NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 G 4.0666 8.3393 109.7516 45.6142 0.0000 172.7697 12 S 4.5650 7.4900 112.6902 54.9425 65.8951 172.9042 13 L 2.6227 8.7090 124.7651 54.0433 43.0334 176.4334 14 P 4.3784 0.0000 0.0000 61.1412 32.3113 174.1985 15 P 4.2345 0.0000 0.0000 62.9923 31.4994 178.3014 16 R 4.0722 8.4360 121.4840 58.5121 30.2403 177.8001 17 E 3.9162 7.9909 117.6201 58.5158 30.0752 177.0666 18 D 4.6043 7.8354 119.6076 52.7061 38.9819 176.1137 19 A 3.9841 7.9838 125.8910 54.2765 18.8430 178.9476 20 A 3.9856 7.9340 118.9773 55.4956 18.5302 179.8690 21 R 3.8295 8.2382 116.4957 59.4006 30.1301 179.4176 22 V 3.6118 7.9564 117.7861 65.9682 31.4093 177.9040 23 A 4.0801 8.4087 120.7597 55.3598 18.3008 179.8583 24 R 3.7218 8.1250 116.6038 59.0723 29.9733 178.8105 25 F 3.9762 8.6150 120.9747 61.3809 39.0380 177.1419 26 V 3.4193 8.0464 117.5284 66.4018 31.0770 177.8560 27 T 3.8721 7.8205 113.8821 67.1282 68.4417 175.6807 28 H 4.6890 7.8027 119.6914 58.7906 30.0155 177.2171 29 V 3.5796 7.3874 111.9226 61.6560 31.6677 176.3392 30 S 4.3105 6.9688 115.8248 57.8351 63.5194 173.9424 31 D 4.7697 8.5166 124.0101 54.7712 41.5075 175.4582 32 W 5.6870 7.4301 114.6601 56.0863 31.4456 173.0734 33 G 4.1540 9.5024 106.4397 45.7820 0.0000 171.3415 34 A 5.3503 8.7734 121.6670 50.1277 21.1306 175.6002 35 L 5.0161 9.0865 125.5851 53.4765 44.5285 174.8285 36 A 5.1435 9.1718 128.7689 50.7247 21.2992 175.8732 37 T 5.1417 9.0028 111.8699 60.0641 73.2994 172.4514 38 I 4.8026 8.1997 122.0579 59.7747 38.6158 176.0794 39 S 4.3862 9.3363 123.3261 58.3571 63.2673 174.4199 40 T 4.4228 8.6532 115.9006 61.1154 69.2875 174.5088 41 L 4.0097 7.5018 123.6828 54.7077 42.1979 177.2079 42 E 3.8257 9.1300 124.8015 59.4151 29.5222 178.0332 43 A 4.1944 8.0186 119.3752 54.9306 18.6978 178.0617 44 V 4.5341 7.8938 108.4741 60.7768 33.2828 175.2542 45 R 4.2546 8.1242 120.0949 58.0670 30.2070 176.5012 46 G 4.0467 9.1107 114.4709 45.2209 0.0000 173.9913 47 R 4.3457 7.8782 119.4409 55.1280 31.3539 174.4863 48 P 4.8896 0.0000 0.0000 63.0019 32.1813 175.2812 49 F 5.0858 9.6141 125.0419 56.3438 42.7000 173.4171 50 A 5.1702 7.2444 124.9073 49.5212 22.1520 174.5747 51 D 4.3780 8.1834 116.2810 53.4669 44.9161 174.2875 52 V 4.8373 8.3964 123.6740 61.6632 32.6793 174.8985 53 L 5.0687 8.9598 127.8298 52.8598 45.0607 176.5337 54 S 5.1675 8.9873 118.6502 58.9833 63.7222 173.1144 55 L 5.1093 8.7813 121.8939 55.4797 44.0023 174.6284 56 S 4.7169 8.4886 112.3135 57.1544 65.7578 173.7454 57 D 5.4328 9.8064 124.5003 51.3600 40.5769 175.3630 58 G 4.8327 7.6533 106.0488 43.4594 0.0000 171.2802 59 P 4.5319 0.0000 0.0000 61.2526 32.7679 175.1224 60 P 5.0620 0.0000 0.0000 60.6011 28.4017 175.9212 61 G 3.9636 7.0205 113.5748 45.5304 0.0000 171.2660 62 A 4.5765 7.8134 124.6234 50.6147 19.2914 177.4484 63 G 3.7254 7.9596 110.9310 46.4022 0.0000 174.4273 64 S 4.3532 9.0372 120.7189 58.1581 63.7368 175.5283 65 G 3.7989 8.7231 110.1953 45.2235 0.0000 173.5304 66 V 4.1554 7.4994 120.8425 60.7352 32.8200 173.3643 67 P 4.3962 0.0000 0.0000 62.5431 32.1241 174.9948 68 Y 4.9248 8.3147 123.0604 56.6444 40.1884 175.0597 69 F 5.3792 9.2927 120.3950 55.9545 43.7071 173.4731 70 Y 5.3323 9.0645 122.0962 56.2824 40.3442 174.5975 71 L 5.2774 8.5696 126.4836 52.9070 46.1449 175.6010 72 S 4.6239 9.0934 115.4512 55.6530 64.8872 173.3706 73 P 4.3621 0.0000 0.0000 65.5278 31.2556 177.7881 74 L 4.0219 7.4441 117.0667 56.7649 41.9047 178.1037 75 Q 4.2278 7.8425 118.8999 55.0797 30.6545 176.7431 76 L 3.8881 8.5409 123.8310 58.3266 41.7471 180.1988 77 S 4.2131 8.0754 114.4045 61.4878 62.7874 176.8308 78 V 3.6935 7.7090 120.8127 65.9201 30.9747 177.9383 79 S 4.1219 8.1690 114.0946 61.6647 62.5039 176.3579 80 N 4.1530 8.0841 119.8088 56.1512 38.1177 177.4342 81 L 4.7060 7.6808 120.1409 57.0716 41.7097 179.2247 82 Q 4.1221 7.9051 117.8539 58.6836 28.6514 177.9031 83 E 4.4437 7.5723 118.4546 57.3240 30.1961 176.4658 84 N 4.7504 8.3419 118.7388 51.5560 41.0061 172.3199 85 P 4.7122 0.0000 0.0000 63.8580 32.7051 175.6465 86 Y 4.9389 8.0933 119.3840 58.5423 38.4444 175.0163 87 A 4.9808 9.3995 124.2357 51.3846 23.8124 175.0202 88 T 5.0445 8.6266 114.8187 61.8057 72.3557 172.9348 89 L 5.2532 9.2112 129.3508 53.8114 43.9152 175.3400 90 T 5.3638 8.6374 115.3761 59.0321 72.8459 172.5603 *92 T 4.5051 8.1631 114.1378 61.7842 68.1851 174.3013 93 L 4.1374 8.7785 126.5236 56.5566 41.7392 178.8886 94 A 4.2916 8.0651 121.5346 54.1407 18.3884 178.7205 95 Q 4.2267 8.0131 114.8220 57.8700 28.9908 175.9512 96 T 4.6259 7.5233 107.8187 60.2796 71.2757 174.2296 97 N 4.7091 8.5730 118.0524 54.0364 38.8052 176.2448 98 F 4.1651 8.2682 122.6283 62.6809 39.4533 176.4786 99 C 4.4282 8.4286 115.3510 59.7021 34.4950 176.1273 100 K 3.9165 7.9919 119.9645 59.3261 31.5769 179.3583 101 K 3.8530 7.8852 117.7867 59.7795 32.4848 177.9394 102 H 4.1801 7.2430 114.5950 54.2676 29.1592 174.9877 103 G 3.6691 7.3784 108.2705 46.7209 0.0000 173.9134 104 F 5.0623 8.0754 118.9969 54.9957 40.5722 175.9554 105 D 4.5401 8.8127 125.3667 53.8680 41.5403 175.3579 106 P 4.3318 0.0000 0.0000 65.3654 31.4080 176.9790 107 Q 4.3021 8.0796 116.6426 55.9222 29.5962 175.5396 108 S 4.2875 8.0261 113.8603 58.0219 63.1593 173.1235 109 P 4.2901 0.0000 0.0000 65.2259 31.2432 178.3816 110 L 3.5339 7.1946 118.8253 57.1866 41.3439 176.6379 111 C 4.8330 7.9227 119.3412 54.7528 40.5424 171.6145 112 V 4.1132 8.3063 124.8109 63.5268 32.1502 173.9579 113 H 5.3741 9.0030 122.3029 53.9511 32.2964 172.5262 114 I 4.9770 7.7354 113.0218 58.7616 41.4439 173.7939 *116 L 4.4154 8.4189 120.6403 55.1591 42.6503 175.4832 117 S 5.3629 9.3553 118.8089 55.8709 65.7202 173.7973 118 G 4.9327 7.9403 113.0934 46.5589 0.0000 171.7193 119 T 5.2023 7.9221 112.5169 59.8730 72.3719 173.4396 120 V 5.0291 8.5666 124.0088 61.8991 32.8558 175.0273 121 T 4.9441 8.8277 116.9486 59.4089 72.7889 173.2156 122 K 4.8572 8.6783 121.6466 56.4530 32.7547 177.3810 123 V 3.9887 8.9450 125.3754 62.5565 32.3248 175.7958 124 N 4.4931 9.0078 124.2277 53.5028 39.2786 175.5233 125 E 3.9713 9.1028 121.0996 60.0507 29.5516 179.3874 126 T 3.9295 7.9220 106.2270 63.6911 69.6462 174.4083 127 E 4.2506 7.7598 125.4811 54.5187 28.5601 175.0056 *129 D 4.1898 7.8227 122.2550 53.8920 43.7735 177.1062 130 I 3.4963 7.4115 117.8070 63.8143 37.8510 177.4577 131 A 2.5800 7.1574 121.5252 54.3747 18.0295 179.5534 132 K 2.6726 6.6562 117.3544 59.3542 32.3632 178.2882 133 H 3.9770 8.1277 118.7072 59.2704 29.6377 177.1105 134 S 4.0367 8.0928 117.2460 61.7171 62.6610 176.9480 135 L 4.0988 8.0169 121.6061 58.0624 41.2635 179.7096 136 F 4.2033 8.3209 116.7034 60.3721 38.8190 177.6953 137 I 3.8315 7.4436 118.6702 64.3674 36.9846 178.1327 138 R 4.0958 7.5975 118.5332 57.9967 30.9866 176.1686 139 H 4.8280 8.6822 116.2094 52.5204 28.8180 172.0815 140 P 3.8369 0.0000 0.0000 65.2672 32.0524 178.8092 141 E 4.0274 7.2713 122.6244 55.5362 28.0952 178.1153 *143 K 3.6406 7.9021 118.4126 55.9902 34.2623 177.4148 144 T 4.3531 7.4306 106.4009 61.2556 69.4651 175.2610 145 W 4.4564 7.7786 122.7991 55.8209 29.8351 173.9670 146 P 4.4909 0.0000 0.0000 62.8593 31.1584 177.4690 147 S 4.4344 9.1267 118.7244 61.0924 62.9701 176.4340 148 S 4.1803 8.1697 114.4058 60.8477 62.7001 174.4514 149 H 4.0784 8.1593 116.8015 55.2462 29.0674 174.4676 150 N 4.1378 7.8326 116.3565 53.6771 36.2468 174.7890 151 W 4.4400 7.6489 116.3849 57.1658 30.1186 177.2474 152 F 5.0659 8.8268 118.1432 54.9649 41.5903 173.6231 153 F 5.2975 8.9441 118.6892 57.3496 40.1398 174.6273 154 A 5.7637 9.7113 125.2642 50.1775 23.0492 174.5710 155 K 5.0956 9.4008 117.5437 55.2740 36.8944 174.8998 156 L 5.0977 8.2674 123.6432 54.0867 43.2575 175.7174 157 N 4.7803 9.3085 125.4369 52.5759 39.5387 174.3126 158 I 4.7720 8.4921 125.9994 60.7372 37.5457 175.9385 159 T 4.5232 8.8432 117.3248 62.0457 70.8498 174.6390 160 N 4.8341 7.8992 118.3279 51.3331 43.4212 173.5352 161 I 4.7640 7.4050 121.6585 59.3488 41.1450 174.0063 162 W 5.1211 9.0566 125.8184 54.7714 32.7419 174.5158 163 V 4.6106 8.9604 123.6162 61.1728 34.1486 174.2090 164 L 4.9396 8.9544 129.1931 53.1378 42.1140 176.3112 165 D 5.1485 8.2935 120.0294 51.3619 40.8789 174.3335 166 Y 4.0932 7.3823 118.8392 56.4710 41.5541 173.4660 167 F 4.3144 6.4457 121.3342 58.5852 39.2964 175.8972 168 G 3.9772 9.0140 110.4834 45.1636 0.0000 174.2821 169 G 3.9813 7.9823 105.2838 43.6023 0.0000 171.3907 170 P 4.6974 0.0000 0.0000 62.6069 32.1432 176.4111 171 K 4.6389 9.1457 123.0071 54.8252 34.4691 175.4277 172 I 4.4483 8.2738 125.5241 60.2741 38.5351 175.3746 173 V 4.5996 7.8929 125.7764 61.1801 34.1883 175.4504 174 T 4.1729 9.0667 118.0358 60.3964 69.9318 173.7299 175 P 4.1760 0.0000 0.0000 66.0175 31.2493 178.7664 176 E 4.1166 8.1513 115.8240 59.2107 29.5506 178.8083 177 E 3.9355 8.0251 118.8116 59.3550 29.4507 178.2747 178 Y 4.1549 8.1740 119.6095 61.0218 38.3803 177.5289 179 Y 4.3887 8.2890 116.2617 59.6326 37.9788 176.6704 180 N 4.6790 7.9258 116.3139 52.7572 39.2608 175.5261 181 V 3.5837 6.8990 121.2042 63.2547 32.1129 175.8140 182 T 4.1618 8.3899 115.8985 61.7675 68.8283 174.1665 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 11 G 8.34 4.07 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 0.00 12 S 7.49 4.57 0.00 4.02 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 13 L 8.71 2.62 0.00 1.18 1.46 0.46 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.38 0.00 1.98 1.90 0.00 3.34 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.96 0.00 15 P 0.00 4.23 0.00 2.11 1.92 0.00 3.53 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 16 R 8.44 4.07 0.00 1.61 1.91 0.00 3.29 0.00 0.00 3.67 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 17 E 7.99 3.92 0.00 1.80 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 2.23 2.17 0.00 18 D 7.84 4.60 0.00 2.71 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 19 A 7.98 3.98 1.31 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 0.00 0.00 20 A 7.93 3.99 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 21 R 8.24 3.83 0.00 2.01 1.97 0.00 3.11 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 1.62 1.89 0.00 22 V 7.96 3.61 2.20 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 1.01 0.00 0.00 0.93 0.00 0.00 23 A 8.41 4.08 1.56 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 0.00 0.00 24 R 8.13 3.72 0.00 1.90 1.82 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.40 0.00 25 F 8.62 3.98 0.00 3.16 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 26 V 8.05 3.42 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 0.93 0.00 0.00 1.06 0.00 0.00 27 T 7.82 3.87 4.31 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 1.26 0.00 0.00 28 H 7.80 4.69 0.00 3.15 3.18 0.00 5.79 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 29 V 7.39 3.58 1.81 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 0.03 0.00 0.00 0.59 0.00 0.00 30 S 6.97 4.31 0.00 3.90 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 31 D 8.52 4.77 0.00 2.94 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 32 W 7.43 5.69 0.00 3.61 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 33 G 9.50 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 34 A 8.77 5.35 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 35 L 9.09 5.02 0.00 1.68 1.50 0.90 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 36 A 9.17 5.14 1.29 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 0.00 0.00 37 T 9.00 5.14 4.31 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 1.27 0.00 0.00 38 I 8.20 4.80 1.92 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 1.31 0.94 0.94 0.00 0.00 39 S 9.34 4.39 0.00 3.82 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 40 T 8.65 4.42 4.20 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 1.18 0.00 0.00 41 L 7.50 4.01 0.00 1.64 1.56 0.71 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 42 E 9.13 3.83 0.00 1.87 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 2.29 2.39 0.00 43 A 8.02 4.19 1.29 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 0.00 0.00 44 V 7.89 4.53 2.12 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 0.80 0.00 0.00 0.93 0.00 0.00 45 R 8.12 4.25 0.00 1.90 1.84 0.00 3.22 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 46 G 9.11 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 47 R 7.88 4.35 0.00 2.07 1.93 0.00 3.15 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 48 P 0.00 4.89 0.00 2.10 2.08 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 49 F 9.61 5.09 0.00 3.05 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 50 A 7.24 5.17 1.05 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 51 D 8.18 4.38 0.00 2.79 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 52 V 8.40 4.84 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 0.69 0.00 0.00 0.88 0.00 0.00 53 L 8.96 5.07 0.00 1.75 1.69 0.49 0.75 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 54 S 8.99 5.17 0.00 3.93 3.59 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 55 L 8.78 5.11 0.00 1.60 1.84 0.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.49 4.72 0.00 3.99 3.78 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 57 D 9.81 5.43 0.00 2.92 2.83 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 58 G 7.65 4.83 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 59 P 0.00 4.53 0.00 2.21 2.11 0.00 3.86 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 7.38 3.67 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 0.00 0.00 0.00 104 F 8.08 5.06 0.00 3.04 2.84 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 0.00 105 D 8.81 4.54 0.00 2.74 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 0.00 106 P 0.00 4.33 0.00 2.11 2.17 0.00 3.77 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 2.08 2.15 0.00 107 Q 8.08 4.30 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 108 S 8.03 4.29 0.00 3.96 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 0.00 109 P 0.00 4.29 0.00 2.20 2.25 0.00 3.73 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 1.62 1.98 0.00 110 L 7.19 3.53 0.00 0.67 0.13 0.52 -0.33 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 1.37 0.51 0.84 0.00 0.00 138 R 7.60 4.10 0.00 1.80 1.94 0.00 3.37 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 139 H 8.68 4.83 0.00 3.09 3.00 0.00 5.68 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 3.84 0.00 2.07 2.10 0.00 3.76 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 1.92 1.90 0.00 141 E 7.27 4.03 0.00 1.85 1.92 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 2.50 2.36 0.00 *143 K 7.90 3.64 0.00 1.62 1.68 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 0.71 7.81 144 T 7.43 4.35 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 1.16 0.00 0.00 145 W 7.78 4.46 0.00 2.84 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 0.00 146 P 0.00 4.49 0.00 2.32 2.29 0.00 3.93 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.89 0.00 147 S 9.13 4.43 0.00 4.14 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 0.00 148 S 8.17 4.18 0.00 4.01 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 0.00 149 H 8.16 4.08 0.00 2.41 2.16 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 N 7.83 4.14 0.00 2.72 2.82 0.00 0.00 6.95 7.19 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 0.00 151 W 7.65 4.44 0.00 2.84 1.74 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 0.00 152 F 8.83 5.07 0.00 3.08 3.11 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 0.00 0.00 0.00 0.00 153 F 8.94 5.30 0.00 3.19 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 0.00 154 A 9.71 5.76 1.58 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 0.00 0.00 155 K 9.40 5.10 0.00 1.66 2.06 0.00 1.48 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.46 7.81 156 L 8.27 5.10 0.00 2.07 1.71 1.13 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 157 N 9.31 4.78 0.00 2.74 2.82 0.00 0.00 6.54 7.40 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 0.00 158 I 8.49 4.77 1.86 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 1.33 0.54 0.79 0.00 0.00 159 T 8.84 4.52 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 1.29 0.00 0.00 160 N 7.90 4.83 0.00 2.49 1.78 0.00 0.00 6.91 7.59 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 0.00 161 I 7.40 4.76 1.85 0.00 0.00 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 0.94 0.71 0.73 0.00 0.00 162 W 9.06 5.12 0.00 3.25 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 0.00 163 V 8.96 4.61 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 1.04 0.00 0.00 0.94 0.00 0.00 164 L 8.95 4.94 0.00 1.38 1.50 0.94 0.90 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 0.00 165 D 8.29 5.15 0.00 2.74 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 0.00 166 Y 7.38 4.09 0.00 2.75 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 0.00 167 F 6.45 4.31 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 0.00 168 G 9.01 3.98 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 0.00 0.00 0.00 169 G 7.98 3.98 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 0.00 0.00 0.00 170 P 0.00 4.70 0.00 2.18 2.19 0.00 3.72 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 2.11 2.17 0.00 171 K 9.15 4.64 0.00 1.66 1.69 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.42 7.81 172 I 8.27 4.45 1.77 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.71 0.66 0.00 0.00 173 V 7.89 4.60 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 0.85 0.00 0.00 0.92 0.00 0.00 174 T 9.07 4.17 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 1.16 0.00 0.00 175 P 0.00 4.18 0.00 2.25 2.38 0.00 3.56 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 2.11 2.14 0.00 176 E 8.15 4.12 0.00 2.20 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 0.00 2.38 2.36 0.00 177 E 8.03 3.94 0.00 2.14 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 2.34 2.32 0.00 178 Y 8.17 4.15 0.00 2.83 2.88 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 0.00 179 Y 8.29 4.39 0.00 3.21 2.89 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 0.00 180 N 7.93 4.68 0.00 2.80 2.87 0.00 0.00 6.89 7.64 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 0.00 181 V 6.90 3.58 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 0.70 0.00 0.00 0.92 0.00 0.00 182 T 8.39 4.16 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 * Residues marked with a * may have inaccurate shift predictions.