NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 83 S 4.5080 8.3344 116.8223 58.2548 64.3599 172.7360 84 S 4.1184 8.3182 117.1045 55.6947 62.7559 171.7067 85 P 2.9700 0.0000 0.0000 62.8105 32.7104 175.3578 86 A 4.3628 7.0514 121.2533 50.4210 19.8221 175.6540 87 P 4.5191 0.0000 0.0000 63.2711 32.1238 176.1139 88 R 4.5785 8.7848 123.5105 54.5848 33.4639 173.2077 89 Y 4.6766 8.6438 127.4498 56.9673 39.9098 174.2388 90 I 4.3230 7.8526 127.7401 59.3420 40.2052 174.6709 91 T 4.7734 8.0504 115.3161 60.1705 70.8221 173.1962 92 D 4.7805 8.9134 122.8990 54.7670 42.8868 176.6283 93 M 4.7583 8.4025 118.0047 53.0345 34.3418 176.5198 94 S 4.4119 8.7318 118.2030 58.0005 64.8649 175.4078 95 I 3.7743 8.2416 121.1087 63.7932 37.5748 177.5267 96 E 3.9789 8.1109 120.1079 59.3320 29.4361 178.3466 97 E 4.0996 7.7647 117.2821 59.5410 29.6522 178.9419 98 I 3.9723 7.7257 117.2313 63.4181 38.1615 177.2886 99 S 4.5188 7.6212 113.8019 58.4628 63.3204 174.6301 100 R 3.9525 7.4260 122.2594 56.4023 30.1922 175.8705 101 E 4.0391 8.8302 125.3500 56.0960 29.9300 176.0533 102 W 4.9956 7.9257 119.3339 54.6619 31.5465 173.6999 103 Y 4.5446 8.5416 114.7669 56.3251 41.1692 174.9293 104 M 5.0367 8.2202 120.6363 52.3843 34.5197 175.5915 105 L 4.0976 9.3229 126.2442 57.9778 42.4816 176.8386 106 M 4.7173 8.4660 120.7889 52.3226 33.1758 172.0966 107 P 4.6758 0.0000 0.0000 62.4742 32.4130 175.7633 108 R 4.9514 8.8954 122.7251 54.6079 34.5101 174.2473 109 Q 5.2168 8.4648 117.7040 55.1741 32.1671 174.0535 110 K 4.6655 9.2698 119.4567 55.2208 36.8558 175.2000 111 I 4.7952 8.4105 125.3506 60.1888 39.1689 175.5363 112 T 4.3835 8.7044 120.7605 61.0727 70.1476 173.6112 113 G 4.0878 7.8528 119.9356 46.6432 0.0000 173.4400 114 G 4.0421 8.9864 114.2086 45.1304 0.0000 171.8507 115 L 5.1487 7.8661 119.9472 52.7964 45.0515 174.9541 116 M 4.8006 9.2920 122.5716 53.8107 34.7846 174.4921 117 V 4.8237 8.9684 126.3194 61.1336 34.0944 174.2445 118 K 5.3949 9.3664 127.7881 54.9548 35.5193 175.1262 119 M 5.3499 8.9345 120.1090 53.9489 35.0781 173.5654 120 D 4.8771 9.0832 121.2634 53.4386 41.6865 176.7222 121 Q 4.2637 9.1807 128.7930 58.2975 28.8848 177.2115 122 A 4.1875 8.4124 120.6939 54.7992 18.9217 177.9089 123 I 3.9789 7.3800 117.9253 61.4954 37.5362 175.3930 124 M 4.9813 8.1420 121.1004 54.7543 33.9616 173.5839 125 D 4.6424 8.3989 116.8832 54.2870 39.4190 173.7971 126 K 4.7052 8.3253 117.2660 54.5491 35.2326 175.4515 127 R 4.7420 8.2670 122.4465 55.3532 31.6490 175.0515 128 I 4.9834 9.0001 126.6587 59.8347 41.0997 174.2918 129 T 5.0481 9.1763 123.4981 61.7970 71.1966 173.2986 130 L 4.9851 8.9052 127.1609 53.8860 43.5416 176.0195 131 K 5.2044 9.2673 122.0835 54.7004 36.6128 175.2239 132 A 5.2897 9.6810 124.6672 50.4720 23.3202 174.4251 133 N 5.2465 8.8508 117.9630 51.5140 41.5581 173.9895 134 F 5.1309 7.5886 116.4230 56.2755 41.9296 172.7538 135 S 5.1544 9.0698 115.0999 57.1744 65.3331 173.5622 136 V 4.9245 8.5225 114.9781 59.6493 35.5272 174.5279 137 L 4.6373 8.5863 122.3349 53.8219 44.0040 175.8690 138 F 3.7900 9.5154 120.0483 59.5629 35.7189 174.7770 139 D 5.0125 8.6861 116.1871 54.6882 39.2979 173.4426 140 Q 4.7813 8.1033 119.9837 53.6526 31.7725 174.1493 141 L 4.4628 8.9226 127.7808 56.1635 42.6373 175.1347 142 E 4.5775 9.5630 126.3044 57.6655 31.4050 176.0138 143 T 4.7252 7.5410 116.3097 61.5477 72.1720 172.6425 144 L 4.6334 8.9650 128.9301 54.7921 42.5891 176.1751 145 V 4.0959 8.7169 126.8814 65.0778 32.4466 176.1574 146 S 4.8012 7.7020 111.7035 57.2343 65.8639 173.0759 147 L 5.1871 8.7381 128.8562 53.3783 44.5515 175.1928 148 R 4.9138 9.3627 124.4594 54.2110 34.3137 174.0417 149 A 5.0882 8.0993 123.8187 50.3014 21.4896 175.7269 150 F 5.2489 9.2361 121.8201 55.7035 42.4273 175.8411 151 T 4.7989 8.5776 112.8225 60.0027 69.8620 175.4095 152 D 4.6332 8.7008 122.0216 57.4847 40.7991 177.6237 153 D 4.4993 8.0890 115.7877 53.6460 39.6936 177.0781 154 G 4.0077 8.7318 108.6650 45.5317 0.0000 173.8512 155 A 4.2759 8.3316 123.1248 51.7721 19.1150 176.9380 156 I 4.0787 8.0202 121.8177 60.2388 38.3386 176.2354 157 V 4.5748 7.9837 116.4534 60.9489 33.9682 174.8567 158 A 4.8413 6.6889 120.4794 51.2538 22.6304 174.6906 159 E 4.9306 9.2270 119.5287 54.9577 34.0038 173.8150 160 I 5.1673 8.8420 127.2742 59.6237 39.8245 174.8481 161 S 5.0024 9.0546 120.6801 56.0947 66.8187 171.7545 162 P 4.7942 0.0000 0.0000 62.7221 32.2092 176.2867 163 I 4.0163 8.7193 125.3955 60.1556 37.3181 174.8849 164 P 4.2175 0.0000 0.0000 65.7381 31.2579 178.0757 165 S 4.3010 7.9638 109.8262 59.9470 63.4816 173.9984 166 M 4.4682 7.6931 121.0826 53.3435 33.0794 174.2263 167 P 4.3884 0.0000 0.0000 62.0176 32.1387 176.6924 168 G 3.8945 8.6156 110.1565 45.9215 0.0000 173.1267 169 H 4.5697 8.4015 118.5740 55.1197 29.7410 175.3909 170 S 4.6651 8.7588 116.2827 57.3808 65.9201 175.4339 171 T 3.8911 8.2547 118.1213 66.6404 68.0208 176.2912 172 E 3.9121 8.2423 120.7703 59.4946 29.7252 178.4444 173 D 4.3548 8.3715 118.9492 57.3844 40.8246 179.0522 174 V 3.5452 7.6390 118.0306 65.9797 31.5779 178.1765 175 K 3.9332 8.2150 118.3454 59.5520 31.8176 179.1049 176 N 4.3220 8.5238 116.7903 56.2449 38.5005 177.3416 177 A 3.9846 8.5458 122.4565 55.2432 18.4040 179.7886 178 I 3.7618 8.1607 118.8097 64.2975 37.0699 178.7724 179 G 3.6826 8.2063 106.8866 47.9869 0.0000 175.7805 180 I 3.8209 8.0442 115.9742 63.0955 37.5894 178.1122 181 L 3.9409 8.0286 122.3232 58.1614 41.9502 178.9927 182 I 3.7948 8.0542 120.0696 64.3029 37.1033 178.6670 183 G 3.7183 8.4859 106.9981 47.7033 0.0000 175.9106 184 G 3.8335 8.3388 107.5923 47.7464 0.0000 175.5297 185 L 4.2340 8.2243 121.9232 57.4239 41.6519 179.3571 186 E 4.0959 8.5256 118.2549 58.5163 29.1496 179.0253 187 W 4.2378 7.8657 118.2203 58.9360 29.2596 176.4117 188 N 4.9260 8.1055 115.1800 52.8535 38.0134 174.9881 189 D 4.3000 8.2104 115.8799 55.3757 39.0838 173.4346 190 N 4.8496 8.1299 115.4945 53.2047 39.4368 174.5117 191 S 4.7739 8.9834 117.0757 56.7766 65.3259 172.8885 192 I 4.9058 8.3856 125.1601 59.5246 39.0733 175.1485 193 R 4.7989 9.1111 121.7318 54.3872 32.9668 173.8303 194 A 5.1575 8.4263 122.1400 49.7898 21.7598 176.4984 195 S 4.2366 8.5299 115.5253 58.5417 64.0612 175.5779 196 E 3.9611 8.8984 119.8108 59.6332 29.1665 179.2151 197 N 4.5439 8.2795 116.0174 56.5702 38.6571 177.3331 198 I 3.6928 8.0698 120.9891 64.5715 37.0185 178.3897 199 Q 3.9606 7.9110 117.5150 59.0393 28.5776 178.8684 200 R 3.8408 7.9844 118.7531 58.6906 30.4065 177.6217 201 F 5.0760 8.4295 115.8429 55.4183 40.2291 176.8496 202 A 4.4344 8.3796 116.7401 52.0560 18.7325 178.7757 *218 Q 3.9652 9.0186 116.4128 56.9829 30.1548 173.3345 219 K 4.7186 7.9872 119.0539 56.9759 39.0398 176.0547 220 R 4.7510 7.2886 112.8620 54.5183 32.4136 173.7689 221 Y 4.5604 8.3326 115.8533 56.0637 40.9894 175.1670 222 M 4.0476 8.8430 124.9556 54.9339 32.7521 175.4215 223 A 3.8527 8.8403 129.0579 53.6818 18.8666 177.1802 224 R 4.1824 8.7210 118.4047 56.7906 30.7733 176.0962 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 83 S 8.33 4.51 0.00 4.37 4.06 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 0.00 0.00 0.00 0.00 84 S 8.32 4.12 0.00 3.86 3.65 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 85 P 0.00 2.97 0.00 2.12 2.13 0.00 3.69 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 1.87 1.96 0.00 86 A 7.05 4.36 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 87 P 0.00 4.52 0.00 1.93 2.02 0.00 3.58 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 88 R 8.78 4.58 0.00 1.76 1.59 0.00 3.04 0.00 0.00 3.03 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.49 0.00 89 Y 8.64 4.68 0.00 2.85 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 90 I 7.85 4.32 0.56 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 -0.06 0.55 0.00 0.00 91 T 8.05 4.77 4.39 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 1.08 0.00 0.00 92 D 8.91 4.78 0.00 2.80 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 93 M 8.40 4.76 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.46 0.00 94 S 8.73 4.41 0.00 4.06 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 95 I 8.24 3.77 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.35 0.93 0.00 0.00 96 E 8.11 3.98 0.00 2.07 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 2.42 2.38 0.00 97 E 7.76 4.10 0.00 2.13 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 0.00 2.43 2.35 0.00 98 I 7.73 3.97 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.82 1.03 0.00 0.00 99 S 7.62 4.52 0.00 4.04 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 0.00 100 R 7.43 3.95 0.00 2.08 1.96 0.00 3.34 0.00 0.00 3.68 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 101 E 8.83 4.04 0.00 1.97 1.60 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 2.25 2.29 0.00 102 W 7.93 5.00 0.00 3.45 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 8.54 4.54 0.00 2.94 2.82 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 0.00 104 M 8.22 5.04 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.76 0.00 105 L 9.32 4.10 0.00 1.62 1.90 0.93 0.95 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 0.00 106 M 8.47 4.72 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 107 P 0.00 4.68 0.00 1.91 1.93 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.24 0.00 108 R 8.90 4.95 0.00 1.73 1.77 0.00 3.26 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 109 Q 8.46 5.22 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.67 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 110 K 9.27 4.67 0.00 1.66 1.70 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.43 7.81 111 I 8.41 4.80 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.96 0.00 0.00 112 T 8.70 4.38 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 1.24 0.00 0.00 113 G 7.85 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 G 8.99 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 0.00 0.00 0.00 115 L 7.87 5.15 0.00 1.73 1.52 0.88 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 116 M 9.29 4.80 0.00 2.20 1.92 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 117 V 8.97 4.82 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 0.99 0.00 0.00 0.95 0.00 0.00 118 K 9.37 5.39 0.00 1.97 1.81 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.41 7.81 119 M 8.93 5.35 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 120 D 9.08 4.88 0.00 2.96 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 0.00 121 Q 9.18 4.26 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 122 A 8.41 4.19 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 0.00 123 I 7.38 3.98 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.89 1.00 0.00 0.00 124 M 8.14 4.98 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 125 D 8.40 4.64 0.00 2.84 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.33 4.71 0.00 1.76 1.70 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.54 1.51 7.81 127 R 8.27 4.74 0.00 1.90 1.80 0.00 3.16 0.00 0.00 3.30 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.50 0.00 128 I 9.00 4.98 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.97 0.90 0.00 0.00 129 T 9.18 5.05 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 1.21 0.00 0.00 130 L 8.91 4.99 0.00 1.60 1.60 0.91 0.54 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 0.00 131 K 9.27 5.20 0.00 1.83 1.65 0.00 0.83 0.00 0.00 1.39 0.00 0.00 2.64 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.30 1.36 7.81 132 A 9.68 5.29 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 0.00 133 N 8.85 5.25 0.00 2.73 2.51 0.00 0.00 6.65 8.46 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 0.00 134 F 7.59 5.13 0.00 3.24 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 0.00 135 S 9.07 5.15 0.00 3.94 4.18 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 0.00 136 V 8.52 4.92 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 0.40 0.00 0.00 0.73 0.00 0.00 137 L 8.59 4.64 0.00 1.64 1.56 0.95 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 138 F 9.52 3.79 0.00 3.22 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 0.00 139 D 8.69 5.01 0.00 3.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.10 4.78 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.93 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 141 L 8.92 4.46 0.00 1.49 1.50 0.19 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 E 9.56 4.58 0.00 1.96 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 0.00 2.24 2.33 0.00 143 T 7.54 4.73 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 144 L 8.96 4.63 0.00 1.63 1.50 0.96 0.97 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 0.00 145 V 8.72 4.10 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 0.89 0.00 0.00 1.20 0.00 0.00 146 S 7.70 4.80 0.00 3.95 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 0.00 147 L 8.74 5.19 0.00 1.74 1.45 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 148 R 9.36 4.91 0.00 1.64 1.06 0.00 3.14 0.00 0.00 2.94 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.43 0.00 149 A 8.10 5.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 F 9.24 5.25 0.00 2.86 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 0.00 151 T 8.58 4.80 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 152 D 8.70 4.63 0.00 2.71 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 0.00 153 D 8.09 4.50 0.00 2.82 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 0.00 154 G 8.73 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 A 8.33 4.28 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 0.00 156 I 8.02 4.08 1.51 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.18 -0.58 0.00 0.00 157 V 7.98 4.57 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 0.70 0.00 0.00 0.90 0.00 0.00 158 A 6.69 4.84 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 0.00 159 E 9.23 4.93 0.00 1.70 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 2.27 2.44 0.00 160 I 8.84 5.17 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.80 0.89 0.00 0.00 161 S 9.05 5.00 0.00 3.87 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 0.00 162 P 0.00 4.79 0.00 2.01 2.11 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.30 0.00 163 I 8.72 4.02 1.89 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 1.24 0.64 0.92 0.00 0.00 164 P 0.00 4.22 0.00 2.04 2.15 0.00 3.69 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 2.05 2.12 0.00 165 S 7.96 4.30 0.00 3.98 3.99 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 0.00 166 M 7.69 4.47 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.66 0.00 167 P 0.00 4.39 0.00 2.05 1.98 0.00 3.73 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 2.03 2.08 0.00 168 G 8.62 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 0.00 169 H 8.40 4.57 0.00 3.33 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 S 8.76 4.67 0.00 4.08 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 0.00 171 T 8.25 3.89 4.26 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 1.22 0.00 0.00 172 E 8.24 3.91 0.00 2.04 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 2.39 2.42 0.00 173 D 8.37 4.35 0.00 2.96 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 0.00 174 V 7.64 3.55 2.18 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 1.05 0.00 0.00 0.98 0.00 0.00 175 K 8.21 3.93 0.00 1.83 1.83 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.66 7.81 176 N 8.52 4.32 0.00 2.94 2.87 0.00 0.00 6.93 7.49 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 0.00 177 A 8.55 3.98 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 0.00 178 I 8.16 3.76 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.69 0.89 0.00 0.00 179 G 8.21 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 I 8.04 3.82 1.91 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 1.69 1.20 0.94 0.00 0.00 181 L 8.03 3.94 0.00 1.86 1.86 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 182 I 8.05 3.79 1.92 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 1.45 0.54 0.89 0.00 0.00 183 G 8.49 3.72 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 0.00 0.00 0.00 184 G 8.34 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 0.00 0.00 0.00 185 L 8.22 4.23 0.00 1.72 1.75 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.53 4.10 0.00 1.93 1.87 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 2.46 2.48 0.00 187 W 7.87 4.24 0.00 3.54 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 N 8.11 4.93 0.00 3.01 2.89 0.00 0.00 6.89 8.09 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 0.00 189 D 8.21 4.30 0.00 3.00 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 0.00 190 N 8.13 4.85 0.00 2.74 2.84 0.00 0.00 6.97 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 0.00 191 S 8.98 4.77 0.00 3.84 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 0.00 192 I 8.39 4.91 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.89 0.91 0.00 0.00 193 R 9.11 4.80 0.00 1.80 1.96 0.00 2.72 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 194 A 8.43 5.16 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 0.00 195 S 8.53 4.24 0.00 3.96 4.21 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 0.00 196 E 8.90 3.96 0.00 2.01 2.03 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 2.40 2.34 0.00 197 N 8.28 4.54 0.00 3.13 3.32 0.00 0.00 7.13 7.39 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 0.00 198 I 8.07 3.69 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.71 0.87 0.00 0.00 199 Q 7.91 3.96 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 200 R 7.98 3.84 0.00 1.58 1.68 0.00 2.94 0.00 0.00 2.80 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 201 F 8.43 5.08 0.00 3.44 3.15 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 0.00 202 A 8.38 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *218 Q 9.02 3.97 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 219 K 7.99 4.72 0.00 1.70 1.78 0.00 1.81 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.42 7.81 220 R 7.29 4.75 0.00 1.86 1.81 0.00 2.95 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.60 0.00 221 Y 8.33 4.56 0.00 2.91 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 0.00 222 M 8.84 4.05 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 223 A 8.84 3.85 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 0.00 224 R 8.72 4.18 0.00 2.07 1.99 0.00 3.14 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 * Residues marked with a * may have inaccurate shift predictions.