NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 Q 4.2901 8.3449 118.8246 55.7468 29.9410 174.2378 7 E 4.1075 8.4682 119.1457 53.2987 30.2557 174.5045 8 P 4.5081 0.0000 0.0000 61.6413 33.5234 175.4130 9 K 3.9820 8.4768 121.7218 56.3402 32.5161 177.3029 10 V 4.2100 8.0746 126.3064 60.9979 32.3214 175.6521 11 V 3.7530 8.1878 126.2345 65.5073 31.3874 177.5778 12 G 3.6996 8.1189 104.3535 47.2317 0.0000 175.0306 13 V 3.9336 7.5420 119.7107 65.2471 31.9291 177.5014 14 E 4.1102 8.0741 118.6779 59.5890 29.1546 179.4617 15 I 3.7257 7.5548 111.5222 63.8667 37.8124 178.0170 16 L 4.1450 7.8084 120.4017 57.6825 41.6384 178.8578 17 E 3.9972 8.1734 118.5557 59.3977 29.1529 179.4955 18 K 3.9324 8.0124 117.6076 59.4931 32.1809 178.8367 19 S 4.3823 7.7085 112.9633 58.9911 62.8624 175.1311 20 G 3.8433 7.9191 109.9345 45.4787 0.0000 173.1073 21 L 4.0050 7.6426 121.3301 54.1979 42.7464 176.5583 22 D 4.5332 8.5849 125.4068 53.9502 41.5274 176.5961 23 I 3.8387 8.1966 129.4580 63.9515 37.3714 178.1448 24 K 3.9138 8.0385 120.1625 59.4002 32.2248 178.6517 25 K 3.9523 7.9764 119.3115 59.1659 32.0059 178.6238 26 L 3.9264 7.9573 120.7147 58.2286 42.0161 179.0474 27 V 3.5497 8.1406 118.6266 66.0409 31.5190 177.3553 28 D 4.2776 8.0937 117.7242 57.3636 41.0481 178.5096 29 K 3.9534 7.9575 118.5726 59.3102 31.9943 179.3230 30 L 4.0120 8.2264 119.6763 57.8100 41.4733 179.7847 31 V 3.6087 8.0406 118.3600 66.0067 31.3990 178.3044 32 K 4.0407 7.9385 117.6095 59.2410 31.4279 179.3432 33 A 3.5789 7.9073 121.1095 55.3921 18.0444 179.9307 34 T 4.2252 8.4556 114.4850 66.5973 68.4595 176.9021 35 A 4.1469 8.4918 123.0480 55.2057 18.4465 179.5363 36 A 4.2156 7.9748 120.0662 54.7234 18.4267 179.5981 37 E 4.0687 8.1082 116.9324 59.6282 29.1075 179.3039 38 F 3.8140 8.2567 121.1456 61.2181 39.2472 177.3924 39 T 3.9804 8.1911 109.6940 64.8369 68.7145 176.6623 40 T 3.7539 8.0319 118.6709 66.7771 68.2679 175.5497 41 Y 4.2572 7.5698 119.6652 60.8650 38.3893 177.5789 42 Y 3.6882 7.2375 119.0200 60.8161 38.9707 177.2460 43 Y 4.1397 8.2877 118.0720 61.2478 37.9344 177.9078 44 Y 4.2060 8.9102 117.9437 60.8898 37.6215 178.5629 45 T 3.7554 7.1670 115.3941 66.7184 68.6317 176.1786 46 I 3.7083 7.2633 119.4363 64.3591 37.2743 178.0127 47 L 4.0922 7.7123 118.5269 57.5019 41.8786 180.7312 48 R 4.0568 8.0464 118.6670 56.5177 29.8627 177.2812 *50 H 4.4430 8.0536 112.0630 54.7569 30.6265 174.8073 51 L 4.3842 7.6419 121.4825 53.7324 39.6860 175.6651 52 T 4.6110 7.8095 113.1773 60.3498 73.5144 177.5940 53 G 3.8812 8.2463 114.1397 47.0414 0.0000 174.9903 *55 E 4.2613 9.3131 120.5276 56.0281 31.2453 177.4206 56 G 3.8599 7.7292 103.3063 45.4571 0.0000 175.1920 57 E 4.0294 7.7483 121.7571 59.5249 29.5324 178.9572 58 G 3.7289 7.9562 102.7570 46.9348 0.0000 174.9769 59 L 4.2413 7.7238 120.8088 57.0065 41.5897 179.1645 60 K 3.9147 7.6760 118.1563 59.6228 32.0743 179.0477 61 E 4.0043 8.1167 117.0081 59.3022 29.5153 179.0824 62 I 3.4646 7.6597 120.3294 64.0960 37.2896 178.0132 63 A 4.3681 8.1633 121.6269 54.8942 18.1036 179.3780 64 E 3.9470 8.5530 118.4625 59.6377 29.7860 178.6537 65 D 4.4344 8.2841 118.7004 57.4385 40.8144 178.7720 66 A 3.9316 8.2323 120.7500 55.0950 18.4777 179.4801 67 R 3.9964 8.3596 117.1987 59.9300 30.3632 178.8009 68 L 4.0895 8.2766 118.7053 57.8428 41.5886 179.4305 69 E 4.0020 8.3854 118.6845 59.4624 29.4593 179.1339 70 D 4.3461 8.5216 119.3546 57.0995 40.9193 178.7279 71 R 3.8384 8.0728 119.4776 59.3757 29.9611 178.6168 72 L 4.0979 7.8661 118.3071 57.7451 41.3235 179.1106 73 H 4.1805 7.8698 115.9217 58.6537 28.6807 177.1365 74 F 4.4891 8.0766 121.2457 61.5550 39.1382 176.6857 75 E 3.8949 8.2227 117.9179 59.1389 28.8291 178.8312 76 L 4.0543 7.8575 116.5281 56.8994 41.6317 178.2360 *78 T 4.0659 7.7068 115.1522 63.9933 70.6234 175.6654 79 Q 3.9986 7.6708 120.5555 59.4925 29.0238 178.7036 80 R 3.9475 7.5848 119.1133 59.3389 30.0147 178.4499 81 I 3.6608 7.7660 119.2977 64.7047 37.1487 177.8317 82 Y 4.2301 7.8195 118.8832 60.2733 37.4738 177.9640 83 E 4.0752 8.1392 119.0281 59.0878 29.6422 178.4349 84 L 4.3968 7.7010 116.1469 54.6312 41.9206 177.6340 85 G 3.8218 7.9429 107.5696 45.5172 0.0000 173.8591 86 G 3.8921 7.8476 110.1729 44.0468 0.0000 173.0153 87 G 3.2577 7.5585 106.3114 43.7039 0.0000 172.6798 88 L 4.2631 8.0244 119.8212 53.2084 42.3151 175.8730 89 P 4.3221 0.0000 0.0000 62.6809 31.9583 176.5925 90 R 3.9918 8.8163 122.9449 59.2436 30.1633 176.6141 91 D 4.8474 7.8981 116.0432 52.7486 44.1066 176.9773 92 I 3.6482 8.1366 124.8064 64.0348 38.0888 178.5424 93 R 3.9828 8.9495 119.6672 59.0184 29.8472 178.8104 94 Q 3.9693 8.0428 117.5305 58.8370 28.2442 178.2973 95 L 3.9189 7.6242 121.0740 58.2773 41.8445 178.8915 96 A 4.0861 7.6087 118.5699 55.4898 18.4166 179.1027 97 D 4.4892 8.0093 116.4785 56.8757 41.0059 178.0809 98 I 4.1147 7.6381 110.8081 59.8305 38.4793 175.9176 99 S 4.1356 7.1719 114.5075 58.9390 62.5856 174.2952 100 A 4.0504 8.8134 130.5180 54.4596 18.3721 177.3786 101 C 4.8234 7.3103 111.8581 57.4914 30.7936 173.8946 102 S 4.1759 8.2716 116.2844 57.9337 62.6329 173.8119 103 D 3.8045 8.2079 125.8814 54.4643 41.1881 177.7015 104 A 4.1208 7.1585 129.5141 50.9903 17.2167 176.6061 105 Y 4.3195 6.7732 119.3055 56.5883 39.2119 176.5376 106 L 3.9540 8.5050 125.2066 54.5001 42.4807 175.3323 107 P 4.6078 0.0000 0.0000 62.2282 32.3940 176.2111 108 E 4.0553 8.7914 119.2227 59.1849 30.2667 177.1817 109 N 4.6083 7.7909 118.6228 52.1292 37.7770 175.6594 110 W 4.3108 7.6065 116.1286 59.0136 29.1524 178.3972 111 K 3.5533 6.9159 117.7684 58.4920 31.7855 176.2538 112 D 4.5100 7.6940 120.0274 52.5539 40.9881 175.0780 113 P 4.4043 0.0000 0.0000 65.6306 31.2947 178.4389 114 K 3.9409 8.2248 118.1591 59.2700 31.7205 178.8276 115 E 3.9808 8.1526 119.1497 59.3489 29.3290 179.4090 116 I 3.7063 7.6654 119.3972 64.3558 37.2081 178.2840 117 L 3.7408 8.0114 119.8666 57.5233 41.3623 179.7062 118 K 3.9112 8.0767 118.4832 59.4423 32.0091 179.5273 119 V 3.5249 7.3946 118.3265 65.8533 31.4717 177.9395 120 L 3.5334 7.6163 118.7184 57.5392 41.2149 179.2578 121 L 4.1202 7.8984 120.3822 58.3888 42.0619 178.8746 122 E 3.9751 8.3734 118.2666 59.2707 29.3436 179.2281 123 A 4.0423 8.1082 120.8299 55.2937 18.4524 179.5689 124 E 4.1027 8.5177 117.0959 59.8036 29.6046 179.6280 125 Q 4.0391 8.5291 118.3948 59.0120 28.6412 178.5152 126 C 4.0994 8.2141 119.5950 62.4011 31.5586 175.4087 127 A 3.9609 8.0809 122.4232 55.1327 17.9013 179.6157 128 I 3.7320 8.0732 118.3506 64.8051 37.3417 178.7921 129 R 3.9338 7.8131 118.2603 59.5472 29.5734 179.3722 130 T 3.6857 8.0408 115.5362 66.5524 68.4976 176.8978 131 W 4.4342 8.3088 120.8470 59.2123 29.0762 178.6889 132 K 4.0455 8.4225 120.2027 59.2525 31.3537 178.4681 133 E 3.9253 7.8644 118.5198 59.2795 29.6673 178.5941 134 V 3.8093 7.3428 116.8208 66.2503 31.9002 177.3841 135 C 4.5843 8.3116 116.4456 62.9467 27.7252 176.3976 136 D 4.5501 7.8528 116.4838 55.2221 40.0299 177.5453 *138 T 4.3049 7.9063 111.0723 61.1917 70.6961 172.7710 139 Y 3.8453 8.0484 123.8639 59.2940 38.7320 176.1242 140 G 3.5107 8.5752 114.5606 45.6092 0.0000 173.2665 141 K 4.3542 7.7809 116.4864 57.1477 35.7879 176.2229 142 D 4.7551 8.1843 119.4577 50.4292 41.4513 173.5018 143 P 4.3045 0.0000 0.0000 65.1158 31.5986 177.7482 144 R 3.8830 7.9239 116.7199 59.9448 30.1371 178.5936 145 T 3.9202 8.0956 115.1636 66.5646 68.4025 176.1197 146 Y 4.0868 8.2817 122.9897 60.1904 38.9193 177.5298 147 D 4.2612 8.3599 118.9427 57.3615 41.3184 178.3262 148 L 3.8137 7.8124 118.9719 57.7002 41.6379 179.2994 149 A 3.5529 7.9725 120.8467 55.0237 18.2634 179.3040 150 Q 3.6208 8.0807 118.2493 59.3071 28.8657 178.8294 151 R 3.7675 7.7310 118.8251 59.2341 30.0920 179.1359 152 I 3.1574 7.2243 119.2934 64.0566 36.9336 177.9159 153 L 3.8589 7.7167 121.5423 58.4145 41.6845 178.6524 154 Q 3.8578 7.9974 119.1599 59.5557 28.8518 178.5515 155 E 4.0057 7.6552 119.2791 59.1183 29.3668 179.1557 156 E 3.8266 8.1198 118.9020 59.2332 29.5060 179.2611 157 I 3.6359 7.8080 119.9909 64.3989 37.1669 178.3320 158 E 3.6557 7.5834 118.9657 59.4926 29.3424 179.1210 159 H 2.8855 7.6427 116.4327 58.4116 28.6592 177.3700 160 E 4.0909 8.3703 121.1969 59.4134 29.5188 178.7651 161 A 4.0187 7.8153 120.6528 54.7641 18.2724 179.6770 162 W 4.2573 7.8884 117.4994 60.2132 29.0765 178.8373 163 F 4.6704 7.8365 117.1370 60.4343 38.3500 177.8847 164 L 4.3379 8.5306 119.2047 57.9086 41.1797 179.1662 165 E 4.5221 8.0457 119.6595 58.5134 29.6187 178.7050 166 L 4.1970 7.7156 118.1901 57.6905 41.9352 179.0847 167 L 3.9590 8.1561 117.6775 57.2355 41.8849 177.0209 168 Y 4.6743 7.6360 113.8870 56.4417 40.2480 175.3085 169 G 4.0449 8.4777 107.4355 45.9290 0.0000 174.1071 170 R 4.3366 8.0149 121.4538 53.5560 30.4863 173.7462 171 P 4.6761 0.0000 0.0000 63.4936 32.1044 174.4870 172 S 4.7976 8.2835 116.3407 58.4586 70.0800 176.6480 173 G 4.2228 6.0998 112.6547 44.1641 0.0000 172.1404 174 H 4.2778 8.8994 124.9213 56.2450 29.9646 172.6035 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 6 Q 8.34 4.29 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 7 E 8.47 4.11 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 8 P 0.00 4.51 0.00 2.18 2.04 0.00 3.77 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 1.98 1.95 0.00 9 K 8.48 3.98 0.00 1.74 1.77 0.00 1.72 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.42 1.56 7.81 10 V 8.07 4.21 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 1.03 0.00 0.00 0.99 0.00 0.00 11 V 8.19 3.75 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 0.99 0.00 0.00 0.93 0.00 0.00 12 G 8.12 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.54 3.93 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 1.10 0.00 0.00 0.93 0.00 0.00 14 E 8.07 4.11 0.00 2.22 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 2.33 2.51 0.00 15 I 7.55 3.73 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 1.74 0.52 0.90 0.00 0.00 16 L 7.81 4.14 0.00 1.99 1.75 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.17 4.00 0.00 2.18 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 2.33 2.53 0.00 18 K 8.01 3.93 0.00 1.88 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.48 7.81 19 S 7.71 4.38 0.00 3.95 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 20 G 7.92 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 21 L 7.64 4.01 0.00 1.60 1.75 0.94 1.25 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 22 D 8.58 4.53 0.00 2.75 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 8.20 3.84 1.87 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 1.53 0.63 0.91 0.00 0.00 24 K 8.04 3.91 0.00 1.81 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.48 7.81 25 K 7.98 3.95 0.00 1.88 1.93 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.43 7.81 26 L 7.96 3.93 0.00 1.90 1.81 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.14 3.55 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.91 0.00 0.00 28 D 8.09 4.28 0.00 2.92 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 29 K 7.96 3.95 0.00 1.99 1.77 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.60 7.81 30 L 8.23 4.01 0.00 1.99 1.76 1.05 0.90 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 31 V 8.04 3.61 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 1.10 0.00 0.00 0.93 0.00 0.00 32 K 7.94 4.04 0.00 1.91 1.81 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.63 1.54 7.81 33 A 7.91 3.58 0.26 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 34 T 8.46 4.23 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 1.44 0.00 0.00 35 A 8.49 4.15 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 36 A 7.97 4.22 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 37 E 8.11 4.07 0.00 2.55 2.48 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 2.97 2.92 0.00 38 F 8.26 3.81 0.00 2.59 3.08 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 39 T 8.19 3.98 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 40 T 8.03 3.75 4.35 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 0.20 0.00 0.00 41 Y 7.57 4.26 0.00 2.69 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Y 7.24 3.69 0.00 2.70 2.61 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 43 Y 8.29 4.14 0.00 3.19 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 44 Y 8.91 4.21 0.00 3.04 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 45 T 7.17 3.76 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 1.01 0.00 0.00 46 I 7.26 3.71 1.89 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.77 0.00 0.00 47 L 7.71 4.09 0.00 1.47 1.57 0.76 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.05 4.06 0.00 2.00 2.02 0.00 3.13 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 *50 H 8.05 4.44 0.00 2.96 2.98 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.64 4.38 0.00 1.83 1.83 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.81 4.61 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 1.29 0.00 0.00 53 G 8.25 3.88 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 0.00 *55 E 9.31 4.26 0.00 2.00 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 2.20 2.31 0.00 56 G 7.73 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 0.00 0.00 0.00 57 E 7.75 4.03 0.00 2.40 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 0.00 2.31 2.38 0.00 58 G 7.96 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0.00 0.00 0.00 2.32 2.32 0.00 134 V 7.34 3.81 2.50 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 1.09 0.00 0.00 0.99 0.00 0.00 135 C 8.31 4.58 0.00 3.32 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 0.00 136 D 7.85 4.55 0.00 2.89 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 *138 T 7.91 4.30 4.58 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 1.36 0.00 0.00 139 Y 8.05 3.85 0.00 2.98 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 0.00 140 G 8.58 3.51 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 0.00 141 K 7.78 4.35 0.00 1.67 1.76 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.27 1.47 7.81 142 D 8.18 4.76 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.30 0.00 2.21 2.11 0.00 3.66 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 2.11 2.13 0.00 144 R 7.92 3.88 0.00 1.94 1.94 0.00 3.23 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 145 T 8.10 3.92 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 1.29 0.00 0.00 146 Y 8.28 4.09 0.00 3.20 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 0.00 147 D 8.36 4.26 0.00 3.02 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.81 3.81 0.00 1.67 1.55 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 149 A 7.97 3.55 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 0.00 150 Q 8.08 3.62 0.00 1.23 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.74 0.00 0.00 0.00 0.00 0.00 2.20 2.43 0.00 151 R 7.73 3.77 0.00 1.99 1.81 0.00 3.10 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 152 I 7.22 3.16 0.86 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.30 -0.45 0.00 0.00 153 L 7.72 3.86 0.00 1.80 1.74 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 154 Q 8.00 3.86 0.00 2.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 155 E 7.66 4.01 0.00 2.02 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 2.42 2.41 0.00 156 E 8.12 3.83 0.00 2.09 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 0.00 2.41 2.73 0.00 157 I 7.81 3.64 1.97 0.00 0.00 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 1.49 0.86 0.86 0.00 0.00 158 E 7.58 3.66 0.00 1.71 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 159 H 7.64 2.89 0.00 3.25 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.37 4.09 0.00 2.15 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 0.00 2.41 2.43 0.00 161 A 7.82 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 0.00 162 W 7.89 4.26 0.00 2.90 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 0.00 163 F 7.84 4.67 0.00 3.23 3.05 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 0.00 164 L 8.53 4.34 0.00 2.00 1.86 1.03 1.18 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 0.00 165 E 8.05 4.52 0.00 2.26 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 2.37 2.35 0.00 166 L 7.72 4.20 0.00 1.90 1.78 1.10 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 167 L 8.16 3.96 0.00 1.68 0.84 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 168 Y 7.64 4.67 0.00 3.12 2.94 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 0.00 169 G 8.48 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 0.00 170 R 8.01 4.34 0.00 1.92 1.92 0.00 3.17 0.00 0.00 3.41 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 171 P 0.00 4.68 0.00 2.24 2.08 0.00 3.89 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 2.01 1.99 0.00 172 S 8.28 4.80 0.00 4.04 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 G 6.10 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 0.00 174 H 8.90 4.28 0.00 3.08 3.06 0.00 5.77 0.00 0.00 0.00 0.00 6.91 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.