NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3531 8.2649 123.5846 50.7390 19.3246 175.8711 3 P 4.8112 0.0000 0.0000 62.4865 31.4642 176.0928 4 K 4.3692 9.0345 123.7967 58.7433 33.7087 176.2681 5 A 4.7423 7.5987 117.3513 50.7395 23.4817 175.4177 6 V 4.7261 8.3700 118.3700 61.4159 35.1450 174.0119 7 L 5.2022 9.4376 128.3616 53.3076 44.1943 176.0549 8 V 4.6241 9.0111 115.5253 59.5811 36.3829 175.5243 9 G 3.7653 7.1988 107.2443 46.7068 0.0000 172.1646 10 L 4.5866 7.7056 120.4945 52.3174 42.9131 174.6101 11 P 4.3627 0.0000 0.0000 65.0185 31.0239 176.7370 12 G 4.0652 9.0144 111.1835 45.2710 0.0000 174.4565 13 S 4.1063 7.9735 115.8334 60.4128 63.0154 175.5094 14 G 4.0964 8.6495 107.8666 45.2302 0.0000 174.8749 15 K 3.7768 8.4155 122.0728 60.2131 31.8773 178.7989 16 S 4.1374 7.8977 115.1947 61.5235 63.2092 176.5750 17 T 3.9484 7.7117 117.7047 66.6543 68.5312 177.0641 18 I 3.8396 8.0902 122.0378 64.1247 37.1346 178.5154 19 G 4.2325 7.9376 107.5430 47.3039 0.0000 175.5342 20 R 3.8902 8.2634 121.9763 58.9072 30.2131 178.5434 21 R 3.9056 7.8050 117.6685 59.5088 28.6182 178.8425 22 L 4.0035 8.5611 119.9190 57.6338 41.9604 178.5420 23 A 4.0104 7.8632 120.5720 55.2835 18.2402 179.8702 24 K 3.8944 8.3768 116.7367 59.5172 32.0631 179.3309 25 A 4.1465 7.7151 118.9900 53.9839 18.3008 177.6613 26 L 4.5641 6.7027 116.1953 54.0733 43.5158 176.2500 27 G 3.9480 8.6858 103.6039 46.2320 0.0000 173.6949 28 V 4.5483 8.0347 112.5070 59.5042 36.1557 174.7291 29 G 4.2410 8.4734 107.0949 44.6607 0.0000 172.5102 30 L 4.8624 8.4411 124.8124 54.2276 42.9649 175.7731 31 L 4.5609 8.9440 128.9055 53.7744 44.5866 174.3696 32 D 5.3426 8.2786 123.1380 52.2940 43.3009 176.4732 33 T 3.8664 8.4623 117.6409 65.1652 68.7612 175.8499 34 D 4.5412 8.4003 121.5758 57.3001 40.9743 178.6896 35 V 3.5403 8.1234 117.7737 66.3164 31.3503 177.3407 36 A 4.2697 8.2954 119.2957 53.6385 18.4481 179.5596 37 I 3.6901 7.9632 119.7207 64.4692 37.2226 178.3165 38 E 3.4783 8.1725 117.6662 58.9157 29.2863 178.5829 39 Q 4.0019 7.9398 120.3728 59.4773 29.2730 178.1779 40 R 4.1396 8.2248 118.4865 58.6943 30.4091 178.2108 41 T 4.5106 8.8992 108.8742 60.4122 68.8405 175.2742 42 G 3.9670 7.7122 107.8767 46.2545 0.0000 173.6582 43 R 4.6518 7.7800 113.9821 53.7332 32.5286 175.1937 44 S 4.4626 8.7660 115.2272 58.3472 63.2585 175.2963 45 I 3.6756 8.7127 127.7134 64.6453 37.2996 178.1048 46 A 3.9075 8.1351 122.9139 55.2771 18.4631 176.9281 47 D 4.9436 8.3184 117.3334 51.8492 39.5155 175.1878 48 I 4.3321 7.6130 132.3522 62.4059 40.2116 176.6392 49 F 3.8219 8.1814 117.2694 60.4474 39.0128 177.1511 50 A 4.2327 8.7689 122.4391 55.1394 18.7143 178.7303 51 T 3.9308 8.0072 111.8946 64.3126 68.4124 175.0272 52 D 4.7923 6.4381 124.9565 51.8221 39.2258 174.9208 53 G 4.0737 7.9303 115.8280 46.1169 0.0000 172.3142 54 E 3.1985 8.5693 122.1428 58.3529 29.4306 178.8237 55 Q 4.1951 7.7074 115.9376 58.0456 29.8363 177.1269 56 E 3.9906 8.0007 120.6166 58.7595 29.5913 178.3139 57 F 4.1879 7.6776 120.0922 60.9929 39.0401 177.4202 58 R 3.5422 7.9215 117.6685 58.5997 29.4908 178.9921 59 R 3.9486 7.5919 115.4913 58.7607 29.9175 178.5374 60 I 3.7239 7.5205 120.0069 64.1224 36.7794 177.3742 61 E 3.6926 8.2666 120.2171 59.5102 28.9717 178.2777 62 E 3.8668 7.5270 118.5070 59.8749 29.6393 178.7572 63 D 4.3629 8.2606 118.6943 56.8241 40.8502 178.9780 64 V 3.5271 7.6093 118.4461 66.0286 31.5716 177.9679 65 V 3.4324 8.4269 119.0815 65.9949 31.0632 177.7294 66 R 3.8292 7.8638 117.1315 59.5249 30.2081 178.0845 67 A 4.1098 7.8871 119.9332 54.9883 18.4523 179.2572 68 A 3.9565 8.8752 120.4166 55.5349 18.2310 179.8784 69 L 3.9349 8.1710 115.8826 56.7504 41.7056 178.3965 70 A 4.6780 7.6841 118.0629 51.9033 20.2444 176.3988 71 D 4.7146 8.0131 114.9446 54.0822 43.3659 175.5297 72 H 4.7445 8.2247 118.9713 54.7021 30.6514 173.5909 73 D 4.8221 8.5571 125.7261 54.0173 42.0191 176.8750 74 G 4.2381 6.7566 107.9784 46.1625 0.0000 172.8642 75 V 4.7049 8.4650 123.2943 62.0149 33.5948 175.3720 76 L 5.1539 8.8117 127.5609 53.2484 45.3314 175.1080 77 S 4.7963 8.9493 120.3427 56.5198 64.5979 172.0403 78 L 4.5309 8.4306 130.1311 53.5380 43.3019 176.7267 79 G 3.3023 8.9777 113.5084 47.6437 0.0000 177.6168 80 G 3.9184 9.3427 112.0572 44.2138 0.0000 176.6638 81 G 3.9355 7.6692 109.3216 47.5013 0.0000 175.7735 82 A 4.2946 8.4320 122.2653 53.5004 18.4318 178.8101 83 V 3.9384 7.2222 107.8435 61.3480 32.1638 177.1527 84 T 3.8238 7.3600 116.8750 66.6182 68.6225 175.1158 85 S 4.2718 7.6009 118.2497 57.4470 63.4296 173.3030 86 P 4.3139 0.0000 0.0000 65.5145 31.0338 178.9048 87 G 3.6089 7.9313 105.5685 46.8975 0.0000 175.9019 88 V 3.5892 7.5918 120.0420 65.6843 31.4956 178.0208 89 R 3.8637 7.8825 116.6128 59.4384 30.1195 178.5783 90 A 4.0978 8.1863 120.3003 55.0916 18.1361 179.4154 91 A 4.0453 8.3378 118.5080 54.6570 18.8680 179.3649 92 L 4.2969 8.2413 117.0347 55.6548 41.5124 176.8078 93 A 4.2595 7.1326 123.1697 53.3215 18.4644 176.5182 94 G 4.0258 8.9677 112.8055 46.5507 0.0000 173.9069 95 H 4.4706 7.7711 116.1307 54.9144 29.5604 174.9456 96 T 4.1011 8.3810 117.5615 63.8837 69.5063 173.7994 97 V 4.6467 8.7115 127.2904 61.0049 34.3178 174.2018 98 V 4.7185 9.1832 128.4473 61.5642 33.2305 173.7949 99 Y 5.0139 9.2668 130.3257 56.0737 39.6601 174.6120 100 L 4.3214 8.6575 128.4305 54.3488 42.0178 176.5213 101 E 4.1473 9.0384 123.6983 54.9511 31.6128 175.1405 102 I 4.9290 7.9017 120.9228 59.4808 41.5926 174.4680 103 S 4.4198 8.8554 120.5375 57.6319 63.9682 174.6434 104 A 4.1268 8.7062 122.6401 55.7536 17.8277 179.9353 105 A 3.8159 7.7674 117.4125 55.2518 18.8718 179.0188 106 E 3.9054 8.6547 117.6594 60.2640 29.6884 181.7974 107 G 3.2567 8.0916 102.3320 46.0851 0.0000 177.0419 108 V 3.3543 7.7101 121.9808 64.7641 31.8929 178.5673 109 R 4.1162 8.3677 118.4322 58.3783 29.6806 177.7757 110 R 4.6788 7.3612 116.2961 55.8628 31.1899 177.0353 111 T 4.4938 7.4802 108.2765 60.9359 68.9977 172.9305 112 G 4.0171 8.2943 112.4410 46.1285 0.0000 173.5688 113 G 3.8986 8.3474 110.2735 43.5672 0.0000 172.6104 *124 D 4.4773 8.4609 125.6406 52.9732 40.4758 176.9043 125 R 4.2676 7.9663 118.6533 58.1811 30.1895 177.1794 126 A 3.8799 7.8566 120.3447 55.7886 18.4744 179.0103 127 E 4.0768 8.2960 116.6598 59.8107 29.1523 179.4499 128 K 3.9157 7.5485 117.1011 59.8524 32.0986 178.0096 129 Y 4.2540 7.5932 118.4099 59.4924 39.0077 177.3716 130 R 4.0040 9.0086 120.3995 59.6710 29.8624 178.1224 131 A 3.9860 8.3780 120.3386 55.4777 18.2420 179.4736 132 L 3.8172 7.7643 117.3119 57.9883 42.0092 178.6926 133 M 3.9486 8.2834 118.8678 58.3660 31.9459 177.4687 134 A 3.9812 8.3191 120.8643 55.3752 18.7023 179.0976 135 K 3.9383 8.7116 115.9451 59.5359 32.4755 178.7195 136 R 4.3050 7.7094 115.2204 55.8456 31.9657 177.7978 137 A 4.1423 8.2286 121.4230 55.0455 18.1322 177.9479 138 P 4.1694 0.0000 0.0000 65.4855 31.6713 178.5157 139 L 4.0491 7.4320 117.5269 57.7025 41.6966 178.8073 140 Y 3.9636 8.3516 117.8814 60.7349 37.5186 177.8267 141 R 4.0902 7.7413 116.5992 57.3431 30.2652 177.4742 142 R 4.5038 7.6026 117.1844 56.0542 31.3887 175.9957 143 V 4.2490 7.5112 108.3786 61.5574 34.1146 175.9021 144 A 4.2162 7.7061 122.9490 53.2739 18.4175 177.3639 145 T 4.3948 8.2929 111.8191 62.6274 70.2956 174.7211 146 M 4.6910 7.7818 122.5689 54.3115 35.1992 174.1978 147 R 4.9579 8.6819 125.0969 55.7927 32.4414 176.2969 148 V 4.2107 7.7318 118.4437 62.2507 35.6139 172.2263 149 D 4.8652 8.7812 128.8422 53.5166 40.3764 175.4957 150 T 4.2142 8.2952 113.7460 62.1580 69.1564 176.0208 151 N 4.3808 8.5866 120.6622 56.6503 38.8664 176.1026 152 R 4.1975 7.9360 115.6921 58.6838 30.8854 176.3864 153 R 3.7812 7.4928 114.9551 55.6504 31.0625 176.2639 154 N 4.7977 8.3892 118.9692 51.2718 40.4380 174.8689 155 P 4.2648 0.0000 0.0000 65.6899 31.5205 178.9311 156 G 3.9210 8.2130 103.9316 48.0381 0.0000 175.1436 157 A 3.9888 8.8660 123.3815 55.1423 18.4574 179.7980 158 V 3.4384 7.7969 116.8368 66.5211 31.6167 178.4348 159 V 3.6981 8.0168 117.9981 65.3944 31.2912 177.7998 160 R 4.1638 7.7080 115.7248 58.8892 29.2968 176.9846 161 H 4.0293 8.4965 118.6332 59.9750 29.5796 176.5823 162 I 3.6872 8.0270 119.9825 64.7714 37.1567 178.4782 163 L 4.1358 7.7772 118.1526 57.6838 41.5455 179.0768 164 S 4.4124 8.2814 111.8837 59.5761 63.4482 175.7469 165 R 4.2042 7.6407 121.1033 58.6572 30.3499 176.7092 166 L 4.2232 8.0502 122.8510 54.7647 41.4757 176.8830 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 A 8.26 4.35 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 3 P 0.00 4.81 0.00 2.29 2.18 0.00 3.91 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 2.28 0.00 4 K 9.03 4.37 0.00 1.64 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.45 7.81 5 A 7.60 4.74 1.21 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 0.00 0.00 6 V 8.37 4.73 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 0.99 0.00 0.00 0.97 0.00 0.00 7 L 9.44 5.20 0.00 1.59 1.54 0.97 0.92 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 V 9.01 4.62 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 0.91 0.00 0.00 1.09 0.00 0.00 9 G 7.20 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 10 L 7.71 4.59 0.00 1.82 1.49 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.36 0.00 2.34 2.18 0.00 3.70 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 2.15 2.06 0.00 12 G 9.01 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 13 S 7.97 4.11 0.00 3.83 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 14 G 8.65 4.10 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 0.00 0.00 0.00 15 K 8.42 3.78 0.00 1.99 2.11 0.00 1.51 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.57 7.81 16 S 7.90 4.14 0.00 3.90 3.94 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 17 T 7.71 3.95 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 18 I 8.09 3.84 1.92 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 1.64 0.96 0.91 0.00 0.00 19 G 7.94 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 0.00 0.00 0.00 0.00 20 R 8.26 3.89 0.00 2.01 1.93 0.00 3.12 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 21 R 7.80 3.91 0.00 2.07 1.98 0.00 3.17 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 22 L 8.56 4.00 0.00 1.72 1.81 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.86 4.01 1.52 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 0.00 0.00 24 K 8.38 3.89 0.00 1.80 1.87 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.60 7.81 25 A 7.72 4.15 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 26 L 6.70 4.56 0.00 1.92 1.57 0.92 1.03 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 27 G 8.69 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 28 V 8.03 4.55 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 0.69 0.00 0.00 0.99 0.00 0.00 29 G 8.47 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 0.00 0.00 0.00 0.00 30 L 8.44 4.86 0.00 1.67 1.60 0.99 0.93 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 31 L 8.94 4.56 0.00 1.12 1.28 0.78 0.72 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 32 D 8.28 5.34 0.00 2.72 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 33 T 8.46 3.87 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 1.20 0.00 0.00 34 D 8.40 4.54 0.00 2.93 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 35 V 8.12 3.54 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 1.05 0.00 0.00 0.95 0.00 0.00 36 A 8.30 4.27 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 37 I 7.96 3.69 2.12 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 1.58 1.20 1.02 0.00 0.00 38 E 8.17 3.48 0.00 2.22 2.43 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 2.42 2.40 0.00 39 Q 7.94 4.00 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.01 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 40 R 8.22 4.14 0.00 1.90 1.98 0.00 3.20 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 41 T 8.90 4.51 4.27 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 0.00 0.00 0.00 1.27 0.00 0.00 42 G 7.71 3.97 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 0.00 0.00 0.00 43 R 7.78 4.65 0.00 1.92 1.88 0.00 3.09 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.58 0.00 44 S 8.77 4.46 0.00 3.89 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 45 I 8.71 3.68 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.82 0.78 0.00 0.00 46 A 8.14 3.91 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 47 D 8.32 4.94 0.00 2.77 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 48 I 7.61 4.33 2.22 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.62 1.03 0.00 0.00 49 F 8.18 3.82 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 50 A 8.77 4.23 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.01 3.93 4.27 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 0.00 0.00 0.00 1.22 0.00 0.00 52 D 6.44 4.79 0.00 2.74 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 53 G 7.93 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 54 E 8.57 3.20 0.00 2.07 1.94 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 2.28 2.50 0.00 55 Q 7.71 4.20 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 56 E 8.00 3.99 0.00 2.03 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 2.36 2.40 0.00 57 F 7.68 4.19 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 58 R 7.92 3.54 0.00 1.86 1.85 0.00 3.32 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.35 0.00 59 R 7.59 3.95 0.00 1.90 1.99 0.00 3.09 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 60 I 7.52 3.72 1.91 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 1.54 0.55 0.89 0.00 0.00 61 E 8.27 3.69 0.00 1.23 1.53 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 0.00 2.16 2.20 0.00 62 E 7.53 3.87 0.00 1.99 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 0.00 2.27 2.34 0.00 63 D 8.26 4.36 0.00 2.97 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 64 V 7.61 3.53 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 1.02 0.00 0.00 1.02 0.00 0.00 65 V 8.43 3.43 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 1.00 0.00 0.00 0.94 0.00 0.00 66 R 7.86 3.83 0.00 2.08 2.09 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 67 A 7.89 4.11 1.37 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 0.00 0.00 0.00 68 A 8.88 3.96 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 69 L 8.17 3.93 0.00 1.83 1.59 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.68 4.68 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 71 D 8.01 4.71 0.00 2.92 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 72 H 8.22 4.74 0.00 3.09 3.35 0.00 5.93 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.56 4.82 0.00 2.65 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 74 G 6.76 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 0.00 0.00 0.00 0.00 75 V 8.46 4.70 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 0.98 0.00 0.00 0.98 0.00 0.00 76 L 8.81 5.15 0.00 1.79 1.46 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.95 4.80 0.00 3.91 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 78 L 8.43 4.53 0.00 1.76 1.74 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.98 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 9.34 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 81 G 7.67 3.94 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 0.00 0.00 0.00 82 A 8.43 4.29 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 7.22 3.94 1.91 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 0.70 0.00 0.00 0.33 0.00 0.00 84 T 7.36 3.82 4.21 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 1.18 0.00 0.00 85 S 7.60 4.27 0.00 4.00 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 86 P 0.00 4.31 0.00 2.12 2.08 0.00 3.56 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 87 G 7.93 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 0.00 0.00 0.00 88 V 7.59 3.59 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 1.08 0.00 0.00 0.87 0.00 0.00 89 R 7.88 3.86 0.00 1.92 1.95 0.00 3.15 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 90 A 8.19 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3.27 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.89 0.00 142 R 7.60 4.50 0.00 1.86 2.09 0.00 3.17 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 143 V 7.51 4.25 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 0.99 0.00 0.00 144 A 7.71 4.22 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 0.00 145 T 8.29 4.39 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 1.28 0.00 0.00 146 M 7.78 4.69 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.56 0.00 147 R 8.68 4.96 0.00 1.78 2.00 0.00 3.39 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.81 0.00 148 V 7.73 4.21 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 0.81 0.00 0.00 0.99 0.00 0.00 149 D 8.78 4.87 0.00 2.65 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 0.00 150 T 8.30 4.21 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 1.16 0.00 0.00 151 N 8.59 4.38 0.00 3.24 2.90 0.00 0.00 6.80 6.94 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 0.00 152 R 7.94 4.20 0.00 1.72 1.91 0.00 3.31 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 153 R 7.49 3.78 0.00 2.04 1.83 0.00 3.18 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 154 N 8.39 4.80 0.00 2.97 2.93 0.00 0.00 6.18 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 0.00 155 P 0.00 4.26 0.00 2.17 2.11 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 156 G 8.21 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 0.00 157 A 8.87 3.99 1.37 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 0.00 0.00 0.00 158 V 7.80 3.44 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 0.98 0.00 0.00 0.97 0.00 0.00 159 V 8.02 3.70 2.28 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 1.00 0.00 0.00 0.93 0.00 0.00 160 R 7.71 4.16 0.00 2.04 2.17 0.00 2.86 0.00 0.00 3.10 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.82 0.00 161 H 8.50 4.03 0.00 3.38 3.37 0.00 5.80 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.03 3.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.63 0.91 0.00 0.00 163 L 7.78 4.14 0.00 1.73 1.75 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.28 4.41 0.00 3.99 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 0.00 165 R 7.64 4.20 0.00 1.91 1.99 0.00 3.19 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 166 L 8.05 4.22 0.00 1.73 1.59 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.