NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.5491 8.0433 121.1442 55.6149 42.5820 174.9465 3 K 4.7657 8.8703 121.4767 54.0397 33.8106 174.1421 4 L 4.3622 9.9380 129.6647 54.0381 43.9421 174.4291 5 C 5.0435 10.5079 124.9165 56.7143 30.5471 172.5081 6 G 4.0878 7.4563 112.0436 45.3639 0.0000 172.5935 7 F 4.3702 6.5388 118.0513 54.9551 40.5165 175.2444 8 A 3.9955 8.2843 125.0420 53.7107 18.4335 178.8557 9 A 4.2109 8.1457 118.1329 53.5736 19.1632 178.2704 10 S 4.4384 7.8048 112.3034 57.3712 63.5853 174.3917 11 N 4.3421 8.8254 127.4968 56.5033 37.1162 176.9559 12 Y 4.1339 8.0636 118.5547 60.5099 37.9055 177.6401 13 Y 4.0643 8.0948 120.8005 60.9116 38.9191 177.8812 14 N 4.3443 8.4752 117.2405 55.7887 38.3914 177.3158 15 K 4.0667 8.0009 122.7851 58.8915 32.1876 179.0014 16 V 3.4461 7.2879 116.9698 65.7472 31.3727 177.7019 17 K 3.3329 7.7841 119.4575 59.4286 31.9574 178.5873 18 L 3.9471 8.0539 118.9659 57.7405 41.6254 179.3622 19 A 4.0244 7.6906 120.6045 55.1360 18.3316 179.6909 20 L 3.7107 7.9126 117.7199 57.8112 41.7221 179.7839 21 L 4.0781 8.0614 119.1967 58.0104 41.3850 179.5462 22 E 3.9261 8.4993 117.5199 58.5909 29.4403 178.5524 23 K 4.2881 7.7301 115.6670 55.2026 32.6563 176.1207 24 N 4.1748 7.6370 115.3115 54.0725 36.6457 174.1297 25 V 3.8445 7.5106 117.5890 61.0962 32.3622 173.8764 26 P 4.5441 0.0000 0.0000 62.5941 31.9545 175.3633 27 F 5.1495 7.9934 115.5989 55.8318 41.0192 172.6342 28 E 4.5695 9.2136 121.4276 54.4697 31.9902 174.4563 29 E 4.9597 8.7476 126.4521 55.7270 30.8620 175.7267 30 V 4.2900 8.7442 125.3287 60.6254 33.9850 174.3230 31 L 4.3503 8.4774 130.5510 54.9818 42.6676 176.1182 32 A 4.4543 8.6058 128.5276 50.3458 21.8237 175.5250 33 W 4.4162 8.6383 121.5376 56.4980 30.2342 176.5209 34 I 3.9253 8.2610 121.4163 63.5833 36.7712 176.7953 35 G 4.0809 9.6985 113.5237 45.4636 0.0000 173.3685 36 E 4.7515 8.2400 117.7724 56.1074 31.1469 175.9059 37 T 4.3464 7.8638 109.7685 61.0561 70.1087 173.3666 38 D 4.8390 8.7856 121.9976 53.5488 41.0096 176.3494 39 T 4.3398 8.0793 117.2756 62.6070 69.1585 176.0955 40 T 3.9165 7.9620 113.0362 64.2868 69.1257 175.9767 41 A 4.5242 7.6421 123.4358 52.0138 20.1781 176.6668 42 T 4.2402 7.5809 111.8706 59.3389 67.8023 172.2571 43 P 4.3658 0.0000 0.0000 63.8169 31.7329 177.3882 44 A 4.4003 7.9286 118.5812 51.3772 19.1856 177.1001 45 G 4.0216 8.1125 104.3254 46.3261 0.0000 174.6055 46 K 4.3425 7.8347 117.8963 55.7762 32.8942 176.7742 47 V 4.6938 8.2059 114.6163 59.0567 34.4507 173.7332 48 P 5.1080 0.0000 0.0000 62.3779 33.4781 174.2236 49 Y 5.0771 7.8611 116.9994 54.9898 41.5152 173.2978 *51 I 4.4226 8.2967 118.1842 62.1416 38.9791 175.3352 52 T 4.8661 8.8486 119.0445 60.0469 71.8574 174.3177 53 E 4.1647 8.8073 116.7314 58.9707 29.7346 174.9307 54 S 4.3528 8.0665 112.2001 58.9663 63.9876 174.6175 55 G 3.8704 6.2204 107.5733 44.8721 0.0000 171.3723 56 S 4.9836 7.8957 112.8066 56.3790 66.0374 172.7824 57 L 4.8917 8.1714 120.5239 53.4450 45.0946 176.6937 58 C 4.9187 8.7018 117.2051 57.4849 30.3252 173.8767 59 E 4.7005 7.9729 118.8654 54.4411 33.7738 176.1063 60 S 4.1237 8.6925 118.6541 61.7437 63.0194 176.4205 61 E 4.0429 8.1684 122.2499 58.5800 29.5062 178.6417 62 V 3.6155 7.7444 118.1845 65.8526 31.5729 177.9433 63 I 3.7802 7.9996 119.8071 64.6237 37.0045 178.2433 64 N 4.4111 8.3364 117.2915 56.3342 38.2267 177.3732 65 E 4.0200 8.6245 120.4596 59.4646 29.4157 178.7812 66 Y 4.0779 8.1276 119.6641 60.7070 38.7927 178.0427 67 L 4.0821 8.5225 120.3917 57.8403 41.4746 179.3366 68 E 3.9331 8.0522 117.6520 59.2152 29.4238 178.8249 69 A 4.0823 7.4893 119.5045 54.3808 18.7734 178.8366 70 A 3.9464 7.6610 118.1157 52.6639 20.3154 177.2272 71 Y 4.6088 7.7381 115.1160 55.8111 37.9824 174.3226 72 P 4.4145 0.0000 0.0000 63.7899 32.6416 178.4512 73 Q 4.1111 7.6315 118.5010 58.8001 28.6537 176.7979 74 T 4.4887 7.4625 114.5885 60.2409 68.9123 171.0626 75 P 4.6377 0.0000 0.0000 62.8060 32.2765 177.0174 76 L 4.7157 9.3924 119.8625 54.3661 42.3509 175.8918 77 L 5.0587 7.5577 117.8166 51.9538 45.1136 174.6981 78 P 4.4741 0.0000 0.0000 62.4584 32.0292 176.7060 79 R 4.0070 8.4028 120.2173 58.9664 30.5113 176.8461 80 D 4.3799 8.0010 118.1660 53.7749 41.6121 175.5030 81 P 4.3206 0.0000 0.0000 63.6667 31.4396 178.0055 *83 Q 4.1794 8.2587 119.2024 56.0032 30.7403 177.5562 84 A 4.1280 8.4271 120.0546 55.0049 18.1702 179.9460 85 G 3.5661 8.3111 104.4564 47.9693 0.0000 176.1676 86 K 3.9707 7.9820 120.4973 58.9786 32.0555 179.5558 87 V 3.5363 7.6270 118.2311 66.1379 31.4434 178.4425 88 R 3.9999 8.0315 117.8063 58.9873 29.7705 178.6589 89 E 3.9992 8.5431 119.7527 59.1904 29.5963 178.9492 90 I 3.7868 7.7339 119.7978 64.3906 37.1566 178.4924 91 V 3.6545 7.7700 118.9930 66.4282 31.3307 178.2321 92 T 3.8220 8.1857 115.5135 66.5320 68.3282 176.5532 93 F 3.9036 8.5709 122.7507 61.1671 39.4525 176.8627 94 L 3.7687 8.3714 120.0499 58.1202 41.7835 178.8952 95 E 3.8808 8.3172 118.4768 59.4015 29.3529 179.2763 96 L 3.6317 7.7303 118.0324 57.0611 41.5856 178.2070 97 Y 4.4129 7.1652 114.1536 57.9699 39.4763 177.0901 98 L 4.5069 7.4544 118.5655 56.6034 42.8147 178.1719 99 E 3.9384 8.3390 119.1476 59.5684 29.5410 179.0608 100 L 4.0293 7.8760 117.6971 57.8184 41.7761 179.5531 101 T 4.0567 7.8287 115.2648 66.6802 68.5941 176.5664 102 A 4.1783 8.2540 122.7074 54.8921 18.5165 179.5027 103 R 2.0000 7.9400 117.7815 58.9272 29.7442 178.4122 104 E 4.0391 7.5146 115.8341 58.3665 29.6201 178.1327 105 L 4.4397 8.1828 118.3323 55.5872 42.3078 177.9380 106 Y 4.1702 7.6646 117.1134 60.7555 37.7647 176.6979 107 P 4.5822 0.0000 0.0000 65.7604 31.2300 178.0768 108 E 4.4298 8.3107 117.3553 58.3591 29.8752 177.9821 109 A 3.8758 7.8574 119.9999 54.1630 18.3959 178.6469 110 F 4.8664 8.1307 113.9260 57.1235 41.0034 176.2997 111 F 4.9771 7.6731 114.4622 56.8840 39.7782 175.5492 112 G 3.9223 8.4984 107.1982 46.1696 0.0000 174.8559 113 G 4.0876 8.3907 113.2511 44.6721 0.0000 173.4828 114 K 5.0108 8.3778 119.5955 52.8205 35.4469 171.8161 115 V 4.5558 9.0524 117.3147 58.2108 34.2837 176.7152 116 S 4.3683 8.2942 117.8477 58.3909 64.9153 175.2267 117 D 4.3648 8.5899 122.4118 57.5326 40.5139 178.9396 118 N 4.3388 8.0616 116.7643 56.1968 38.5803 177.4275 119 V 3.6026 7.9206 119.6438 65.9545 31.6345 178.1418 120 K 4.0257 8.2585 118.3532 59.4860 31.8787 178.9589 121 E 3.9463 8.5001 119.6826 59.1601 29.6182 178.5838 122 R 3.8441 8.1067 118.7698 59.9098 30.1459 178.6061 123 Q 4.0955 8.4349 117.7706 58.7034 28.6736 178.5229 124 L 3.7158 8.0184 121.7491 57.6655 41.7790 178.9309 125 K 3.8730 8.0199 119.8012 59.1903 32.0406 178.8130 126 L 3.5569 7.8051 119.2184 57.8464 41.5649 179.5688 127 L 4.0993 8.2483 119.1182 57.9786 41.2936 179.7841 128 S 4.1270 7.8993 114.0908 60.7572 63.1243 176.0217 129 R 4.1381 7.3671 121.4274 59.0292 29.9772 177.8655 130 Y 4.8566 8.0980 116.7908 60.6673 37.9208 178.1531 131 V 3.8151 8.2547 119.5709 65.8328 31.5366 176.4787 132 P 4.3094 0.0000 0.0000 65.1932 31.3274 178.3145 133 A 4.0910 7.8317 118.7261 55.1156 18.3445 179.3051 134 F 3.5936 8.6557 119.3654 61.3796 39.2048 177.2101 135 A 3.9134 8.0132 119.3749 54.9424 18.1801 179.4741 136 K 3.9830 7.4173 116.2938 59.3594 32.1076 179.1763 137 L 3.9092 7.2039 117.9178 56.2390 42.1825 177.6604 138 A 3.7381 6.8673 120.9373 51.8580 18.8966 176.8435 139 K 4.1661 8.3929 121.1470 56.9753 34.2157 177.3487 140 F 4.0182 7.3596 115.9018 59.0104 36.8458 175.7042 141 S 4.9009 8.0392 110.8382 56.9032 63.0339 173.5311 142 P 4.8645 0.0000 0.0000 63.2093 32.7357 175.7969 143 Y 4.8060 7.5935 118.1688 56.9992 39.1115 176.8244 144 V 2.6247 9.1956 121.1181 64.0927 31.3172 177.6684 145 A 4.4043 8.8319 119.8399 50.9329 20.5571 177.9153 146 G 4.1378 7.0075 104.4592 45.6857 0.0000 173.9923 147 D 5.3746 8.7165 123.0809 52.7617 40.3164 176.5179 148 T 4.6411 7.5057 109.4089 59.3751 71.5681 173.3174 149 F 3.7450 8.0565 125.9571 58.2636 39.9496 174.3290 150 T 4.8046 8.2125 117.6986 59.0657 71.5743 174.2984 151 L 3.9736 8.4270 119.9337 57.8870 41.2492 179.5982 152 A 4.0072 7.7831 120.4948 54.9956 18.1620 179.3288 153 D 4.7662 7.6404 118.9463 56.8734 40.8638 178.6129 154 C 4.1391 7.7275 116.6844 62.4873 28.0679 175.9040 155 A 3.9215 7.7059 121.6251 55.0665 18.3098 179.5704 156 A 4.0309 8.4577 119.4967 55.2727 18.2065 179.7004 157 A 4.1588 8.3140 118.6856 54.6766 17.0974 179.2538 158 V 4.1179 7.6294 109.6141 63.0379 33.0771 177.7434 159 H 4.7048 8.1995 115.7373 58.2104 28.8553 177.7059 160 L 4.0709 7.9877 120.8581 57.4958 41.4857 177.8413 161 P 4.3412 0.0000 0.0000 65.4100 31.2240 178.4701 162 L 3.9615 7.5141 118.0977 58.0328 42.0283 179.1668 163 V 3.7878 8.0954 118.3128 66.0952 31.4926 178.2383 164 S 4.3506 8.2997 114.8531 61.7917 62.7312 176.8061 165 S 4.2034 8.3364 117.8643 61.7053 62.5892 176.1348 166 C 3.7294 8.5303 121.6818 62.9031 31.3322 175.9191 167 T 4.1134 8.1499 111.1488 64.7226 68.4518 176.6136 168 K 4.2212 8.2958 121.3686 59.3106 31.8448 179.3925 169 I 3.6623 7.4646 118.9348 64.4874 37.1313 178.3017 170 I 3.6885 7.5534 119.1976 63.5831 36.2913 177.1225 171 Y 4.7542 8.3318 115.6073 56.5661 38.6275 177.0119 172 G 4.1486 8.3362 107.5579 45.5463 0.0000 173.5522 173 K 4.5064 7.4453 117.1383 54.8594 35.7808 175.2172 174 D 4.4673 8.7078 121.5840 54.2724 40.8699 176.6266 175 L 4.2607 8.6240 127.4138 56.5135 41.9818 177.9362 176 L 4.5882 8.5377 118.8577 54.3677 41.6895 178.2513 177 A 4.0145 7.7479 123.6374 54.9166 18.2808 178.9373 178 D 4.6417 8.0124 113.1741 54.7642 41.5846 176.3283 179 L 4.5667 7.5962 119.8044 52.8028 43.9095 175.6154 180 P 4.7226 0.0000 0.0000 62.0194 29.0511 178.0546 181 V 3.5729 7.2855 119.5513 66.3711 32.2262 176.5437 182 K 3.9107 7.9428 119.0132 59.7395 32.0208 178.5052 183 E 3.9935 8.0974 118.2764 59.3939 29.4405 178.6595 184 Y 4.2131 7.9216 119.6511 60.8544 38.7273 178.1118 185 L 3.8788 8.1129 118.8492 57.2066 41.9237 179.2763 186 K 4.0467 7.9258 119.5239 59.8377 31.9926 178.6751 187 T 3.8469 7.6944 114.7575 66.9455 68.7542 175.8340 188 L 4.3166 7.6478 119.1830 56.2639 41.6198 179.0937 189 S 4.2979 7.9535 116.4656 61.4693 63.1600 175.8008 190 E 4.1683 8.0279 117.0598 57.5995 30.2919 182.0846 191 R 4.1726 7.8701 117.9018 55.7817 31.2760 175.6622 192 P 4.2775 0.0000 0.0000 65.5441 31.3208 178.8719 193 S 4.0980 7.9091 112.6594 61.6227 62.8706 176.7229 194 V 3.6144 7.6846 121.7799 65.4516 31.3305 177.8372 195 Q 3.9693 8.1858 117.9510 58.7268 28.4750 178.6806 196 K 3.9221 8.1920 120.6659 59.4874 32.2628 178.9966 197 V 3.6294 7.9499 118.5851 66.1440 31.4402 177.8226 198 N 4.3209 8.4860 116.1239 56.1006 38.5440 177.0451 199 A 4.0052 7.9180 122.2144 55.6911 18.5191 179.5905 200 D 4.3955 8.4105 117.2057 57.1756 40.8512 179.0459 201 R 4.2927 8.0182 120.9623 58.8997 30.2133 178.8081 202 K 4.0067 8.2053 118.1256 59.2748 32.1995 179.2360 203 A 4.0214 7.9052 120.6945 55.3116 18.1164 179.2565 204 N 4.4869 8.1731 114.3320 56.8476 39.0724 177.0828 205 T 4.1357 7.9470 116.8389 66.4848 68.6173 175.8934 206 E 4.1441 7.9117 119.9141 59.0487 30.0402 178.6804 207 L 4.1059 7.7017 117.1303 55.7770 41.3988 178.2046 *209 L 4.3137 7.8527 117.7397 54.1671 43.4480 178.4520 210 S 4.2328 7.6841 113.8579 60.9464 63.0816 175.3311 211 R 3.8496 7.6637 122.2352 56.6265 30.1468 177.5948 212 N 4.5838 8.7506 120.4834 53.8902 37.8800 173.9218 213 K 4.1802 7.3916 124.6734 55.5823 32.6749 181.0714 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 2 L 8.04 4.55 0.00 1.85 1.99 0.92 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.87 4.77 0.00 1.66 1.76 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.48 7.81 4 L 9.94 4.36 0.00 1.52 1.54 0.65 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 5 C 10.51 5.04 0.00 1.23 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 0.00 0.00 0.00 6 G 7.46 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 0.00 0.00 0.00 7 F 6.54 4.37 0.00 3.05 2.44 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 8 A 8.28 4.00 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 9 A 8.15 4.21 1.66 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 0.00 0.00 10 S 7.80 4.44 0.00 3.17 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 11 N 8.83 4.34 0.00 2.85 3.03 0.00 0.00 6.27 7.57 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 12 Y 8.06 4.13 0.00 3.06 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 13 Y 8.09 4.06 0.00 2.81 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 14 N 8.48 4.34 0.00 2.94 2.88 0.00 0.00 6.72 7.37 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 15 K 8.00 4.07 0.00 1.73 1.98 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.37 7.81 16 V 7.29 3.45 1.97 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 0.81 0.00 0.00 0.89 0.00 0.00 17 K 7.78 3.33 0.00 1.55 1.81 0.00 1.91 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.47 7.81 18 L 8.05 3.95 0.00 1.91 1.79 1.04 0.95 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 19 A 7.69 4.02 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 20 L 7.91 3.71 0.00 1.07 1.10 -0.09 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.06 4.08 0.00 1.85 1.73 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.50 3.93 0.00 1.93 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 2.37 2.44 0.00 23 K 7.73 4.29 0.00 1.78 1.81 0.00 1.95 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.52 7.81 24 N 7.64 4.17 0.00 2.89 2.88 0.00 0.00 6.84 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 V 7.51 3.84 1.79 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 -0.06 0.00 0.00 0.48 0.00 0.00 26 P 0.00 4.54 0.00 2.09 1.94 0.00 3.65 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 2.03 2.06 0.00 27 F 7.99 5.15 0.00 3.03 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 28 E 9.21 4.57 0.00 2.00 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 2.19 2.22 0.00 29 E 8.75 4.96 0.00 1.94 2.02 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 2.59 2.45 0.00 30 V 8.74 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 0.98 0.00 0.00 0.92 0.00 0.00 31 L 8.48 4.35 0.00 1.44 1.36 -0.17 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.61 4.45 1.32 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 F 8.13 4.87 0.00 2.11 1.88 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 0.00 111 F 7.67 4.98 0.00 3.28 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 0.00 112 G 8.50 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 0.00 113 G 8.39 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 0.00 0.00 0.00 114 K 8.38 5.01 0.00 1.72 1.52 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 1.00 7.81 115 V 9.05 4.56 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 0.89 0.00 0.00 0.90 0.00 0.00 116 S 8.29 4.37 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.59 4.36 0.00 2.72 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 0.00 118 N 8.06 4.34 0.00 2.74 2.87 0.00 0.00 6.80 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 0.00 119 V 7.92 3.60 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 1.13 0.00 0.00 0.94 0.00 0.00 120 K 8.26 4.03 0.00 2.04 1.95 0.00 1.69 0.00 0.00 1.47 0.00 0.00 2.76 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.61 7.81 121 E 8.50 3.95 0.00 2.15 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 2.31 2.32 0.00 122 R 8.11 3.84 0.00 2.17 2.03 0.00 3.15 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 123 Q 8.43 4.10 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.59 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 124 L 8.02 3.72 0.00 1.37 1.75 0.19 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.02 3.87 0.00 1.92 1.86 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.43 1.35 7.81 126 L 7.81 3.56 0.00 1.91 1.63 1.01 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 127 L 8.25 4.10 0.00 1.60 1.76 1.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 128 S 7.90 4.13 0.00 3.89 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 0.00 129 R 7.37 4.14 0.00 1.70 1.66 0.00 2.97 0.00 0.00 2.86 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 130 Y 8.10 4.86 0.00 3.18 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 0.00 131 V 8.25 3.82 2.26 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 1.24 0.00 0.00 1.09 0.00 0.00 132 P 0.00 4.31 0.00 2.10 2.13 0.00 3.92 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 133 A 7.83 4.09 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.66 3.59 0.00 3.37 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.01 3.91 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 0.00 136 K 7.42 3.98 0.00 2.04 1.77 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.35 7.81 137 L 7.20 3.91 0.00 1.24 1.44 0.53 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 138 A 6.87 3.74 0.36 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 0.00 139 K 8.39 4.17 0.00 1.64 1.78 0.00 1.81 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.21 1.54 7.81 140 F 7.36 4.02 0.00 3.15 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 0.00 141 S 8.04 4.90 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.86 0.00 1.92 2.08 0.00 3.36 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 0.93 1.70 0.00 143 Y 7.59 4.81 0.00 3.41 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 V 9.20 2.62 1.62 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 0.82 0.00 0.00 0.30 0.00 0.00 145 A 8.83 4.40 1.20 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 0.00 0.00 0.00 146 G 7.01 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.72 5.37 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 7.51 4.64 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 1.25 0.00 0.00 149 F 8.06 3.75 0.00 2.24 2.67 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 0.00 150 T 8.21 4.80 4.30 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 1.16 0.00 0.00 151 L 8.43 3.97 0.00 1.69 1.75 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.78 4.01 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 0.00 153 D 7.64 4.77 0.00 1.58 2.29 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 0.00 154 C 7.73 4.14 0.00 3.09 3.18 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 0.00 0.00 0.00 155 A 7.71 3.92 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 0.00 156 A 8.46 4.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 A 8.31 4.16 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 0.00 158 V 7.63 4.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.80 0.00 0.00 159 H 8.20 4.70 0.00 3.14 3.25 0.00 5.62 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 0.00 160 L 7.99 4.07 0.00 1.98 1.85 1.19 1.07 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 0.00 161 P 0.00 4.34 0.00 2.17 2.13 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 162 L 7.51 3.96 0.00 1.92 1.86 0.45 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 163 V 8.10 3.79 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 1.07 0.00 0.00 1.11 0.00 0.00 164 S 8.30 4.35 0.00 4.12 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 0.00 165 S 8.34 4.20 0.00 4.21 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 0.00 166 C 8.53 3.73 0.00 3.23 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 0.00 167 T 8.15 4.11 4.49 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 1.44 0.00 0.00 168 K 8.30 4.22 0.00 2.03 1.93 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.61 7.81 169 I 7.46 3.66 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.58 0.79 0.00 0.00 170 I 7.55 3.69 1.18 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 1.44 0.46 0.02 0.00 0.00 171 Y 8.33 4.75 0.00 3.07 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 0.00 172 G 8.34 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 0.00 173 K 7.45 4.51 0.00 2.05 1.78 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 174 D 8.71 4.47 0.00 2.74 2.65 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 0.00 0.00 0.00 0.00 175 L 8.62 4.26 0.00 1.75 1.73 0.75 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 176 L 8.54 4.59 0.00 1.87 1.73 1.04 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 177 A 7.75 4.01 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 0.00 178 D 8.01 4.64 0.00 2.71 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 0.00 179 L 7.60 4.57 0.00 1.62 1.54 1.30 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 180 P 0.00 4.72 0.00 2.00 2.07 0.00 3.34 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.67 0.00 181 V 7.29 3.57 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 1.22 0.00 0.00 0.95 0.00 0.00 182 K 7.94 3.91 0.00 1.86 1.77 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.54 7.81 183 E 8.10 3.99 0.00 2.19 1.97 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 2.38 2.41 0.00 184 Y 7.92 4.21 0.00 3.04 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 0.00 185 L 8.11 3.88 0.00 1.77 1.70 0.96 0.97 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 0.00 186 K 7.93 4.05 0.00 2.04 1.97 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.35 7.81 187 T 7.69 3.85 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 188 L 7.65 4.32 0.00 1.73 1.68 0.55 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 189 S 7.95 4.30 0.00 4.02 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 0.00 190 E 8.03 4.17 0.00 2.01 1.90 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 2.22 1.90 0.00 191 R 7.87 4.17 0.00 1.93 1.77 0.00 3.23 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 192 P 0.00 4.28 0.00 2.12 2.09 0.00 3.53 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 193 S 7.91 4.10 0.00 4.01 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 0.00 194 V 7.68 3.61 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 1.17 0.00 0.00 1.03 0.00 0.00 195 Q 8.19 3.97 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 196 K 8.19 3.92 0.00 1.84 1.95 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.46 7.81 197 V 7.95 3.63 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 1.01 0.00 0.00 0.99 0.00 0.00 198 N 8.49 4.32 0.00 2.84 2.85 0.00 0.00 6.91 7.87 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 0.00 199 A 7.92 4.01 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 0.00 0.00 0.00 0.00 0.00 200 D 8.41 4.40 0.00 2.76 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 0.00 201 R 8.02 4.29 0.00 2.02 2.14 0.00 3.10 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 202 K 8.21 4.01 0.00 2.01 1.85 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.62 7.81 203 A 7.91 4.02 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 0.00 204 N 8.17 4.49 0.00 2.84 2.94 0.00 0.00 7.31 7.11 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 0.00 205 T 7.95 4.14 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 1.22 0.00 0.00 206 E 7.91 4.14 0.00 2.02 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 2.34 2.33 0.00 207 L 7.70 4.11 0.00 1.92 2.02 1.02 0.68 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 *209 L 7.85 4.31 0.00 1.76 1.76 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 210 S 7.68 4.23 0.00 4.07 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 0.00 211 R 7.66 3.85 0.00 1.41 1.49 0.00 2.21 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00 212 N 8.75 4.58 0.00 2.74 2.72 0.00 0.00 6.43 7.44 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 0.00 213 K 7.39 4.18 0.00 1.66 1.53 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.21 7.81 * Residues marked with a * may have inaccurate shift predictions.