NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *-13 H 4.6130 8.4449 120.3752 55.9629 31.2173 172.6357 *-12 H 4.2076 8.0857 114.8251 52.6273 29.2314 174.3507 -11 S 4.4258 8.9399 120.7045 56.6055 62.9885 172.6775 -10 S 4.2674 8.2091 123.6830 58.7842 64.1135 173.2363 -9 G 4.0331 8.1385 119.6283 45.5650 0.0000 174.0604 -8 R 4.4392 8.8460 119.5339 57.9515 32.8713 174.2410 -7 E 4.7557 7.8893 109.3889 56.6247 37.4300 177.8804 *-3 F 4.8693 8.3418 117.2374 57.5883 39.3867 175.5026 -2 Q 4.4785 9.4462 118.6680 56.3267 33.0270 172.8902 -1 G 4.0189 8.1821 106.7582 46.1081 0.0000 174.3815 *-13 H 4.6130 8.4449 120.3752 55.9629 31.2173 172.6357 -11 D 4.5958 8.9699 125.4045 52.5055 40.2885 174.3775 -10 K 4.1174 8.1891 128.3830 56.6842 33.4136 175.2363 -9 K 4.3931 8.0985 131.2283 56.6650 32.6445 175.7604 -8 S 4.5692 8.9260 114.7339 60.2515 65.7713 172.5410 -7 L 4.7457 7.6292 110.9889 55.1247 49.8100 178.8804 7 Y 4.7087 7.7195 116.0555 61.0785 37.9113 178.2569 8 K 3.9602 8.2597 120.0509 59.7288 31.8869 177.7227 9 Y 4.1583 8.1485 119.0774 60.8236 38.7157 177.7251 10 L 3.7505 8.1581 119.1232 58.0472 41.6206 179.6233 11 L 3.9850 8.1013 117.5484 57.5171 41.8677 179.4316 12 L 4.1050 8.0252 119.0208 58.0018 41.8149 179.6935 13 R 3.9675 7.8389 118.0046 59.2445 29.6758 178.7746 14 S 4.5501 7.9787 113.1226 59.6170 63.0091 174.7441 15 T 4.4888 7.6682 111.8088 61.5547 68.7684 174.8562 16 G 3.9245 7.8934 107.9442 46.0681 0.0000 173.5454 17 D 4.5626 7.7151 119.3945 52.4270 41.6094 175.2203 *19 H 4.5853 8.3814 121.6525 54.7716 29.6621 173.1847 20 R 3.9112 8.4806 120.6232 56.3050 30.4845 176.1123 21 A 4.4305 8.4078 125.5927 52.5070 18.9976 176.9985 22 K 4.7122 8.6671 120.0161 54.5074 36.3788 176.6833 23 S 4.3862 8.7091 119.9105 57.8607 63.4102 172.7821 24 P 4.6330 0.0000 0.0000 62.8847 32.0356 175.8607 25 T 4.5578 8.4846 108.5149 62.9689 71.6309 174.4906 26 I 4.4127 7.1087 112.2494 60.5941 39.1181 178.5174 *28 T 4.0929 8.5099 117.6136 63.1056 69.7723 171.6141 29 R 3.7130 8.6605 127.1053 55.9956 29.4887 176.2267 30 V 3.9137 8.4871 120.8114 62.4316 32.2737 175.7993 31 T 4.6513 7.1332 112.1474 60.0662 70.5673 172.2922 32 N 4.4081 8.9033 120.7839 56.3866 38.5687 174.6907 33 N 5.1685 8.3615 111.8064 52.2914 41.8994 174.3044 34 V 4.7393 7.8262 119.7165 61.7641 33.3245 174.1736 35 Y 5.2499 9.5642 125.7940 56.1775 41.2208 174.3163 36 L 5.2991 9.0020 124.4636 53.7217 44.8783 175.6996 37 G 4.2940 8.9360 111.7146 46.0405 0.0000 170.2687 38 N 5.4962 8.9822 117.7510 51.0982 40.1612 174.8812 39 Y 3.6789 8.6701 119.1871 60.8918 39.0301 178.1869 40 K 4.0172 8.3485 118.7184 59.7434 32.3178 177.7905 41 N 4.4183 8.9078 115.3912 56.0975 38.8347 178.1575 42 A 3.8283 7.4648 120.9075 52.1541 18.4013 178.5940 *44 D 4.4866 8.1681 120.2614 55.1362 43.3087 177.5860 45 A 3.9384 7.6605 122.9486 54.8267 18.5272 177.8726 46 P 4.2448 0.0000 0.0000 65.5751 31.3612 177.3531 47 S 4.6490 7.6357 109.2105 57.8829 63.1283 174.1237 48 S 4.3702 7.7934 115.5538 58.2566 62.6565 174.2951 49 E 4.0322 8.6638 125.4416 59.0413 29.5302 178.0386 50 V 3.4902 7.3603 119.0618 62.5638 31.7666 176.6640 51 K 4.2590 7.9695 127.6582 54.7911 30.6446 175.4167 52 F 4.4016 8.1095 120.7362 57.4230 39.9763 175.4558 53 K 4.2822 9.1280 123.8032 57.3251 34.1858 176.0888 54 Y 5.3978 8.0480 115.7889 56.0879 42.5214 174.9017 55 V 4.8619 8.8995 121.6531 61.2327 35.2750 174.2687 56 L 4.7848 8.8514 128.5587 53.9648 42.9707 175.4872 57 N 4.7073 9.3778 125.1742 52.3473 40.0910 174.8110 58 L 5.4668 8.6190 126.0161 53.3697 43.4028 177.1619 59 T 4.6162 8.7122 118.3585 61.3538 67.2792 177.3472 *61 D 4.6209 8.8185 117.7691 53.6212 41.6939 174.7588 62 K 3.9176 8.5290 125.4903 56.3040 32.9375 175.1568 63 Y 4.9494 7.4741 121.8858 55.7287 41.0924 173.6913 64 T 4.6327 8.4432 109.6185 59.6953 71.6753 173.2935 65 L 4.7076 8.1819 121.5570 52.1907 43.3956 174.8278 66 P 4.3040 0.0000 0.0000 65.2011 31.9581 177.1092 67 N 4.8569 7.6263 118.2047 50.0967 37.5909 174.1892 68 S 4.6035 7.4073 111.8212 57.2886 65.9371 173.0551 69 N 4.8144 8.5491 122.4518 53.0402 38.6437 175.1413 70 I 3.7796 7.7567 120.7960 61.6173 37.8750 175.5280 71 N 4.5966 8.9291 125.0060 52.7936 39.6104 174.4033 72 I 4.6255 8.3379 125.9005 60.0880 38.4233 175.2768 73 I 4.2367 8.9928 129.5869 60.0164 38.9600 174.5585 74 H 5.0910 8.7730 127.5610 55.2000 30.7577 174.5685 75 I 4.4021 8.4003 128.7680 58.5214 37.8892 172.1598 76 P 5.1706 0.0000 0.0000 61.9186 32.0218 175.9301 77 L 4.8175 8.3170 122.5428 52.8219 45.5335 175.9983 78 V 4.2373 8.3439 120.8903 61.5882 32.9457 176.2281 79 D 4.7979 8.4454 127.8679 52.6274 39.6278 174.4144 80 D 4.5133 7.6034 121.1633 52.3008 42.2721 175.9465 81 T 4.2876 8.3885 108.8657 62.1571 69.0255 174.8941 82 T 4.4642 8.1781 111.4304 61.6720 69.8170 174.1510 83 T 4.5252 7.7686 112.6209 60.0307 70.6195 173.4984 84 D 4.7696 8.6568 124.4832 53.7345 41.8410 175.7737 85 I 4.5547 8.9271 119.7666 60.5893 39.1087 177.6461 86 S 3.0604 8.3514 118.2202 61.1406 62.3830 176.3723 87 K 3.9057 7.8849 120.5275 59.1843 32.5171 177.7273 88 Y 4.3254 7.5883 117.5162 59.3824 38.0266 177.5255 89 F 4.7537 7.7331 119.4066 61.0376 39.2250 177.1630 90 D 4.5619 8.3398 117.7708 57.6589 40.6781 178.6346 91 D 4.4264 8.1286 118.8762 57.3716 40.9744 178.8699 92 V 3.7452 8.2047 119.1301 66.1278 31.5487 178.2381 93 T 4.0115 8.6610 109.9509 64.7801 68.6354 176.3732 94 A 4.0855 8.1391 123.5035 54.7788 18.3775 179.4207 95 F 4.0447 8.2984 119.0914 61.5284 39.5666 177.3624 96 L 3.5367 7.8909 118.5835 57.5808 41.1751 179.4225 97 S 4.3765 8.2442 114.8151 60.6654 62.2737 176.0937 98 K 3.8134 7.8004 122.2202 59.8098 31.9428 178.3533 99 C 3.8857 7.6179 116.8438 62.9895 27.8297 176.0549 100 D 4.3959 8.1374 120.3088 57.3489 40.2342 178.6195 101 Q 4.0279 8.0608 117.6972 58.8771 28.8871 178.5342 102 R 4.2730 7.9929 115.4014 54.9698 31.4386 175.8878 103 N 4.2813 7.5842 114.8480 53.7578 36.3845 175.3968 104 E 4.6610 8.5952 116.4199 53.7582 32.1506 176.2283 105 P 4.9283 0.0000 0.0000 62.6778 32.8017 176.0783 106 V 5.2842 9.3494 122.7205 60.0290 35.2609 173.8983 107 L 5.3161 8.7591 125.7148 53.3885 44.2930 175.0185 108 V 5.0645 9.1261 127.1676 60.3722 33.6988 174.6331 109 H 6.0977 9.1701 119.1718 53.2468 32.0236 171.8148 110 C 5.0732 8.6304 114.9779 58.6167 32.4564 174.4798 111 A 4.3734 9.0909 115.6804 54.8848 18.3920 179.5926 112 A 4.2290 8.2709 115.3083 52.0635 19.3915 177.6173 113 G 3.9812 8.2783 103.2043 45.8000 0.0000 174.1971 114 V 4.2760 7.8794 116.1392 63.8969 33.8125 176.7102 115 N 4.6490 7.9691 115.9483 55.6657 38.8861 177.6298 116 R 3.9503 7.9954 118.1412 59.4686 30.5861 178.9966 117 S 4.4084 8.1422 113.6964 61.2663 63.2587 176.1982 118 G 3.8338 8.2553 108.7869 47.4611 0.0000 176.1871 119 A 4.2572 7.9635 121.2883 52.3000 18.2285 179.3288 *121 I 4.2228 7.7672 123.8409 62.9940 39.3238 178.1484 122 L 4.1026 8.5554 120.9712 57.9830 41.9195 178.4407 123 A 3.3693 8.0658 120.2879 54.9997 18.2575 178.6719 124 Y 4.4579 7.8526 117.3751 60.7956 37.8647 179.6196 125 L 3.8178 7.9270 118.5484 55.0300 41.4816 179.1901 *127 S 4.6882 8.0758 115.5298 58.2916 64.7753 174.9921 128 K 4.0312 7.4047 117.7620 58.0301 32.1036 176.8809 129 N 4.4204 7.2404 114.5873 53.0120 39.3606 174.6575 130 K 4.4818 8.1278 120.9580 55.9117 34.1359 176.0654 131 E 4.2274 8.0329 119.3666 56.2923 30.1633 178.0064 132 S 4.3989 8.5553 113.9759 60.3859 63.9616 174.8441 133 L 4.7547 7.4481 119.5339 51.6937 41.9507 172.8129 134 P 4.8691 0.0000 0.0000 61.4112 32.9889 177.5142 *136 L 4.3550 8.5605 124.4305 55.2532 43.9110 177.8531 137 Y 4.2799 8.2480 118.4921 60.6693 38.5936 177.7620 138 F 4.1560 8.4557 121.1775 61.3716 39.5220 177.1212 139 L 4.0007 8.2043 118.1805 57.8889 41.4615 178.8151 140 Y 4.0759 8.4364 119.8303 60.6186 38.5788 178.1970 141 V 3.0489 7.4103 117.8421 65.9025 31.7050 176.8256 142 Y 4.0258 7.5956 118.1653 61.3326 38.8242 177.7825 143 H 4.3381 8.5019 117.4322 58.3878 28.9656 177.5784 144 S 4.7085 7.7109 117.0468 58.1488 63.3432 176.2858 *146 R 4.1224 8.0017 123.9953 57.4786 31.5662 177.0237 147 D 4.3882 8.3322 116.9730 57.1548 41.1427 177.7264 148 L 3.9922 7.6671 120.0531 58.0236 42.0994 178.1555 149 R 4.1218 7.7578 115.0670 56.6749 30.8365 177.0394 150 G 4.1087 10.3746 106.6348 45.3820 0.0000 173.1952 151 A 4.7763 7.4037 118.6951 51.3759 21.8561 175.6818 152 F 4.4399 9.9083 124.5544 58.2839 42.1191 174.5424 153 V 3.3954 8.0155 129.0996 64.2394 29.7342 173.0416 154 E 4.1029 8.0295 119.6620 58.5426 30.5032 177.3027 155 N 4.1500 8.5645 117.6454 53.1808 39.4187 173.3996 156 P 4.3089 0.0000 0.0000 65.8713 31.4480 178.3386 157 S 4.1283 8.0231 112.6279 61.0948 62.4157 175.7977 158 F 4.5991 8.7173 120.8306 60.7457 38.6801 177.6204 159 K 4.0947 8.2236 117.9761 59.6314 31.9181 179.0191 160 R 3.8997 8.3766 119.1566 59.9138 29.9411 178.5124 161 Q 4.1468 8.3515 117.5116 59.0853 28.6262 178.7933 162 I 3.9189 8.2343 120.9354 64.3249 37.0457 178.5969 163 I 3.4045 7.9828 120.7644 64.3267 36.8253 178.2287 164 E 3.9084 8.2144 119.3500 59.3672 29.0934 179.5216 165 K 3.7690 7.9637 118.2237 59.0607 32.3840 177.6328 166 Y 4.6206 8.0594 114.1817 57.7324 39.1583 175.8606 167 V 4.1957 7.4808 116.0271 64.4616 32.9319 176.3077 168 I 3.6217 7.2478 120.0683 62.6692 37.4239 175.4139 169 D 4.9130 7.9654 122.6246 52.6170 43.1981 176.6606 170 K 4.0619 8.4572 122.5584 57.4190 32.0062 175.3095 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 *-13 H 8.44 4.61 0.00 3.12 3.08 0.00 7.25 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *-12 H 8.09 4.21 0.00 3.05 2.60 0.00 7.30 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -11 S 8.94 4.43 0.00 3.90 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 -10 S 8.21 4.27 0.00 3.79 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 -9 G 8.14 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 0.00 0.00 0.00 -8 R 8.85 4.44 0.00 1.78 1.76 0.00 3.27 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.16 0.00 -7 E 7.89 4.76 0.00 1.92 1.80 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 2.13 1.86 0.00 *-3 F 8.34 4.87 0.00 2.93 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 Q 9.45 4.48 0.00 1.48 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.71 0.00 0.00 0.00 0.00 0.00 1.86 1.16 0.00 -1 G 8.18 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 *-13 H 8.44 4.61 0.00 3.12 3.08 0.00 7.25 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -11 D 8.97 4.60 0.00 2.73 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 -10 K 8.19 4.12 0.00 1.74 1.63 0.00 0.61 0.00 0.00 1.71 0.00 0.00 2.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.35 7.81 -9 K 8.10 4.39 0.00 1.52 1.06 0.00 0.61 0.00 0.00 1.74 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.32 7.81 -8 S 8.93 4.57 0.00 3.81 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 -7 L 7.63 4.75 0.00 1.48 1.46 0.92 0.70 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 7 Y 7.72 4.71 0.00 3.09 2.93 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 0.00 0.00 0.00 8 K 8.26 3.96 0.00 1.90 2.11 0.00 1.77 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.56 7.81 9 Y 8.15 4.16 0.00 3.10 3.29 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 10 L 8.16 3.75 0.00 1.88 1.79 1.21 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.10 3.98 0.00 1.67 1.73 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.03 4.10 0.00 1.89 1.68 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 13 R 7.84 3.97 0.00 1.41 1.12 0.00 2.83 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.69 0.00 14 S 7.98 4.55 0.00 3.97 3.93 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 0.00 0.00 0.00 15 T 7.67 4.49 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 1.27 0.00 0.00 16 G 7.89 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 17 D 7.72 4.56 0.00 2.61 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.38 4.59 0.00 3.33 3.35 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.48 3.91 0.00 1.81 1.91 0.00 3.25 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 21 A 8.41 4.43 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 22 K 8.67 4.71 0.00 1.64 1.68 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.59 7.81 23 S 8.71 4.39 0.00 3.78 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 24 P 0.00 4.63 0.00 2.08 2.02 0.00 3.79 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.21 0.00 25 T 8.48 4.56 4.25 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 1.22 0.00 0.00 26 I 7.11 4.41 1.91 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 1.36 0.69 0.93 0.00 0.00 *28 T 8.51 4.09 4.25 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 1.14 0.00 0.00 29 R 8.66 3.71 0.00 1.58 1.73 0.00 3.19 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.93 0.00 30 V 8.49 3.91 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 0.75 0.00 0.00 1.08 0.00 0.00 31 T 7.13 4.65 4.39 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 1.48 0.00 0.00 32 N 8.90 4.41 0.00 2.73 2.88 0.00 0.00 6.69 7.79 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 33 N 8.36 5.17 0.00 2.91 2.85 0.00 0.00 6.50 8.54 0.00 0.00 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 V 7.83 4.74 2.21 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 1.16 0.00 0.00 0.93 0.00 0.00 35 Y 9.56 5.25 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 36 L 9.00 5.30 0.00 1.67 1.60 1.09 1.22 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 37 G 8.94 4.29 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 0.00 38 N 8.98 5.50 0.00 3.15 3.10 0.00 0.00 7.06 8.40 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 39 Y 8.67 3.68 0.00 3.05 3.01 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 1.68 1.99 0.00 117 S 8.14 4.41 0.00 4.13 4.12 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 0.00 0.00 0.00 118 G 8.26 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 0.00 0.00 0.00 119 A 7.96 4.26 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 *121 I 7.77 4.22 2.27 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 1.65 1.00 1.10 0.00 0.00 122 L 8.56 4.10 0.00 1.80 1.88 1.03 1.30 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 0.00 123 A 8.07 3.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 7.85 4.46 0.00 3.06 3.22 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 0.00 125 L 7.93 3.82 0.00 1.87 1.72 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 *127 S 8.08 4.69 0.00 4.14 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 0.00 128 K 7.40 4.03 0.00 1.82 1.76 0.00 1.33 0.00 0.00 1.45 0.00 0.00 2.62 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.05 7.81 129 N 7.24 4.42 0.00 2.45 2.70 0.00 0.00 6.96 6.56 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 0.00 130 K 8.13 4.48 0.00 1.68 1.75 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.26 1.31 7.81 131 E 8.03 4.23 0.00 2.07 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 0.00 2.31 2.19 0.00 132 S 8.56 4.40 0.00 3.98 3.99 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 0.00 0.00 0.00 133 L 7.45 4.75 0.00 1.60 1.63 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.87 0.00 2.44 2.46 0.00 3.96 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 2.22 2.01 0.00 *136 L 8.56 4.35 0.00 1.92 1.95 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 8.25 4.28 0.00 3.25 3.18 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 0.00 138 F 8.46 4.16 0.00 3.35 3.15 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 0.00 139 L 8.20 4.00 0.00 2.03 1.85 1.03 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 140 Y 8.44 4.08 0.00 3.16 3.15 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 0.00 141 V 7.41 3.05 1.83 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 0.70 0.00 0.00 0.37 0.00 0.00 142 Y 7.60 4.03 0.00 2.33 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 0.00 143 H 8.50 4.34 0.00 3.21 3.21 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 S 7.71 4.71 0.00 3.69 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.00 4.12 0.00 1.48 1.94 0.00 3.12 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 147 D 8.33 4.39 0.00 2.65 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.67 3.99 0.00 1.57 1.55 0.92 0.67 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 0.00 149 R 7.76 4.12 0.00 1.82 1.99 0.00 3.24 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.43 0.00 150 G 10.37 4.11 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 0.00 0.00 0.00 151 A 7.40 4.78 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 0.00 152 F 9.91 4.44 0.00 2.71 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 0.00 153 V 8.02 3.40 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 0.93 0.00 0.00 0.18 0.00 0.00 154 E 8.03 4.10 0.00 2.01 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 2.36 2.27 0.00 155 N 8.56 4.15 0.00 2.39 2.43 0.00 0.00 6.79 7.22 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 0.00 156 P 0.00 4.31 0.00 2.29 2.28 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 157 S 8.02 4.13 0.00 3.90 3.99 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 0.00 0.00 0.00 158 F 8.72 4.60 0.00 3.27 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 0.00 159 K 8.22 4.09 0.00 2.04 1.95 0.00 1.50 0.00 0.00 1.19 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.65 7.81 160 R 8.38 3.90 0.00 2.03 2.16 0.00 3.11 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.70 0.00 161 Q 8.35 4.15 0.00 2.53 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 162 I 8.23 3.92 2.22 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 1.47 0.90 1.18 0.00 0.00 163 I 7.98 3.40 1.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.34 0.74 0.00 0.00 164 E 8.21 3.91 0.00 2.18 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 2.32 2.44 0.00 165 K 7.96 3.77 0.00 1.73 1.43 0.00 1.75 0.00 0.00 1.90 0.00 0.00 3.17 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 0.95 7.81 166 Y 8.06 4.62 0.00 3.13 3.01 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 0.00 0.00 0.00 167 V 7.48 4.20 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 0.82 0.00 0.00 0.76 0.00 0.00 168 I 7.25 3.62 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.88 0.89 0.00 0.00 169 D 7.97 4.91 0.00 2.55 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 4.06 0.00 1.80 1.67 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.47 7.81 * Residues marked with a * may have inaccurate shift predictions.