NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1353 8.0549 114.0477 61.4728 33.0313 174.3809 3 Y 4.4119 8.3281 119.8439 55.0165 39.6451 173.8438 4 P 4.3616 0.0000 0.0000 62.8681 32.9266 175.8137 5 I 4.3540 8.1713 123.7397 60.4047 38.0311 175.8790 6 R 4.1619 8.7613 125.6743 56.2966 30.6037 176.4611 7 L 4.6713 8.3895 122.7316 52.9978 44.4729 174.9956 8 Y 4.1244 8.1999 121.6740 59.6545 38.3715 176.0195 9 G 3.8238 8.4722 114.4520 45.8432 0.0000 173.6061 10 D 4.3818 8.2566 120.9555 53.2165 41.6696 175.2636 11 P 4.3329 0.0000 0.0000 65.3553 31.4945 178.6971 12 V 3.6345 8.1410 119.4493 64.7512 31.0652 177.9677 13 L 4.2266 8.0571 118.8315 56.2272 41.6196 178.1400 14 R 4.6203 7.7735 116.5922 55.8169 31.0628 175.9198 15 R 4.3784 7.2886 116.4990 55.2298 31.7320 176.0505 16 K 4.4533 8.3674 121.7584 55.1210 32.3752 176.1543 17 A 4.3487 8.4796 130.1203 51.6096 19.2803 176.9887 18 R 4.2761 8.6856 119.8036 54.8311 31.6502 174.6932 19 P 4.6851 0.0000 0.0000 62.8620 32.2392 176.2078 20 V 3.6417 8.7754 123.8428 62.6863 31.9403 175.2684 21 E 4.4091 8.6972 126.0918 57.2801 31.0609 175.5653 22 D 4.7428 7.7138 118.3084 52.8639 41.8137 175.6250 23 F 4.4119 8.7995 125.0242 57.4066 39.7281 177.7578 24 S 4.1474 8.5845 116.7660 61.0095 62.7477 175.6665 25 G 3.9960 7.8725 107.0103 45.2968 0.0000 175.2403 26 I 3.7001 7.7977 122.3038 64.0304 37.0207 178.0212 27 K 3.9244 8.0818 120.0846 59.6812 32.1856 178.7004 28 R 4.1125 7.9451 118.4346 59.1316 30.0201 177.9485 29 L 3.9948 8.0564 120.0723 58.2137 42.0637 178.8113 30 A 3.9782 8.4329 121.0794 55.2620 18.2635 179.4388 31 E 3.9908 8.3317 117.1013 59.7674 29.5235 179.3573 32 D 4.4979 8.1582 118.6875 57.3511 40.7919 178.7558 33 M 4.1210 8.3343 119.6849 58.3292 31.8889 178.6944 34 L 3.7512 8.2849 119.5241 57.7278 41.8212 179.1470 35 E 4.1822 8.4444 119.2216 59.6301 29.5430 178.9790 36 T 3.9273 8.1558 115.7347 66.8597 68.5663 176.2352 37 M 3.9881 8.2238 120.1704 58.6743 32.2609 178.2209 38 F 4.5577 8.3564 118.2446 60.8295 38.9298 177.3248 39 E 4.0694 8.3929 117.3435 58.8990 29.5204 177.7549 40 A 4.3598 7.9487 117.9833 51.2035 19.0812 176.9587 41 K 3.8841 8.0285 115.9988 57.5564 29.9871 176.0943 42 G 4.1364 8.4211 107.3420 44.6764 0.0000 174.5806 43 V 4.4752 8.1926 109.9088 61.1234 33.7650 175.8205 44 G 4.4430 7.8163 105.8762 45.2556 0.0000 172.4776 45 L 4.6561 8.7706 121.2001 54.0965 46.1704 174.0149 46 A 5.0093 9.0453 129.3431 50.3191 21.2872 177.3629 47 A 3.9042 8.9837 123.3373 55.0424 18.3611 178.7550 48 P 4.3670 0.0000 0.0000 65.1732 31.3653 178.5218 49 Q 4.1506 8.2211 116.3553 57.3869 28.2086 177.5264 50 I 4.4410 7.4150 112.7435 60.4539 37.7005 176.3092 51 G 3.8113 8.2804 107.4248 45.9003 0.0000 173.5066 52 L 4.5397 7.5077 119.5393 52.7673 43.9528 176.5624 53 S 4.7546 8.2983 121.9062 57.1511 60.4718 172.3707 54 Q 4.6578 7.5388 119.2201 53.8607 33.2032 177.1362 55 R 4.3877 8.6753 122.8978 54.8175 29.0299 174.1460 56 L 5.1707 7.6868 122.7978 53.4588 46.1928 174.1215 57 F 5.3948 9.0684 120.2783 55.5601 42.1293 173.5104 58 V 4.9976 8.8085 111.9732 59.9938 35.3486 174.6664 59 A 5.1575 8.5961 122.6685 51.3620 23.0489 175.7153 60 V 4.8726 8.6765 112.1537 59.6414 36.0799 174.9543 61 E 4.6491 9.0589 125.6418 54.9005 31.0523 174.5706 62 Y 4.6261 8.5945 125.3224 57.2564 39.0964 175.5596 *78 V 3.8846 8.0959 116.6819 61.5260 32.9942 175.1238 79 R 4.3108 9.1459 125.4249 57.9809 30.8078 176.5667 80 R 4.6213 7.5101 115.0952 54.2953 34.6147 174.0546 81 V 4.6760 8.1193 121.7371 61.2684 34.3278 174.1749 82 Y 4.8002 9.0564 124.3434 56.1004 41.8324 174.5459 83 V 4.5120 8.4992 123.2182 61.0755 34.4942 174.2559 84 V 4.1620 8.4784 128.3999 61.0572 33.8301 173.8423 85 A 5.0960 9.2373 130.5674 50.4864 21.8040 175.7839 86 N 4.2225 8.7008 117.6033 53.6635 36.8647 173.3303 87 P 4.8674 0.0000 0.0000 62.7570 32.9733 176.1813 88 V 4.4771 8.8317 120.0284 61.3003 34.8854 174.2236 89 I 4.5615 8.6492 129.4432 61.6436 37.1041 175.8569 90 T 4.5012 8.9057 117.6796 62.3327 70.0253 174.2679 91 Y 4.9911 7.6644 122.4245 56.7650 42.1497 173.0808 92 R 4.7335 7.5807 121.0527 54.8875 32.9847 173.5624 93 E 4.3912 8.7531 120.0271 56.0473 33.8767 175.7248 94 G 4.1203 10.4143 110.6541 45.4413 0.0000 171.9757 95 L 4.9001 7.7727 119.4746 54.0139 44.9379 174.6024 96 V 4.5265 8.9511 126.0665 61.2706 35.1646 173.7981 97 E 4.9764 8.8685 126.7305 55.7730 31.1863 175.3827 98 G 4.1611 8.6511 109.2077 45.8449 0.0000 171.7664 99 T 5.1055 8.4092 116.8342 63.0127 69.4543 174.8159 100 E 4.5735 9.2952 124.8934 54.2151 33.8894 174.6933 101 G 3.5352 8.2549 111.9654 45.1107 0.0000 174.3322 *103 L 4.3116 8.5141 120.4379 54.7243 43.6767 177.9155 104 S 4.3723 7.9085 113.0269 59.6562 64.0228 173.5467 105 L 4.4145 7.3481 119.7279 52.1296 41.8452 174.6902 106 P 4.4152 0.0000 0.0000 64.3885 31.9361 177.5338 107 G 4.1336 9.0506 111.3544 45.0323 0.0000 172.9452 108 L 4.7692 7.4078 119.3637 53.6937 43.1420 175.5377 109 Y 5.0632 8.5114 118.4459 56.6575 42.2629 174.3166 110 S 5.0081 8.8341 115.8332 56.9607 65.2609 174.3609 111 E 4.7207 8.8811 123.9564 56.6796 29.7563 175.8150 112 E 4.8474 7.9294 118.2877 55.9553 30.9686 176.0023 113 V 4.0036 8.1432 120.9903 61.9797 32.7230 173.1210 114 P 5.0884 0.0000 0.0000 62.7147 32.2964 175.6676 115 R 4.8099 9.2096 121.3448 53.8479 34.9535 174.4559 116 A 4.7313 8.6700 122.7927 52.0357 18.6553 177.7216 117 E 4.1476 8.9615 122.1727 58.5296 31.1871 176.9023 118 R 5.3119 7.8184 117.0612 54.2921 34.7153 174.5047 119 I 5.1468 8.8226 115.2306 59.2365 41.8799 173.7365 120 R 5.2038 9.0591 123.0548 54.5981 33.1779 174.3490 121 V 4.9816 9.0642 125.5744 61.2739 34.9442 173.7084 122 E 5.2767 9.1604 127.5586 55.2906 31.9439 174.7250 123 Y 5.2364 8.3744 120.7363 56.6778 42.2646 172.8384 124 Q 5.0484 9.2837 118.4182 54.1408 32.1546 176.6802 125 D 5.0622 8.7318 122.0324 51.7656 41.3622 176.5919 126 E 4.1332 8.7483 115.9033 58.9949 29.6302 177.1572 127 E 4.3035 8.3849 117.4985 56.0153 29.8402 176.6828 128 G 2.3699 7.7195 107.4028 44.7352 0.0000 173.6159 129 R 4.1229 7.9102 119.7698 54.7783 31.4119 176.4173 130 G 3.8908 8.5192 111.4764 46.5980 0.0000 172.8210 131 R 4.7126 8.9050 122.2125 54.1814 35.0482 174.2095 132 V 4.9502 8.1268 119.6766 61.2177 34.6140 174.4233 133 L 4.9355 9.1687 128.2285 53.4997 45.9172 174.4285 134 E 5.2496 8.8567 123.9385 54.6595 32.1077 175.2382 135 L 4.9821 8.6921 122.5867 53.0102 46.2690 175.1695 136 E 5.0101 8.3163 117.7362 54.3733 33.1329 177.7929 137 G 3.6876 9.0229 109.4623 46.6120 0.0000 175.5212 138 Y 4.0829 8.8640 121.1660 61.1451 38.5504 177.9463 139 M 4.0142 8.1835 118.6671 58.0578 32.0451 178.3485 140 A 3.8344 7.8861 120.7220 55.0762 18.5138 179.4917 141 R 3.7310 7.8213 117.1329 59.4087 30.1037 178.9079 142 V 3.3458 7.4882 117.9657 66.0048 31.4767 178.0007 143 F 3.7254 8.4640 117.6355 60.5681 38.7094 177.6624 144 Q 3.9402 8.2169 117.6851 59.0740 28.2559 178.3628 145 H 3.9174 7.9616 118.1507 59.2985 30.0931 176.8980 146 E 3.7913 7.8656 120.3263 59.3227 29.0711 179.4195 147 I 3.6474 7.5889 120.1751 64.3851 37.0210 178.0644 148 D 4.2875 8.0495 119.7566 57.7977 40.7215 178.5652 149 H 4.0902 7.6779 116.3934 58.9020 28.6537 177.6176 150 L 4.1921 8.0029 120.0825 56.5452 41.1794 178.0047 151 D 4.8113 7.6970 116.7348 53.6436 41.2059 176.7557 152 G 4.2225 7.7966 105.8330 47.2972 0.0000 173.4461 153 I 4.4009 7.7391 120.2127 59.1878 38.8951 175.3898 154 L 4.5131 8.4994 125.1459 52.3820 44.3103 177.6060 155 F 4.1196 8.3246 116.2864 60.0613 37.7781 177.5364 156 F 3.8622 6.2240 114.1394 59.1036 37.3194 177.0751 157 E 3.9633 7.0048 118.5863 58.8933 29.2467 177.9978 158 R 4.1284 7.4713 115.8828 57.1732 30.6045 176.9599 159 L 4.2553 7.3126 118.4524 53.3474 42.4096 175.8098 160 P 4.4300 0.0000 0.0000 62.3769 33.1942 177.1481 161 K 3.8189 8.7316 120.9463 59.4896 31.9962 176.9619 162 P 4.2512 0.0000 0.0000 66.1806 31.0546 178.4506 163 K 4.0755 8.0115 117.8607 58.8400 32.0629 179.2158 164 R 3.9766 8.4515 119.5825 59.4179 29.9221 178.5165 165 E 3.9681 8.6208 118.5326 59.3907 29.4913 179.1500 166 A 3.9825 8.1940 120.8613 54.9589 18.4905 179.5207 167 F 4.0126 8.3898 119.1374 61.5992 39.3291 177.5146 168 L 3.7826 7.9547 117.2213 57.3395 41.6637 178.8535 169 E 3.9665 8.3920 119.3933 59.3919 29.4402 178.9007 170 A 4.0126 7.8480 119.1443 54.1434 18.5611 178.3263 171 N 5.3617 7.2882 114.7277 52.2182 39.3919 176.7872 172 R 3.6803 7.4977 122.3618 59.7817 30.0393 178.3928 173 A 3.9345 7.7326 119.7595 54.9146 18.4409 179.2163 174 E 3.4632 7.7984 116.6691 59.4463 29.5583 179.4608 175 L 3.8622 7.4876 118.8976 57.5075 41.6326 179.4887 176 V 3.6240 7.5268 117.9066 66.3118 31.3415 178.3799 177 R 3.9243 7.9740 117.5979 59.1783 29.8095 179.0031 178 F 4.5869 8.0145 117.6537 61.0264 38.8483 177.8284 179 Q 4.2462 8.4969 117.5448 58.7683 28.2123 179.0747 180 K 4.0161 8.0277 118.9750 59.4883 32.2247 178.6976 181 E 4.0979 8.3252 118.2694 59.1956 29.6552 178.3438 182 A 4.1948 8.3585 119.8476 54.0957 18.6069 178.0398 183 R 4.2398 7.5125 121.1252 56.4913 30.4550 176.1587 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 V 8.05 4.14 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 1.03 0.00 0.00 0.94 0.00 0.00 3 Y 8.33 4.41 0.00 2.96 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 4 P 0.00 4.36 0.00 2.09 2.03 0.00 3.84 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 2.07 2.14 0.00 5 I 8.17 4.35 1.88 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 1.42 0.53 0.94 0.00 0.00 6 R 8.76 4.16 0.00 1.62 1.84 0.00 3.51 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 7 L 8.39 4.67 0.00 1.61 1.49 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 8 Y 8.20 4.12 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 9 G 8.47 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 0.00 0.00 0.00 10 D 8.26 4.38 0.00 2.73 2.52 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 0.00 0.00 0.00 0.00 11 P 0.00 4.33 0.00 2.26 2.25 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 12 V 8.14 3.63 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.89 0.00 0.00 13 L 8.06 4.23 0.00 1.78 1.75 1.02 0.86 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 14 R 7.77 4.62 0.00 1.85 1.87 0.00 3.18 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 15 R 7.29 4.38 0.00 1.74 1.84 0.00 3.12 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 1.62 1.69 0.00 16 K 8.37 4.45 0.00 1.74 1.72 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.42 7.81 17 A 8.48 4.35 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.69 4.28 0.00 1.79 1.82 0.00 3.29 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 19 P 0.00 4.69 0.00 2.09 2.02 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 20 V 8.78 3.64 1.77 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 -0.39 0.00 0.00 0.82 0.00 0.00 21 E 8.70 4.41 0.00 1.95 1.98 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 2.20 2.20 0.00 22 D 7.71 4.74 0.00 2.60 2.51 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 23 F 8.80 4.41 0.00 3.11 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.58 4.15 0.00 4.00 4.08 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 25 G 7.87 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 0.00 0.00 0.00 26 I 7.80 3.70 2.28 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.53 0.97 0.00 0.00 27 K 8.08 3.92 0.00 1.86 1.84 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.54 7.81 28 R 7.95 4.11 0.00 1.99 1.94 0.00 3.51 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 29 L 8.06 3.99 0.00 1.82 1.79 0.84 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.43 3.98 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 31 E 8.33 3.99 0.00 2.24 2.07 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 2.38 2.51 0.00 32 D 8.16 4.50 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 33 M 8.33 4.12 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.47 0.00 34 L 8.28 3.75 0.00 1.89 1.73 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.44 4.18 0.00 2.23 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 0.00 2.40 2.46 0.00 36 T 8.16 3.93 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 1.35 0.00 0.00 37 M 8.22 3.99 0.00 1.89 1.99 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.56 0.00 38 F 8.36 4.56 0.00 3.38 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 39 E 8.39 4.07 0.00 2.12 2.06 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 2.38 2.39 0.00 40 A 7.95 4.36 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 41 K 8.03 3.88 0.00 2.02 2.00 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.57 7.81 42 G 8.42 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 43 V 8.19 4.48 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 1.14 0.00 0.00 1.03 0.00 0.00 44 G 7.82 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 0.00 0.00 0.00 0.00 45 L 8.77 4.66 0.00 1.72 1.44 0.93 0.95 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 46 A 9.05 5.01 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 47 A 8.98 3.90 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 48 P 0.00 4.37 0.00 2.09 2.24 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 49 Q 8.22 4.15 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.83 0.00 0.00 0.00 0.00 0.00 2.21 2.09 0.00 50 I 7.41 4.44 1.42 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.47 0.86 0.00 0.00 51 G 8.28 3.81 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 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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 1.00 0.00 0.00 0.46 0.00 0.00 143 F 8.46 3.73 0.00 3.16 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 0.00 144 Q 8.22 3.94 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 145 H 7.96 3.92 0.00 3.06 3.36 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 7.87 3.79 0.00 1.16 1.12 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 2.05 1.87 0.00 147 I 7.59 3.65 1.83 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.59 0.91 0.00 0.00 148 D 8.05 4.29 0.00 2.82 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 0.00 149 H 7.68 4.09 0.00 3.25 3.24 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 0.00 150 L 8.00 4.19 0.00 1.82 1.72 1.04 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 151 D 7.70 4.81 0.00 2.70 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 0.00 152 G 7.80 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 0.00 153 I 7.74 4.40 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 1.20 0.75 0.73 0.00 0.00 154 L 8.50 4.51 0.00 0.78 1.11 1.13 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 155 F 8.32 4.12 0.00 3.26 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 0.00 156 F 6.22 3.86 0.00 2.44 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 0.00 157 E 7.00 3.96 0.00 1.81 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.54 0.00 158 R 7.47 4.13 0.00 1.96 1.94 0.00 3.27 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 159 L 7.31 4.26 0.00 1.81 1.62 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 160 P 0.00 4.43 0.00 2.27 2.19 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 161 K 8.73 3.82 0.00 1.85 1.89 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.58 1.55 7.81 162 P 0.00 4.25 0.00 2.32 2.32 0.00 3.66 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 163 K 8.01 4.08 0.00 2.02 1.95 0.00 1.70 0.00 0.00 1.91 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.57 1.52 7.81 164 R 8.45 3.98 0.00 2.05 2.12 0.00 3.25 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.93 0.00 165 E 8.62 3.97 0.00 2.26 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 166 A 8.19 3.98 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 0.00 167 F 8.39 4.01 0.00 3.23 3.14 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 0.00 168 L 7.95 3.78 0.00 1.62 1.60 0.92 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 169 E 8.39 3.97 0.00 2.03 2.06 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 2.28 2.32 0.00 170 A 7.85 4.01 1.25 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 0.00 0.00 171 N 7.29 5.36 0.00 2.17 2.31 0.00 0.00 6.49 7.38 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 0.00 172 R 7.50 3.68 0.00 1.86 1.83 0.00 3.04 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 173 A 7.73 3.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 E 7.80 3.46 0.00 1.85 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 175 L 7.49 3.86 0.00 1.69 1.62 0.50 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 176 V 7.53 3.62 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 1.01 0.00 0.00 0.94 0.00 0.00 177 R 7.97 3.92 0.00 1.76 1.90 0.00 3.30 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 178 F 8.01 4.59 0.00 3.42 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 0.00 179 Q 8.50 4.25 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.92 0.00 180 K 8.03 4.02 0.00 1.95 1.90 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.60 7.81 181 E 8.33 4.10 0.00 2.17 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 0.00 2.38 2.39 0.00 182 A 8.36 4.19 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 0.00 183 R 7.51 4.24 0.00 1.94 1.86 0.00 3.20 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 * Residues marked with a * may have inaccurate shift predictions.