NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.4254 7.8676 121.0503 61.2743 39.8416 174.2896 17 S 4.5444 9.2025 122.3392 55.6632 66.2480 172.0708 18 G 3.3997 8.3185 109.9642 47.2271 0.0000 174.9045 19 G 3.7948 8.8901 112.9996 45.2273 0.0000 172.8518 *29 D 4.5954 8.0167 117.5934 53.7474 42.6084 175.0290 30 A 4.5901 8.4842 122.6769 52.1176 19.3704 177.0432 31 I 4.9267 8.3489 113.3856 59.4208 41.5582 173.7152 32 Y 5.4169 9.7138 122.4560 56.6726 41.2487 175.2452 33 S 4.7212 8.4712 119.1720 56.5967 65.4360 173.7175 34 S 4.2125 8.4675 112.4938 61.0635 63.3746 175.7447 *39 T 4.4094 7.2736 109.4360 60.9329 70.9302 174.0606 40 G 4.0360 6.6793 108.5432 45.9162 0.0000 171.3071 41 R 5.0574 8.6554 119.8046 54.7750 33.3357 176.3834 42 C 5.0917 8.9117 120.5461 55.8780 44.5816 172.7363 43 S 5.2130 8.5612 114.7938 57.0253 66.1833 174.1867 44 L 3.2977 8.5948 125.4748 55.5673 42.1988 176.2968 45 G 3.9511 9.4911 114.3677 47.9832 0.0000 172.7610 46 F 5.0756 7.9250 115.6577 54.8742 44.4095 173.5223 47 N 5.3974 8.9022 119.3993 53.2754 39.5512 174.7655 48 V 5.2192 9.3882 115.8196 60.4294 37.2289 173.9099 48A R 5.2002 8.9588 116.7889 55.6109 33.4044 174.0935 48B S 4.6743 8.9058 114.5863 56.7116 65.7179 174.3712 48C G 3.8679 9.1255 117.6579 47.1092 0.0000 173.8523 48D S 4.4836 8.9864 115.7965 57.6832 63.2479 173.1035 49 T 4.3631 8.1724 119.1709 62.6769 69.5896 173.1226 50 Y 5.1309 8.2843 123.9545 57.1389 40.5439 174.3813 51 Y 5.4183 9.4646 119.8702 56.8783 43.4638 173.5409 52 F 5.5653 8.6206 113.7647 55.6546 41.6815 174.0255 53 L 5.0788 9.1006 120.9224 54.5727 44.2035 175.8138 54 T 4.5257 8.2489 114.3316 61.4737 71.3949 172.3697 55 A 4.2694 8.5364 123.9936 51.7940 19.3427 179.0747 56 G 3.8362 8.8237 108.4573 45.9179 0.0000 175.8482 57 H 3.7179 7.8670 115.9966 57.6458 28.3702 176.5645 58 C 4.5543 7.5388 118.8092 59.7300 35.8857 175.3168 59 T 4.4101 7.9758 110.6383 62.8104 68.7214 173.9120 60 D 4.3086 7.9562 122.8848 54.6698 41.2397 176.5872 58 G 3.9643 7.5488 109.0092 46.6300 0.0000 175.6168 59 A 4.3801 8.0658 120.8383 53.5104 18.0214 177.0120 60 T 4.0186 7.7662 116.0848 62.2698 69.9397 174.9872 65 T 4.6700 7.4308 119.1492 60.7019 70.6736 173.6288 66 W 4.9901 8.3896 123.9304 54.7134 32.7600 174.6589 67 W 5.4052 9.9696 123.0468 55.0113 32.4224 176.2156 68 A 4.4556 9.6737 123.3602 53.6875 19.4348 177.2847 *78 N 5.1484 8.2536 112.0667 52.2595 38.4330 175.6797 79 S 3.0069 7.7870 113.0987 60.7277 63.1440 175.5213 80 A 3.8363 7.5733 122.4130 52.7500 18.4967 176.9212 81 R 3.2864 7.3229 113.8955 57.6130 27.4768 177.0300 82 T 4.3634 8.1755 106.7892 61.7359 70.7998 173.9878 83 T 4.6299 8.3373 119.6737 61.6565 70.3790 174.0670 84 V 3.8882 8.6238 126.7150 63.1716 32.3658 174.6505 85 L 4.6601 8.9221 124.6355 54.6916 43.9079 176.9288 86 G 4.3004 7.0919 104.2517 45.6231 0.0000 171.2244 87 T 5.7948 7.4857 108.5866 59.7867 72.3692 173.7181 88 T 4.2597 8.7827 120.3250 64.7554 68.4368 174.0043 89 S 4.6586 8.8159 121.7000 58.6351 65.1165 174.4133 90 G 4.1239 7.6556 104.1543 45.7108 0.0000 172.5368 91 S 4.7862 8.2310 115.6596 56.9153 66.4492 172.8915 *93 S 4.4723 8.6715 120.6677 58.9761 63.1945 171.9319 94 F 5.3071 8.5910 124.3778 57.5906 42.3085 172.0196 *99A P 3.1447 0.0000 0.0000 63.9374 31.8872 174.4598 100 N 4.9557 8.7386 117.2402 53.7897 37.7794 174.3312 101 N 5.5393 7.4156 112.7415 51.9043 42.0089 173.9331 102 D 5.2058 8.7685 115.4850 53.3278 41.7379 173.4491 103 Y 5.2864 8.0490 118.7628 55.7528 42.1073 175.8674 104 G 4.4767 9.1086 106.2787 45.4030 0.0000 171.5983 105 I 4.9776 8.6434 120.1735 58.8427 41.9350 174.0398 106 V 4.4603 7.9856 127.9742 60.8168 34.3583 174.0916 107 R 4.3175 8.6487 128.9451 55.4387 31.3237 175.0524 108 Y 4.8208 8.3769 125.2289 58.4599 38.1689 176.0309 109 T 4.4307 9.2731 112.7898 61.2878 70.7633 173.2383 110 N 4.7698 8.3039 121.7049 53.2342 39.1370 174.5264 111 T 4.1959 8.5380 116.1514 62.9776 69.7488 175.4857 112 T 4.2275 7.9010 111.0029 62.4808 70.1454 175.1983 113 I 3.6998 7.8225 122.7222 60.0477 38.3538 173.7208 114 P 4.2927 0.0000 0.0000 62.7677 31.8010 176.8943 115 K 4.4374 7.9066 121.9691 54.2016 31.8514 174.7502 116 D 4.4863 8.4256 121.6832 54.1993 42.1463 177.6652 117 G 3.4986 8.4236 113.9383 44.8665 0.0000 171.7401 118 T 4.8212 7.1324 108.1780 59.9562 72.7718 173.1543 119 V 4.4232 8.2742 120.9142 61.4311 32.8565 176.1248 120 G 3.7568 8.0757 120.3656 46.8148 0.0000 175.6301 121 G 3.6370 8.7959 113.5229 47.2272 0.0000 173.3463 122 Q 3.9665 7.9506 122.7647 55.7116 29.3155 174.9361 123 D 4.6778 8.5532 125.2443 54.1419 42.0567 174.8698 124 I 4.8355 7.9280 126.0526 59.8533 39.2062 175.4532 125 T 4.6955 8.8750 115.8935 61.3064 70.5124 173.1760 126 S 4.6000 7.4555 115.4912 58.0678 66.0813 173.5772 127 A 5.2595 8.4795 120.3876 50.4118 21.7458 174.9666 128 A 4.6307 8.4596 120.2086 50.8056 22.9888 175.6704 129 N 4.6038 8.5580 116.2046 52.1207 39.7571 175.8083 130 A 4.2619 8.3384 124.9635 52.3298 19.4846 176.9702 131 T 4.6936 7.9441 109.0192 59.2092 72.0311 173.6927 132 V 3.7410 8.2533 123.2226 64.6485 31.8359 176.4320 133 G 3.9461 8.9476 116.2263 45.0187 0.0000 173.1257 134 M 4.2190 7.8682 120.8743 55.3355 33.4393 174.9499 135 A 4.7201 8.5002 128.0558 51.7727 19.5920 176.8155 136 V 4.5756 8.7487 115.3473 59.8747 36.6471 174.7867 137 T 4.9162 8.3609 117.2408 61.9221 72.8251 173.3348 138 R 5.6874 9.1019 125.2177 53.6706 33.4271 174.1217 139 R 5.1564 8.6890 123.8886 54.6776 33.4058 174.0963 140 G 4.3983 8.7673 112.2179 44.4244 0.0000 172.9491 141 S 4.3840 9.0454 115.3061 60.3341 63.7954 175.6262 142 T 4.2806 8.1935 117.8820 65.6029 69.1444 176.4058 143 T 4.3176 8.1424 109.8279 62.4932 70.7483 174.5531 *156 G 4.3717 7.4196 108.9993 46.9008 0.0000 172.5785 157 T 5.3338 8.5859 121.7290 62.6050 70.0045 174.0209 158 H 4.9480 9.3119 122.4813 54.2350 33.4838 172.8463 159 S 5.1069 8.5366 116.3602 56.4702 66.7215 174.3803 160 G 4.0240 7.5603 107.0978 46.4216 0.0000 172.1509 161 S 5.1041 8.5611 116.1772 56.5624 68.1430 173.7049 162 V 4.2036 8.4973 122.5274 63.2379 31.6979 176.4161 163 T 4.4751 8.7140 117.8997 61.9907 70.2396 174.1163 164 A 4.5310 7.4041 121.5967 51.3866 22.3711 174.8716 165 L 4.9921 8.4022 118.4585 52.5669 45.9180 175.3287 166 N 4.1453 8.7185 114.7131 54.6258 37.5683 173.4948 167 A 4.6771 8.2373 117.3350 51.6964 20.3759 177.4164 168 T 4.7010 8.3350 117.0457 61.7603 70.6033 174.1671 169 V 3.7362 8.1047 126.3515 60.6924 34.2152 173.5505 170 N 4.6894 8.2500 126.7233 52.2433 39.5576 173.7657 171 Y 4.4311 8.7798 124.3727 57.6357 38.5432 177.0517 172 G 3.9546 8.6652 106.7681 46.0256 0.0000 173.8668 173 G 4.0400 9.4517 104.2016 46.3571 0.0000 175.0146 174 G 3.8894 8.4712 105.8837 45.0981 0.0000 174.8932 175 D 4.5107 7.9541 121.5646 52.7059 40.1841 174.0545 176 V 4.4780 7.6377 121.5249 60.7095 34.3840 174.1581 177 V 4.6900 8.1110 120.5740 59.7117 34.7029 174.3107 178 Y 4.8132 8.4720 120.9205 56.3435 41.5766 175.2857 179 G 4.4745 8.8244 106.3925 45.9548 0.0000 173.8659 180 M 4.7033 8.2029 118.9647 54.5980 33.9182 175.6344 181 I 4.6095 8.9761 123.3268 60.7454 38.8736 174.9169 182 R 4.6282 9.0860 128.4992 55.3366 31.9136 175.1004 183 T 5.0913 8.2864 114.4332 60.1027 73.3290 173.1777 184 N 4.7785 8.3393 116.1628 52.8715 38.4590 174.3984 *190 V 4.4545 8.0350 117.8134 63.7874 32.4951 173.9843 191 C 4.6321 8.7457 121.0057 54.9287 43.1517 172.1832 192 A 4.6749 7.7579 120.6137 51.8074 21.3737 175.2110 192A E 4.7205 9.2866 118.7999 53.5763 33.9080 173.4992 192B P 4.2436 0.0000 0.0000 64.5806 31.5154 176.3404 193 G 4.3797 8.8779 110.5482 46.7348 0.0000 174.2581 194 D 4.5063 8.4796 118.9300 55.3766 41.5335 176.6590 195 S 4.3701 7.9180 115.8007 60.3943 63.2346 175.6744 196 G 4.1522 8.8588 112.3202 46.3452 0.0000 173.8590 197 G 4.0521 8.0057 107.1855 44.8443 0.0000 171.4756 198 P 4.8437 0.0000 0.0000 62.2633 33.1161 174.7981 199 L 5.1034 9.2078 124.5282 53.6349 44.2912 174.7144 200 Y 5.4388 9.2087 123.9525 55.5779 42.6986 174.7372 201 S 4.4009 9.3024 114.2854 56.1945 64.7000 175.0407 202 G 3.9516 8.6751 120.9580 46.8496 0.0000 173.0450 *207 T 4.9464 8.3904 115.5397 61.0042 71.2106 171.4604 208 R 5.0372 7.9117 121.8451 54.8592 32.3210 175.3999 209 A 4.3983 9.1331 127.0000 52.1225 19.1614 177.1248 210 I 4.1149 9.1334 122.8271 62.6657 40.3633 175.6213 211 G 4.7277 7.8367 106.1347 45.6840 0.0000 171.2659 212 L 5.5266 8.9566 118.9712 52.8164 45.4064 176.9140 213 T 3.5817 9.2255 121.2918 64.3960 68.8820 173.6104 214 S 4.3556 8.3905 120.7359 58.0254 64.0838 174.3182 215 G 4.0405 7.3126 105.0375 46.3824 0.0000 171.6987 216 G 4.2170 7.7596 105.3593 46.2469 0.0000 170.5944 217 S 4.6788 7.8886 116.1213 57.2729 66.7129 174.2105 218 G 4.0546 9.7999 107.6761 45.7130 0.0000 171.4953 219 N 4.7622 7.7584 115.3057 52.2205 40.2400 174.5991 220 C 4.3414 9.5204 115.9781 59.3265 40.5257 175.8768 221 S 4.2343 8.2941 113.8512 61.2481 62.1465 175.1839 222 S 4.2888 8.5314 114.1602 58.9975 63.1765 175.4606 223 G 4.0057 9.7075 107.0385 45.5730 0.0000 172.6782 224 G 4.3253 7.6281 104.7397 45.9157 0.0000 171.9672 225 T 4.8349 8.3290 115.5308 61.9719 71.8609 173.7401 226 T 4.9758 8.2951 122.8295 61.6817 72.1683 173.0630 227 F 5.4006 9.3610 124.3421 55.9994 41.7148 174.8695 228 F 5.3537 9.4064 120.5241 55.6444 43.3267 173.8480 229 Q 4.7162 9.2998 124.0898 54.7211 30.6181 173.6013 230 P 4.8390 0.0000 0.0000 62.7185 32.0881 177.8272 231 V 3.8242 8.7856 124.2597 64.6454 31.3464 178.7315 232 T 3.7776 7.8521 110.4878 64.8658 68.5187 176.0807 233 E 3.8475 7.7912 120.1320 58.9970 29.5479 179.2197 234 A 2.7097 7.3860 120.3189 54.5543 18.5628 179.5043 235 L 3.8759 7.8290 117.6247 57.7979 41.5111 179.7850 235A S 3.9545 7.8973 112.8708 61.2445 62.1684 175.7721 236 A 3.8371 7.3558 122.1005 55.1004 18.1316 178.4043 237 Y 4.6986 7.3055 111.3678 56.8718 38.6872 175.8974 238 G 3.8706 7.6417 108.0666 46.9587 0.0000 173.6376 239 V 4.7723 7.4863 111.1997 59.2234 35.2157 175.4155 240 S 4.7458 8.7470 114.8005 56.9205 66.5849 174.2752 241 V 4.4154 8.3342 114.7743 61.5267 32.7607 176.0015 242 Y 4.4052 7.6871 118.8312 57.6487 37.6409 174.7211 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 16 I 7.87 4.43 1.91 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 1.33 1.43 1.00 0.00 0.00 17 S 9.20 4.54 0.00 4.07 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.32 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 19 G 8.89 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *29 D 8.02 4.60 0.00 2.64 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.48 4.59 1.09 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 31 I 8.35 4.93 1.98 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.70 0.53 0.00 0.00 32 Y 9.71 5.42 0.00 3.19 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 33 S 8.47 4.72 0.00 3.00 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 34 S 8.47 4.21 0.00 4.04 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 0.00 *39 T 7.27 4.41 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 40 G 6.68 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 41 R 8.66 5.06 0.00 1.48 1.71 0.00 2.96 0.00 0.00 2.80 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.29 0.00 42 C 8.91 5.09 0.00 2.90 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 43 S 8.56 5.21 0.00 3.76 3.61 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 0.00 0.00 0.00 0.00 44 L 8.59 3.30 0.00 1.26 1.25 0.33 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.49 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 46 F 7.92 5.08 0.00 2.97 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 47 N 8.90 5.40 0.00 2.70 3.06 0.00 0.00 6.73 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 48 V 9.39 5.22 2.31 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 0.93 0.00 0.00 1.14 0.00 0.00 48A R 8.96 5.20 0.00 1.33 1.47 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.38 0.00 48B S 8.91 4.67 0.00 3.88 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 48C G 9.13 3.87 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 0.00 0.00 0.00 48D S 8.99 4.48 0.00 3.96 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 49 T 8.17 4.36 4.41 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 0.74 0.00 0.00 50 Y 8.28 5.13 0.00 2.98 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 51 Y 9.46 5.42 0.00 2.83 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 52 F 8.62 5.57 0.00 3.10 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 53 L 9.10 5.08 0.00 1.83 1.78 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.25 4.53 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 0.96 0.00 0.00 55 A 8.54 4.27 1.09 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 56 G 8.82 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 57 H 7.87 3.72 0.00 2.46 1.31 0.00 5.56 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.54 4.55 0.00 3.11 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 59 T 7.98 4.41 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 1.22 0.00 0.00 60 D 7.96 4.31 0.00 3.06 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 58 G 7.55 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 59 A 8.07 4.38 1.47 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 0.00 0.00 60 T 7.77 4.02 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 1.21 0.00 0.00 65 T 7.43 4.67 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 0.25 0.00 0.00 66 W 8.39 4.99 0.00 3.28 3.23 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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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 8.59 5.31 0.00 2.94 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 *99A P 0.00 3.14 0.00 2.02 1.10 0.00 3.72 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 100 N 8.74 4.96 0.00 2.92 3.14 0.00 0.00 7.27 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 7.42 5.54 0.00 2.49 2.53 0.00 0.00 6.35 8.08 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 0.00 102 D 8.77 5.21 0.00 2.90 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 0.00 103 Y 8.05 5.29 0.00 3.03 2.96 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 0.00 104 G 9.11 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.64 4.98 1.30 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.90 0.00 0.00 114 P 0.00 4.29 0.00 2.04 1.93 0.00 3.65 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 2.00 2.07 0.00 115 K 7.91 4.44 0.00 1.36 1.59 0.00 1.09 0.00 0.00 0.79 0.00 0.00 2.41 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.00 7.81 116 D 8.43 4.49 0.00 2.59 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 0.00 117 G 8.42 3.50 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 0.00 0.00 0.00 118 T 7.13 4.82 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 119 V 8.27 4.42 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 0.74 0.00 0.00 0.58 0.00 0.00 120 G 8.08 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.80 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 0.00 122 Q 7.95 3.97 0.00 2.14 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.22 0.00 123 D 8.55 4.68 0.00 2.66 2.54 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 0.00 124 I 7.93 4.84 1.94 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.19 0.86 0.00 0.00 125 T 8.87 4.70 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 1.21 0.00 0.00 126 S 7.46 4.60 0.00 3.83 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 0.00 127 A 8.48 5.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.46 4.63 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 N 8.56 4.60 0.00 2.72 2.75 0.00 0.00 6.88 7.35 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 0.00 130 A 8.34 4.26 1.24 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 0.00 131 T 7.94 4.69 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 1.21 0.00 0.00 132 V 8.25 3.74 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 0.79 0.00 0.00 0.94 0.00 0.00 133 G 8.95 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 0.00 134 M 7.87 4.22 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 135 A 8.50 4.72 1.18 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 0.00 0.00 136 V 8.75 4.58 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 0.69 0.00 0.00 0.74 0.00 0.00 137 T 8.36 4.92 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 1.07 0.00 0.00 138 R 9.10 5.69 0.00 1.90 1.82 0.00 3.23 0.00 0.00 3.59 7.05 0.00 0.00 0.00 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1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 T 8.34 4.70 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 0.95 0.00 0.00 169 V 8.10 3.74 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 -0.06 0.00 0.00 -0.22 0.00 0.00 170 N 8.25 4.69 0.00 2.54 2.54 0.00 0.00 7.18 7.54 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 0.00 171 Y 8.78 4.43 0.00 3.18 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 8.67 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 0.00 173 G 9.45 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 0.00 174 G 8.47 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 0.00 175 D 7.95 4.51 0.00 2.87 2.69 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 0.00 176 V 7.64 4.48 1.84 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 0.35 0.00 0.00 0.87 0.00 0.00 177 V 8.11 4.69 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 0.88 0.00 0.00 0.83 0.00 0.00 178 Y 8.47 4.81 0.00 2.81 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 0.00 179 G 8.82 4.47 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 0.00 0.00 0.00 180 M 8.20 4.70 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 181 I 8.98 4.61 2.10 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 1.19 0.84 0.96 0.00 0.00 182 R 9.09 4.63 0.00 1.98 1.78 0.00 3.11 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.00 183 T 8.29 5.09 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 1.23 0.00 0.00 184 N 8.34 4.78 0.00 2.79 3.01 0.00 0.00 7.02 8.92 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 *190 V 8.04 4.45 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 1.15 0.00 0.00 0.88 0.00 0.00 191 C 8.75 4.63 0.00 3.08 3.06 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 0.00 192 A 7.76 4.67 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 192A E 9.29 4.72 0.00 1.92 1.78 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 2.21 2.24 0.00 192B P 0.00 4.24 0.00 2.02 2.02 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 193 G 8.88 4.38 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 0.00 194 D 8.48 4.51 0.00 2.79 2.71 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 0.00 195 S 7.92 4.37 0.00 3.87 3.77 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 0.00 196 G 8.86 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 0.00 197 G 8.01 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 0.00 0.00 0.00 198 P 0.00 4.84 0.00 1.79 0.92 0.00 3.85 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 1.97 1.58 0.00 199 L 9.21 5.10 0.00 1.29 1.54 0.14 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 9.21 5.44 0.00 3.22 3.20 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 0.00 201 S 9.30 4.40 0.00 3.77 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 0.00 202 G 8.68 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 *207 T 8.39 4.95 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 1.23 0.00 0.00 208 R 7.91 5.04 0.00 1.97 1.87 0.00 3.11 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 209 A 9.13 4.40 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 I 9.13 4.11 1.98 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 1.37 0.94 0.89 0.00 0.00 211 G 7.84 4.73 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 0.00 212 L 8.96 5.53 0.00 1.77 1.67 1.11 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 213 T 9.23 3.58 4.44 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 1.02 0.00 0.00 214 S 8.39 4.36 0.00 4.01 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 0.00 215 G 7.31 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 0.00 216 G 7.76 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 0.00 0.00 0.00 0.00 217 S 7.89 4.68 0.00 4.00 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 0.00 218 G 9.80 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 N 7.76 4.76 0.00 3.09 2.90 0.00 0.00 7.44 8.27 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 0.00 220 C 9.52 4.34 0.00 3.01 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 0.00 221 S 8.29 4.23 0.00 3.83 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 0.00 222 S 8.53 4.29 0.00 3.88 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 0.00 223 G 9.71 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 0.00 224 G 7.63 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 0.00 0.00 0.00 0.00 225 T 8.33 4.83 4.19 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 0.83 0.00 0.00 226 T 8.30 4.98 4.38 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 0.70 0.00 0.00 227 F 9.36 5.40 0.00 3.00 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 0.00 228 F 9.41 5.35 0.00 3.07 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 0.00 229 Q 9.30 4.72 0.00 2.37 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.84 2.61 0.00 230 P 0.00 4.84 0.00 2.27 2.02 0.00 3.79 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 231 V 8.79 3.82 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 0.74 0.00 0.00 0.86 0.00 0.00 232 T 7.85 3.78 4.19 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 1.17 0.00 0.00 233 E 7.79 3.85 0.00 2.22 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 0.00 2.32 2.51 0.00 234 A 7.39 2.71 0.92 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 0.00 235 L 7.83 3.88 0.00 1.76 1.80 0.81 0.51 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 235A S 7.90 3.95 0.00 3.98 3.74 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 0.00 236 A 7.36 3.84 0.83 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 0.00 237 Y 7.31 4.70 0.00 2.86 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 0.00 238 G 7.64 3.87 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 0.00 0.00 0.00 239 V 7.49 4.77 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.94 0.00 0.00 240 S 8.75 4.75 0.00 3.86 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 0.00 241 V 8.33 4.42 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.86 0.00 0.00 242 Y 7.69 4.41 0.00 3.10 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 * Residues marked with a * may have inaccurate shift predictions.