NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 P 4.2773 0.0000 0.0000 62.4094 32.5321 175.5916 -2 L 4.3133 8.1940 122.6157 52.3811 43.1500 174.5698 -1 G 3.8906 8.3866 115.7663 45.2276 0.0000 171.6565 0 S 4.6922 8.2074 114.0605 57.1982 65.9262 174.8510 1 M 4.0866 8.5322 122.6590 58.8153 32.0392 178.2335 2 E 4.1963 8.2814 118.9970 59.5578 29.9220 178.3111 3 D 4.4330 8.0114 118.8452 57.3320 40.7896 178.6037 4 F 4.0437 8.2838 121.0581 61.2856 39.4248 177.3346 5 V 3.6385 8.3208 118.2407 66.1938 31.1113 178.1593 6 R 4.1004 7.9646 116.1560 58.5118 29.9966 178.1748 7 Q 4.1679 7.4421 116.4464 57.4954 29.1900 176.9084 8 C 3.7533 7.5972 118.9849 59.6940 31.9993 173.4892 9 F 4.7247 7.0216 117.7395 55.2695 40.8809 175.9229 10 N 4.5630 8.4228 120.9376 52.3187 39.2446 174.4461 11 P 4.2769 0.0000 0.0000 65.9209 31.2983 178.7405 12 M 3.9832 8.0952 116.6156 58.6426 32.1905 178.1049 13 I 3.6660 7.6335 119.4085 64.3813 37.2761 178.3546 14 V 3.5677 7.8811 118.9679 65.9829 31.3870 177.6056 15 E 4.1509 8.5613 119.3395 59.4773 29.4460 178.8195 16 L 4.0813 8.3494 119.0650 57.6287 41.6545 179.3617 17 A 4.0814 8.5302 121.2330 55.2548 18.3148 179.4295 18 E 3.9013 8.7491 117.4716 59.5251 29.5961 179.7573 19 K 3.9448 8.2167 118.1381 59.5565 31.9179 179.2534 20 A 4.1209 8.3149 121.0747 55.4192 18.2897 179.6996 21 M 4.1483 8.1860 117.2072 58.4922 32.0132 179.0218 22 K 4.0906 8.2856 119.0362 59.3717 32.0975 178.7209 23 E 3.8457 8.0411 114.3433 57.9784 29.6793 176.7666 24 Y 4.3928 7.3600 113.8460 57.6055 38.1408 176.8454 25 G 4.0506 8.9948 110.5742 45.5548 0.0000 174.5638 26 E 4.1156 7.8606 118.9486 56.2511 30.1715 175.5807 27 D 4.8374 8.3145 120.9826 51.6943 43.4068 175.0935 28 P 3.8569 0.0000 0.0000 65.4108 31.2768 178.4002 29 K 4.3421 7.8057 114.5009 58.5432 32.7894 177.9454 30 I 4.2069 7.5025 119.0921 62.9887 39.7746 176.8562 31 E 4.4200 8.2438 120.4481 55.6904 26.3448 177.9433 32 T 4.2509 7.5215 114.9945 64.7282 69.5465 176.1848 33 N 4.5892 8.2539 119.0600 55.8152 38.5932 177.1689 34 K 4.0931 8.1570 120.7697 59.2225 32.3521 178.5501 35 F 4.4040 8.3566 120.8926 61.3870 39.3989 176.7791 36 A 3.7506 8.1817 120.1636 55.2948 18.0259 179.4958 37 A 4.3364 8.4837 119.0909 55.4119 18.3876 180.0315 38 I 3.7530 8.0835 118.5024 64.7333 37.2854 178.3749 39 C 3.7881 7.7975 117.5416 62.8135 27.6189 176.4817 40 T 4.0506 7.6427 117.3301 66.8206 68.1237 176.2462 41 H 4.0859 8.4593 120.3369 59.2414 29.7885 177.0280 42 L 3.9485 8.0829 120.7392 57.8838 41.4566 178.8850 43 E 4.0603 8.2266 119.0065 59.5417 29.5197 178.9341 44 V 3.4526 7.8577 117.9068 66.3032 31.6629 177.5984 45 C 3.8841 7.9764 116.2181 62.9748 27.7168 176.2801 46 F 4.1636 8.0561 118.0909 60.7907 38.5247 177.4108 47 M 4.2480 8.1894 117.9080 58.4635 31.8301 177.8152 48 Y 3.9411 8.2423 119.5535 59.5191 39.1445 176.4376 49 S 4.2634 7.3046 113.0090 57.4724 64.5253 172.3141 *74 H 4.6027 8.1614 117.2062 55.3589 29.7362 173.7724 75 R 4.0366 8.5819 120.1256 58.9412 30.9514 175.9617 76 F 5.3374 8.1105 116.9059 55.6059 41.0707 175.0561 77 E 4.4856 9.4614 126.0919 55.4696 30.7915 175.3642 78 I 4.3537 8.5337 128.5148 60.7859 38.1138 175.0354 79 I 4.1497 8.5677 126.2916 62.7380 38.4064 176.0561 80 E 3.7859 7.8826 119.1379 57.9622 29.5625 177.1446 81 G 4.0667 8.9698 113.2921 45.3411 0.0000 173.3672 82 R 4.5404 7.2042 115.7798 54.1760 31.5287 176.3449 83 D 4.3534 8.5726 117.2999 55.0574 41.8774 178.1396 84 R 3.9384 8.8845 123.4857 59.9886 30.3043 179.2105 85 T 4.0308 7.9065 114.6834 66.8550 68.5707 176.3661 86 M 4.1512 8.3152 120.7752 57.9119 32.3142 177.7563 87 A 3.9584 8.6688 121.3336 55.2451 18.5809 179.7447 88 W 4.2179 8.2994 117.5087 59.9382 28.6701 178.9847 89 T 3.9922 8.0524 109.6506 64.6840 68.4176 176.6245 90 V 3.6705 7.9210 121.3774 65.7777 31.5249 178.1047 91 V 3.6970 7.9871 117.6449 66.2451 31.4160 177.5367 92 N 4.4413 8.8600 116.8151 56.5611 38.1585 177.5546 93 S 4.2003 8.3731 115.5160 61.3271 62.9898 176.6352 94 I 3.6148 7.6893 122.9558 64.5703 36.8913 178.2537 95 C 4.3634 8.2907 117.3649 62.9065 27.6792 176.0219 96 N 4.4379 8.0317 117.5099 56.1946 38.1451 177.5157 97 T 4.0935 7.4759 116.6300 66.8434 68.8635 176.7792 98 T 4.2143 8.2169 110.3413 62.4786 69.3106 175.8761 99 G 3.9649 8.2770 109.1874 44.5264 0.0000 173.7815 100 V 3.6915 6.9916 118.6747 62.8540 32.0067 175.3470 101 E 4.0638 8.6291 126.1249 55.7686 30.1225 176.4915 102 K 4.1104 8.5448 127.0768 55.3958 32.8337 174.8214 103 P 4.3798 0.0000 0.0000 63.0472 31.5141 176.5396 104 K 4.0048 8.5353 119.1667 58.5194 32.3278 177.4297 105 F 5.2127 7.6427 114.8162 54.8996 42.5267 174.5779 106 L 3.2577 8.5237 123.3320 54.2612 41.6941 176.0886 107 P 5.1410 0.0000 0.0000 61.7063 33.6689 174.6782 108 D 4.6494 8.8095 116.5285 56.2058 42.3217 177.0003 109 L 5.3326 7.7068 115.7594 53.1433 46.7957 174.6722 110 Y 4.7723 9.0130 122.0513 55.8800 41.6935 174.0004 111 D 4.6039 7.6444 126.9208 52.7350 41.7799 176.2043 112 Y 4.2330 8.2637 124.7468 60.1279 37.9530 177.8462 113 K 4.0218 8.0281 120.5606 59.1243 32.4412 177.5444 114 E 4.0792 8.1496 114.2172 56.1225 30.3046 175.9837 115 N 4.0178 7.7739 115.5351 51.8338 36.5971 173.0478 116 R 4.5993 5.9423 112.8071 55.0324 33.3627 176.1990 117 F 5.0315 8.7106 118.6126 57.6710 40.7768 174.4999 118 I 5.1014 8.9708 121.6133 59.7462 41.2287 174.1507 119 E 4.7485 9.2703 127.0207 54.9296 31.2031 174.9792 120 I 4.8309 8.8234 126.4636 59.8884 38.8014 175.6352 121 G 4.6016 9.0427 112.7832 44.4723 0.0000 171.5452 122 V 4.9246 8.3212 120.8136 61.0008 34.0859 174.4837 123 T 4.5132 8.6438 122.2680 60.4138 69.7819 174.8616 124 R 4.5728 9.7606 126.4284 57.5966 31.3173 177.8102 125 R 4.6283 7.5726 119.7485 55.9166 30.7773 175.8553 126 E 4.5579 8.6363 121.3727 56.7552 31.3762 177.6081 127 V 3.7858 8.7452 117.6726 64.8127 31.7504 178.3583 128 H 4.1977 8.3250 117.4769 59.5755 29.7390 177.2724 129 T 3.8548 7.9606 116.9351 66.8218 68.3599 175.8247 130 Y 3.9232 8.0964 121.2985 60.7436 38.4672 176.9953 131 Y 4.0135 8.4040 120.8193 61.1159 38.7078 178.4828 132 L 4.0719 7.9445 118.8922 57.7581 41.5238 179.2901 133 E 3.7980 8.1770 118.5469 59.2728 29.3860 179.4099 134 K 3.6685 8.0192 119.5827 59.2688 32.2282 178.5652 135 A 3.7832 7.9197 121.4233 55.3061 18.0774 179.2198 136 N 4.2872 8.1141 114.3871 56.2398 38.9906 176.9557 137 K 4.0666 7.4845 120.9404 59.4932 32.5080 178.6703 138 I 4.1299 7.6694 111.5843 61.2329 39.1173 175.9507 139 K 3.8064 7.8238 116.9752 56.8632 29.5421 173.5511 140 S 4.6185 7.4741 111.5467 56.9561 65.8032 173.3418 141 E 4.5020 8.8333 125.1211 56.5158 30.1193 176.6498 142 K 4.4083 7.8419 117.4845 57.7803 33.7353 177.0745 143 T 4.2161 8.2687 116.5664 63.7449 68.8706 174.2425 144 H 4.5375 9.4685 127.5998 55.8860 31.4834 173.7845 145 I 4.9603 8.8273 126.0162 59.7539 40.2981 174.0819 146 H 5.1415 9.2061 125.7233 54.6251 33.0258 171.7341 147 I 5.1082 9.0999 127.1703 59.7033 39.6630 174.9135 148 F 5.4339 9.3776 125.3039 55.7952 42.3669 174.5734 149 S 5.6442 8.4580 115.2314 55.7206 65.7944 173.7641 150 F 4.7026 9.2417 116.5374 58.1231 38.9206 176.7173 151 T 4.4707 8.7293 108.2721 61.2208 69.1743 175.1933 152 G 4.0164 8.4693 110.6613 45.0536 0.0000 173.4611 153 E 4.4406 7.9516 121.1713 56.1870 30.9762 175.0327 154 E 5.2271 8.5091 121.6170 55.4407 33.3857 173.8813 155 M 5.0070 9.0742 119.4051 54.2654 36.1679 173.4850 156 A 5.0900 8.0066 125.6337 49.9133 23.5608 175.3158 157 T 3.9419 8.5047 115.8579 64.5903 68.8807 174.8130 158 K 3.6438 9.1647 123.5693 56.8732 29.6657 174.8776 159 A 3.4642 7.5569 118.3848 53.1235 16.5790 177.6676 160 D 4.7932 7.7357 119.3264 54.6272 41.8084 175.3074 161 Y 4.2718 8.6671 123.5208 57.5409 38.6722 176.3338 162 T 3.7771 7.9670 121.6007 64.2670 67.6611 172.2022 163 L 4.6970 7.4821 118.9213 52.8482 43.8818 176.7797 164 D 4.6167 8.2462 120.5960 53.3115 41.4205 177.1888 165 E 3.9853 8.7054 119.8436 59.7271 29.3804 179.6277 166 E 3.9648 8.1589 118.2074 59.3221 29.4477 179.2728 167 S 4.0926 8.5032 115.2826 61.7321 62.9291 177.0334 168 R 3.9760 8.0192 120.5065 59.1744 29.7590 178.9469 169 A 4.1602 8.2732 120.7312 55.1896 18.3747 179.9327 170 R 3.8458 7.8403 116.3103 59.2784 30.0988 179.3941 171 I 3.5382 7.3948 119.5320 64.3899 37.1546 178.6394 172 K 3.9828 8.4392 119.5944 59.8437 31.8666 179.5459 173 T 4.0179 8.1713 116.1898 66.2580 68.3408 176.9951 174 R 3.9281 7.9577 120.7656 59.3787 30.0536 178.6010 175 L 4.0524 8.0602 118.9003 57.5313 41.4684 179.0764 176 F 4.1386 8.4124 120.6801 61.8172 39.3443 177.3094 177 T 3.6627 8.0403 115.0235 66.5614 68.1463 176.7125 178 I 3.7732 7.9441 121.6282 64.3596 37.1351 178.3055 179 R 3.5036 8.2251 119.6076 59.5628 29.7251 178.5235 180 Q 3.6287 7.7578 117.9077 58.7267 28.4388 178.6415 181 E 3.9295 8.1147 119.5281 59.7207 29.4895 179.2335 182 M 3.4495 8.0090 118.4843 58.2501 32.1253 178.7356 183 A 4.0437 8.1254 121.3043 55.1744 18.3253 179.8655 184 S 4.1366 8.1976 111.9181 60.8153 63.1595 175.8696 185 R 4.4209 7.4312 119.4225 55.1860 30.2259 176.9067 186 G 3.9246 7.5532 106.3880 46.6369 0.0000 175.2325 187 L 4.3053 7.9906 121.6203 55.5964 41.9830 178.5968 188 W 4.2530 8.1010 128.3809 60.3687 30.6114 177.3178 189 D 4.0225 7.9742 117.5517 57.2769 40.8156 178.0326 190 S 3.9860 7.8469 113.1949 61.0870 62.2621 175.4031 191 F 4.0973 7.6646 122.2617 61.4727 38.9844 176.6145 192 R 3.1068 7.4928 118.2651 59.3618 29.4382 178.3948 193 Q 3.6990 7.5816 116.6459 58.2977 28.8507 178.1435 194 S 4.3491 7.7998 114.1871 59.1245 63.1147 173.9092 195 E 3.7836 6.9498 123.8212 56.4633 29.2856 176.4545 196 R 4.4100 8.3272 126.4206 55.0226 32.4612 176.8709 197 G 3.7669 8.3795 106.7532 46.1634 0.0000 173.6118 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 -3 P 0.00 4.28 0.00 2.20 2.13 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 -2 L 8.19 4.31 0.00 1.64 1.59 0.94 0.74 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 -1 G 8.39 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 0 S 8.21 4.69 0.00 4.11 4.03 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 1 M 8.53 4.09 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.75 0.00 2 E 8.28 4.20 0.00 2.21 2.04 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 2.62 2.64 0.00 3 D 8.01 4.43 0.00 2.91 2.76 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 4 F 8.28 4.04 0.00 3.17 3.24 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 5 V 8.32 3.64 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 0.12 0.00 0.00 0.91 0.00 0.00 6 R 7.96 4.10 0.00 1.88 2.02 0.00 3.30 0.00 0.00 3.31 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.07 0.00 7 Q 7.44 4.17 0.00 1.82 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 8 C 7.60 3.75 0.00 1.57 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 0.00 0.00 0.00 9 F 7.02 4.72 0.00 2.96 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 10 N 8.42 4.56 0.00 2.96 2.93 0.00 0.00 6.05 7.76 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 11 P 0.00 4.28 0.00 2.17 2.16 0.00 3.58 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 2.10 2.14 0.00 12 M 8.10 3.98 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 13 I 7.63 3.67 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.40 0.87 0.00 0.00 14 V 7.88 3.57 2.27 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 1.31 0.00 0.00 1.05 0.00 0.00 15 E 8.56 4.15 0.00 2.17 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 0.00 2.34 2.39 0.00 16 L 8.35 4.08 0.00 1.81 1.82 1.07 1.13 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 A 8.53 4.08 1.50 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 18 E 8.75 3.90 0.00 2.23 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 2.16 2.57 0.00 19 K 8.22 3.94 0.00 1.96 1.89 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.80 1.60 7.81 20 A 8.31 4.12 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 21 M 8.19 4.15 0.00 2.13 2.13 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 3.02 2.67 0.00 22 K 8.29 4.09 0.00 2.02 1.86 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.55 7.81 23 E 8.04 3.85 0.00 1.96 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 2.57 2.04 0.00 24 Y 7.36 4.39 0.00 3.20 3.02 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 25 G 8.99 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 26 E 7.86 4.12 0.00 2.19 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 2.37 2.30 0.00 27 D 8.31 4.84 0.00 2.65 2.47 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 28 P 0.00 3.86 0.00 1.51 0.49 0.00 3.46 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 29 K 7.81 4.34 0.00 1.94 1.93 0.00 1.57 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.72 1.38 7.81 30 I 7.50 4.21 1.86 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 1.63 0.49 0.91 0.00 0.00 31 E 8.24 4.42 0.00 2.08 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 2.32 2.46 0.00 32 T 7.52 4.25 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 1.32 0.00 0.00 33 N 8.25 4.59 0.00 2.86 3.13 0.00 0.00 6.74 7.53 0.00 0.00 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 K 8.16 4.09 0.00 1.88 2.09 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.54 7.81 35 F 8.36 4.40 0.00 3.13 3.34 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 0.00 36 A 8.18 3.75 1.16 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 0.00 0.00 37 A 8.48 4.34 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 0.00 0.00 0.00 0.00 0.00 38 I 8.08 3.75 2.09 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.75 0.99 0.00 0.00 39 C 7.80 3.79 0.00 1.92 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 40 T 7.64 4.05 4.64 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 1.36 0.00 0.00 41 H 8.46 4.09 0.00 3.28 3.51 0.00 5.60 0.00 0.00 0.00 0.00 6.92 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 0.00 0.00 0.00 141 E 8.83 4.50 0.00 2.00 2.00 0.00 0.00 0.00 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 2.40 0.00 142 K 7.84 4.41 0.00 1.81 1.95 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.48 7.81 143 T 8.27 4.22 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 1.27 0.00 0.00 144 H 9.47 4.54 0.00 3.26 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 I 8.83 4.96 1.49 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.52 0.61 0.00 0.00 146 H 9.21 5.14 0.00 3.21 3.07 0.00 5.56 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 9.10 5.11 2.01 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.16 1.03 0.00 0.00 148 F 9.38 5.43 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 0.00 149 S 8.46 5.64 0.00 4.00 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 0.00 150 F 9.24 4.70 0.00 3.17 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 0.00 151 T 8.73 4.47 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 1.32 0.00 0.00 152 G 8.47 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 0.00 0.00 0.00 153 E 7.95 4.44 0.00 2.12 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 2.45 2.36 0.00 154 E 8.51 5.23 0.00 1.94 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 0.00 2.14 2.48 0.00 155 M 9.07 5.01 0.00 2.15 1.91 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 2.23 2.07 0.00 156 A 8.01 5.09 0.48 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 0.00 157 T 8.50 3.94 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 1.21 0.00 0.00 158 K 9.16 3.64 0.00 1.91 1.88 0.00 1.95 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.42 7.81 159 A 7.56 3.46 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 0.00 160 D 7.74 4.79 0.00 2.65 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 0.00 161 Y 8.67 4.27 0.00 3.02 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 0.00 162 T 7.97 3.78 4.55 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 1.61 0.00 0.00 163 L 7.48 4.70 0.00 1.52 1.49 0.07 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 164 D 8.25 4.62 0.00 2.90 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 0.00 165 E 8.71 3.99 0.00 1.98 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 2.38 2.32 0.00 166 E 8.16 3.96 0.00 2.09 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 2.39 2.33 0.00 167 S 8.50 4.09 0.00 3.96 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 0.00 168 R 8.02 3.98 0.00 1.93 2.15 0.00 3.58 0.00 0.00 3.46 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.70 0.00 169 A 8.27 4.16 1.34 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 0.00 0.00 0.00 170 R 7.84 3.85 0.00 2.02 1.95 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 171 I 7.39 3.54 1.71 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.86 -0.02 0.00 0.00 172 K 8.44 3.98 0.00 1.76 1.91 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.68 1.85 7.81 173 T 8.17 4.02 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 1.21 0.00 0.00 174 R 7.96 3.93 0.00 1.94 2.05 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 175 L 8.06 4.05 0.00 1.85 1.45 0.70 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 176 F 8.41 4.14 0.00 3.07 3.24 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 0.00 177 T 8.04 3.66 4.45 0.00 0.00 0.00 0.00 0.00 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 0.00 178 I 7.94 3.77 2.34 0.00 0.00 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 1.31 0.76 1.26 0.00 0.00 179 R 8.23 3.50 0.00 1.79 1.76 0.00 2.54 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.57 0.00 180 Q 7.76 3.63 0.00 1.63 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 1.95 1.32 0.00 181 E 8.11 3.93 0.00 2.37 2.34 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 2.40 2.51 0.00 182 M 8.01 3.45 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.39 0.00 183 A 8.13 4.04 1.20 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 0.00 0.00 184 S 8.20 4.14 0.00 3.98 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 0.00 185 R 7.43 4.42 0.00 1.74 1.97 0.00 3.43 0.00 0.00 3.36 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 186 G 7.55 3.92 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 0.00 187 L 7.99 4.31 0.00 1.60 1.51 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 188 W 8.10 4.25 0.00 3.41 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 0.00 189 D 7.97 4.02 0.00 2.79 2.59 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 0.00 190 S 7.85 3.99 0.00 3.89 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 0.00 191 F 7.66 4.10 0.00 2.86 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 0.00 192 R 7.49 3.11 0.00 0.67 1.43 0.00 3.22 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.36 0.00 193 Q 7.58 3.70 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 194 S 7.80 4.35 0.00 3.98 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 0.00 195 E 6.95 3.78 0.00 1.67 1.79 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 2.34 2.27 0.00 196 R 8.33 4.41 0.00 1.80 1.85 0.00 3.21 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.78 0.00 197 G 8.38 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.