3796 174.2085 92 Q 4.2680 8.7050 124.1852 56.1516 29.5828 175.2333 93 R 4.9464 8.5489 126.6163 54.5162 32.8958 175.2339 94 Y 4.3200 8.3789 116.2545 57.3748 38.7105 175.7139 95 C 4.4990 8.7689 121.4615 56.7631 41.6361 173.2231 96 R 4.4475 8.8218 125.7726 56.0887 30.2451 178.3768 97 S 4.2688 8.3947 116.5370 62.0319 62.8436 177.2193 98 R 3.8371 8.0225 116.9653 58.4351 29.9094 177.1859 99 E 4.5414 7.6226 114.2048 55.9508 29.6277 176.2848 100 K 4.3246 7.7840 116.7859 56.1447 33.1342 178.3918 101 G 3.8116 7.8942 108.4136 44.7046 0.0000 172.1331 102 P 4.2859 0.0000 0.0000 62.1133 32.2525 175.8046 103 Y 3.8207 7.9336 117.4623 58.5495 38.2720 176.8195 104 A 4.0927 8.2244 125.7121 54.9777 19.1658 176.7958 105 A 4.4615 7.5415 114.9428 51.6578 22.8498 174.8372 106 K 4.6956 8.2254 118.6707 55.6749 35.3448 174.7281 107 T 4.5669 8.0629 114.0896 59.9609 71.4996 174.7519 108 D 4.2837 8.9122 122.1775 57.0687 41.7113 176.9170 109 G 4.0220 6.9967 102.3182 46.2383 0.0000 171.8691 110 V 4.9648 8.5731 119.2445 61.1943 34.5263 176.3192 111 R 4.6449 8.8481 125.6945 54.3038 33.9580 174.0746 112 Q 4.4712 8.2061 121.7609 54.1983 30.5806 175.4048 113 V 3.8949 8.6596 127.3170 62.2593 32.6136 175.4466 114 Q 3.8502 8.6452 127.9056 55.5653 28.9913 174.5606 115 P 4.2241 0.0000 0.0000 63.3422 31.9291 174.8619 116 Y 4.4561 8.1207 113.5854 58.1547 35.9948 171.1371 117 N 4.7146 7.7409 117.3246 50.9627 41.4322 173.2255 118 Q 3.0033 8.4266 129.6716 58.8374 29.1877 178.2389 119 G 3.4250 7.9146 105.9577 47.5328 0.0000 175.1868 120 A 3.9603 8.2773 123.4194 54.9184 18.3850 179.5168 121 L 3.8400 7.5768 118.6348 58.3674 42.1540 179.2540 122 L 3.8202 7.6732 118.8817 57.4712 41.1757 178.8851 123 Y 4.0792 7.9132 119.2155 60.8099 39.0664 177.7707 124 S 3.9169 7.8708 116.0189 61.6807 62.6352 176.8730 125 I 4.4383 8.1205 123.4688 63.6614 36.6365 178.1998 126 A 4.2336 8.1100 120.7765 54.5115 18.1931 178.6869 127 N 4.6343 7.7084 114.6595 54.4500 39.4880 174.8779 128 Q 3.4299 6.7910 115.9337 54.1630 31.5788 170.9760 129 P 4.7720 0.0000 0.0000 62.7758 31.8554 176.2819 130 V 4.5661 8.5568 123.6894 61.0809 35.0738 174.1680 131 S 5.1327 8.9612 121.3737 57.6318 63.4341 173.3577 132 V 5.0879 8.7695 119.9199 59.7437 35.7086 175.0703 133 V 5.0809 8.0033 114.9998 59.9452 35.1336 174.7620 134 L 4.9751 8.8061 122.4773 54.7627 44.7634 174.3133 135 Q 4.7582 8.8856 121.0533 55.0981 28.7955 175.0337 136 A 3.3868 9.2286 129.2679 51.3844 20.2887 177.0709 137 A 4.1148 7.7029 117.9910 54.8594 18.7889 179.5524 138 G 3.9432 7.9940 101.6120 44.9832 0.0000 174.4367 139 K 4.1302 8.7034 123.0678 59.2573 32.1513 179.2128 140 D 4.5560 8.2497 118.2676 57.1956 41.1889 177.8208 141 F 3.7465 8.5823 120.6938 61.6236 39.2270 177.1643 142 Q 4.7122 8.6592 115.9582 58.6651 28.5872 178.0476 143 L 4.4888 7.9380 118.0793 54.2235 42.7135 176.3274 144 Y 4.0108 7.4840 120.9167 58.3919 38.8299 176.5649 145 R 4.0001 8.6747 120.3073 54.3251 30.7161 174.3707 146 G 3.7768 6.4081 106.5725 44.7280 0.0000 173.3741 147 G 3.7026 8.9602 107.8223 44.1954 0.0000 172.6725 148 I 4.4475 7.8963 120.6991 59.2636 37.5731 175.5055 149 F 4.3076 9.2934 129.9102 58.5385 39.3122 175.7838 150 V 4.1261 7.7605 119.6381 60.2916 32.8552 173.8780 151 G 3.3282 5.9770 104.9971 43.0262 0.0000 171.7780 152 P 4.5645 0.0000 0.0000 62.5342 32.4099 174.2421 153 C 4.9157 8.2662 111.3333 55.0591 38.5625 174.0666 154 G 4.0316 8.8895 111.8884 44.4227 0.0000 173.8315 155 N 5.1440 8.3006 116.4468 52.5744 37.7713 175.8026 156 K 4.2799 7.7494 119.4551 56.0631 30.7376 175.7202 157 V 4.0905 7.6606 114.1102 61.4384 32.0579 175.7984 158 D 4.8879 9.0857 122.4419 52.8570 41.3752 174.9756 159 H 4.8994 8.0233 119.5230 54.6892 33.3287 171.3279 160 A 4.9849 8.6269 127.7905 51.1900 20.2106 176.2858 161 V 4.5536 8.8350 116.0194 59.5625 36.5626 173.9661 162 A 5.2458 8.4002 120.8308 50.5434 22.4545 175.6152 163 A 4.8452 9.3160 124.9852 51.4507 19.7219 177.8808 164 V 4.4388 9.6323 115.1136 60.5704 33.5145 176.3924 165 G 4.4268 7.5806 111.3136 46.0727 0.0000 170.8194 166 Y 4.9564 7.3563 116.1276 55.6977 40.7256 174.4272 167 G 3.3342 7.5723 108.6200 43.1173 0.0000 170.9254 168 P 4.0269 0.0000 0.0000 65.6694 31.3967 177.1666 169 N 5.2372 7.9701 111.3480 52.6681 39.9880 173.3120 170 Y 5.5738 7.7183 117.2379 55.7892 42.7914 173.6430 171 I 4.8546 8.8170 119.5169 59.3220 40.4517 175.0150 172 L 4.7691 8.9564 130.3393 54.9426 43.3172 175.4059 173 I 5.0998 8.8336 127.1689 59.4492 40.6581 174.3537 174 K 4.0913 9.1671 128.4674 55.0278 33.4861 175.0936 175 N 5.0825 8.1839 125.7665 51.2352 41.8547 173.9909 176 S 4.8355 7.6699 114.1944 57.9687 62.9946 175.1069 177 W 4.5687 8.4421 116.2758 57.3588 30.1187 176.8546 178 G 4.1256 8.3912 105.5530 45.6519 0.0000 174.7714 179 T 4.4357 8.4371 107.7225 62.5876 69.4527 176.1857 180 G 3.9626 8.1452 110.3164 45.4644 0.0000 172.9302 181 W 4.7741 8.1263 130.2251 56.1958 33.3567 176.3807 182 G 2.9881 6.8824 111.4954 46.6503 0.0000 175.8036 183 E 4.2070 8.6486 114.9897 55.7398 27.9624 176.1659 184 N 4.8308 8.4228 113.6165 53.7713 36.7870 175.9972 185 G 4.2421 8.9653 107.3937 44.9278 0.0000 173.4112 186 Y 5.1293 7.8914 117.0590 56.4045 41.2568 174.5695 187 I 4.7718 8.6594 120.6317 59.5004 41.9786 173.9304 188 R 5.1052 8.4690 127.7481 54.9623 31.8396 175.2065 189 I 4.9434 8.4105 124.9981 58.9139 40.1479 175.3184 190 K 4.7579 9.2231 128.8640 56.8219 32.6741 175.8791 191 R 4.7155 8.9657 122.5713 54.8407 32.8998 175.4526 192 G 3.9824 8.5024 106.0587 45.8300 0.0000 174.6262 193 T 4.0607 7.8271 108.6740 61.9218 69.2993 175.9065 194 G 3.9454 8.2799 110.0976 45.3954 0.0000 172.9940 195 N 4.5200 7.9627 119.9237 53.3594 39.6432 175.4345 196 S 4.5758 8.6027 119.7564 60.2041 63.2590 175.3632 197 Y 4.2237 7.9675 117.6105 59.0229 38.1719 176.8651 198 G 3.3985 7.5370 105.0511 44.2000 0.0000 172.5705 199 V 3.9025 7.6742 118.2735 63.7232 32.0498 176.6887 200 C 4.4813 9.3013 122.3181 57.5661 38.9283 174.4762 201 G 3.9069 8.1947 106.9185 45.1697 0.0000 175.5571 202 L 4.2644 7.0473 121.4235 57.0189 42.1665 177.5110 203 Y 4.9970 8.0045 114.6261 58.1705 38.1832 177.7374 204 T 3.6461 8.2291 118.3998 66.2395 68.2926 175.4154 205 S 4.3218 7.7060 121.8517 57.2955 64.8213 171.9728 206 S 5.7508 8.0394 122.6053 55.5914 66.6230 173.2763 207 F 5.4553 8.9607 122.3677 55.7960 43.1264 173.5096 208 Y 5.3493 8.8157 119.1927 54.4716 41.6464 172.7287 209 P 4.8400 0.0000 0.0000 62.9839 32.6520 175.3981 210 V 4.3331 8.6352 123.0170 61.5843 33.5014 175.0063 211 K 4.6007 8.7459 128.9857 56.2346 33.5056 175.1361 212 N 4.5232 9.7033 123.9663 53.5669 39.2588 174.5135 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 I 8.02 4.18 2.03 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 1.14 0.00 0.00 2 P 0.00 4.41 0.00 2.23 2.03 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.14 0.00 3 E 9.55 4.21 0.00 2.21 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 2.38 2.37 0.00 4 Y 7.72 4.70 0.00 2.58 2.62 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 5 V 7.89 3.98 1.52 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 0.41 0.00 0.00 0.50 0.00 0.00 6 D 7.97 4.80 0.00 2.74 2.53 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 7 W 9.25 4.29 0.00 3.55 3.21 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 8 R 8.56 3.99 0.00 2.18 1.95 0.00 2.87 0.00 0.00 2.44 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 9 Q 7.83 4.12 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 7.33 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 10 K 7.88 4.43 0.00 1.91 1.90 0.00 1.51 0.00 0.00 1.07 0.00 0.00 2.13 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.21 1.27 7.81 11 G 8.48 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 12 A 8.49 4.48 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 13 V 7.57 4.38 2.25 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 1.12 0.00 0.00 1.13 0.00 0.00 14 T 8.38 4.40 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 1.29 0.00 0.00 15 P 0.00 4.50 0.00 2.11 2.08 0.00 3.90 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 2.05 2.11 0.00 16 V 8.34 3.76 2.16 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 0.82 0.00 0.00 0.97 0.00 0.00 17 K 8.67 4.75 0.00 1.95 1.88 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.38 7.81 18 N 8.41 5.41 0.00 2.70 2.67 0.00 0.00 6.94 7.08 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 19 Q 8.77 3.30 0.00 1.75 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.35 0.00 0.00 0.00 0.00 0.00 2.46 2.17 0.00 20 G 8.01 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 21 S 8.73 4.56 0.00 3.96 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 22 C 7.50 4.76 0.00 3.03 3.31 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 23 G 8.61 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 24 S 7.59 4.31 0.00 3.93 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 *26 W 8.31 4.80 0.00 3.64 3.37 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 27 A 6.50 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 7.85 3.59 0.00 2.97 2.98 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 29 S 8.12 4.09 0.00 3.99 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 30 A 7.81 4.06 1.42 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 31 V 7.62 3.50 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.67 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.21 1.50 7.81 107 T 8.06 4.57 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 1.10 0.00 0.00 108 D 8.91 4.28 0.00 2.64 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 0.00 109 G 7.00 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 0.00 110 V 8.57 4.96 2.09 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 0.92 0.00 0.00 0.91 0.00 0.00 111 R 8.85 4.64 0.00 0.85 1.38 0.00 3.20 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.45 0.00 112 Q 8.21 4.47 0.00 1.94 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.98 0.00 0.00 0.00 0.00 0.00 1.79 1.16 0.00 113 V 8.66 3.89 2.15 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 0.73 0.00 0.00 1.12 0.00 0.00 114 Q 8.65 3.85 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 115 P 0.00 4.22 0.00 1.19 1.71 0.00 3.86 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 116 Y 8.12 4.46 0.00 3.12 3.03 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 0.00 117 N 7.74 4.71 0.00 2.75 2.71 0.00 0.00 6.70 6.89 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 0.00 118 Q 8.43 3.00 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 119 G 7.91 3.42 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 0.00 120 A 8.28 3.96 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 0.00 121 L 7.58 3.84 0.00 1.55 1.54 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 122 L 7.67 3.82 0.00 1.58 0.91 0.62 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 7.91 4.08 0.00 2.81 3.10 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 0.00 124 S 7.87 3.92 0.00 3.94 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 4.44 2.15 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 2.28 1.24 0.00 0.00 126 A 8.11 4.23 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 0.00 127 N 7.71 4.63 0.00 2.59 2.70 0.00 0.00 6.84 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 0.00 128 Q 6.79 3.43 0.00 1.89 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.99 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 129 P 0.00 4.77 0.00 1.88 2.03 0.00 3.09 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 130 V 8.56 4.57 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 1.10 0.00 0.00 0.99 0.00 0.00 131 S 8.96 5.13 0.00 4.07 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 0.00 132 V 8.77 5.09 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 0.81 0.00 0.00 1.02 0.00 0.00 133 V 8.00 5.08 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 1.10 0.00 0.00 1.08 0.00 0.00 134 L 8.81 4.98 0.00 1.59 1.74 0.47 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 8.89 4.76 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.55 0.00 136 A 9.23 3.39 0.73 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 0.00 0.00 137 A 7.70 4.11 1.38 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 0.00 0.00 138 G 7.99 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 0.00 139 K 8.70 4.13 0.00 1.91 1.91 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.60 7.81 140 D 8.25 4.56 0.00 3.20 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 0.00 141 F 8.58 3.75 0.00 3.17 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 0.00 142 Q 8.66 4.71 0.00 2.39 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.62 0.00 0.00 0.00 0.00 0.00 2.56 3.00 0.00 143 L 7.94 4.49 0.00 1.97 1.79 0.99 0.85 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 0.00 144 Y 7.48 4.01 0.00 2.59 2.47 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 0.00 145 R 8.67 4.00 0.00 1.62 1.67 0.00 3.03 0.00 0.00 3.13 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.33 0.00 146 G 6.41 3.78 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 0.00 0.00 0.00 147 G 8.96 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 0.00 0.00 0.00 148 I 7.90 4.45 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 1.03 0.00 0.00 149 F 9.29 4.31 0.00 2.81 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 0.00 150 V 7.76 4.13 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 0.78 0.00 0.00 0.80 0.00 0.00 151 G 5.98 3.33 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 0.00 152 P 0.00 4.56 0.00 2.23 2.05 0.00 3.96 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 2.23 1.97 0.00 153 C 8.27 4.92 0.00 3.20 3.41 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 0.00 154 G 8.89 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 0.00 0.00 0.00 155 N 8.30 5.14 0.00 2.59 2.63 0.00 0.00 5.90 7.13 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 0.00 156 K 7.75 4.28 0.00 1.75 1.80 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.40 7.81 157 V 7.66 4.09 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 0.90 0.00 0.00 1.00 0.00 0.00 158 D 9.09 4.89 0.00 2.62 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 0.00 159 H 8.02 4.90 0.00 3.14 3.11 0.00 5.85 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 0.00 160 A 8.63 4.98 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 0.00 161 V 8.84 4.55 2.16 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 0.53 0.00 0.00 0.95 0.00 0.00 162 A 8.40 5.25 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 0.00 163 A 9.32 4.85 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 0.00 164 V 9.63 4.44 2.36 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 0.87 0.00 0.00 1.25 0.00 0.00 165 G 7.58 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 0.00 0.00 0.00 0.00 166 Y 7.36 4.96 0.00 3.13 2.97 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 0.00 167 G 7.57 3.33 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 0.00 168 P 0.00 4.03 0.00 1.98 2.07 0.00 3.09 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 169 N 7.97 5.24 0.00 2.62 3.00 0.00 0.00 6.46 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 0.00 170 Y 7.72 5.57 0.00 3.15 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 0.00 171 I 8.82 4.85 2.07 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 1.22 1.27 1.13 0.00 0.00 172 L 8.96 4.77 0.00 2.18 1.81 1.05 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 173 I 8.83 5.10 2.06 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 1.44 1.17 0.95 0.00 0.00 174 K 9.17 4.09 0.00 1.89 1.66 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.20 0.88 7.81 175 N 8.18 5.08 0.00 2.51 2.45 0.00 0.00 7.09 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 0.00 176 S 7.67 4.84 0.00 3.34 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 0.00 177 W 8.44 4.57 0.00 2.98 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 0.00 178 G 8.39 4.13 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 0.00 179 T 8.44 4.44 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 1.30 0.00 0.00 180 G 8.15 3.96 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 0.00 0.00 0.00 181 W 8.13 4.77 0.00 3.51 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 0.00 182 G 6.88 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 0.00 0.00 0.00 183 E 8.65 4.21 0.00 2.30 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 2.20 2.28 0.00 184 N 8.42 4.83 0.00 3.00 3.04 0.00 0.00 7.57 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 0.00 185 G 8.97 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 0.00 0.00 0.00 0.00 186 Y 7.89 5.13 0.00 3.26 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 0.00 187 I 8.66 4.77 1.44 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 0.71 -0.36 0.98 0.00 0.00 188 R 8.47 5.11 0.00 1.89 1.65 0.00 2.21 0.00 0.00 2.81 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 189 I 8.41 4.94 2.03 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 1.22 0.77 1.09 0.00 0.00 190 K 9.22 4.76 0.00 1.89 1.77 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.48 7.81 191 R 8.97 4.72 0.00 2.08 2.02 0.00 3.31 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 192 G 8.50 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 0.00 193 T 7.83 4.06 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 1.25 0.00 0.00 194 G 8.28 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 0.00 195 N 7.96 4.52 0.00 2.88 2.73 0.00 0.00 6.68 7.64 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 0.00 196 S 8.60 4.58 0.00 3.79 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 Y 7.97 4.22 0.00 3.07 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 0.00 198 G 7.54 3.40 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 0.00 199 V 7.67 3.90 2.24 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 1.08 0.00 0.00 0.97 0.00 0.00 200 C 9.30 4.48 0.00 3.27 3.33 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 0.00 201 G 8.19 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 0.00 202 L 7.05 4.26 0.00 1.85 1.48 1.08 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 203 Y 8.00 5.00 0.00 3.26 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 0.00 204 T 8.23 3.65 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 1.38 0.00 0.00 205 S 7.71 4.32 0.00 3.93 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 0.00 206 S 8.04 5.75 0.00 3.66 3.71 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 0.00 207 F 8.96 5.46 0.00 3.02 2.93 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 0.00 208 Y 8.82 5.35 0.00 2.90 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 0.00 209 P 0.00 4.84 0.00 2.09 2.08 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 210 V 8.64 4.33 2.09 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 1.02 0.00 0.00 0.98 0.00 0.00 211 K 8.75 4.60 0.00 1.71 1.65 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.29 1.51 7.81 212 N 9.70 4.52 0.00 2.83 2.76 0.00 0.00 6.80 7.46 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 * Residues marked with a * may have inaccurate shift predictions.