NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.3787 8.3033 120.2314 56.2927 32.0083 177.7127 5 K 3.7733 8.1014 118.3237 58.4098 31.9417 177.3044 6 L 3.9203 8.6477 121.4128 58.2160 42.3590 178.5973 7 K 3.9110 8.0666 116.2364 59.6139 32.0727 178.7267 8 A 4.0986 8.2277 120.1728 54.9045 18.3301 179.2546 9 A 4.0259 7.9968 119.0548 54.1768 18.7739 178.4285 10 L 3.9581 6.9436 116.0879 54.1356 42.2199 175.5647 11 P 4.2701 0.0000 0.0000 62.5257 32.0489 175.7023 12 E 4.1539 7.9260 116.2016 57.5832 29.7585 176.8818 13 Y 4.4897 6.8248 115.0108 57.1641 38.8157 175.3918 14 A 4.8375 7.2381 124.0229 51.6634 20.0067 178.6957 15 K 3.9349 8.3526 121.8436 61.2239 32.0641 178.3452 16 D 4.3618 8.0976 118.5592 57.6597 40.7872 178.8758 17 I 3.7723 7.7221 119.6164 64.0347 37.1226 178.2893 18 K 3.8881 7.9797 120.5820 59.4473 32.0189 178.7117 19 L 3.9623 8.1534 120.8331 58.1083 41.9212 178.4871 20 N 4.2627 8.5595 116.9393 56.3931 38.5460 177.0199 21 L 3.8872 8.0690 121.5770 58.2343 41.8376 179.1101 22 S 4.1058 7.6117 114.0993 61.6383 63.0911 176.3497 23 S 4.2474 8.3051 116.9357 61.6990 62.4296 176.3829 24 I 3.6749 7.8580 121.5647 63.7011 37.8155 177.1788 25 T 3.9130 7.5763 111.5837 63.0681 67.3093 174.6658 26 R 4.6878 7.2682 118.9845 56.1989 30.9946 175.9471 27 S 4.2793 8.1057 112.2449 58.4433 62.9199 173.6752 28 S 4.6788 8.3901 119.4557 58.4056 64.3155 175.4910 29 V 3.7357 7.7044 121.1578 65.0129 31.4805 175.9308 30 L 4.7217 7.5821 118.2952 52.7859 43.6133 176.4913 31 D 4.7468 8.3693 122.6569 52.7166 41.9306 177.2458 32 Q 4.1967 8.8191 118.6728 59.4469 28.5364 179.4256 33 E 4.1278 8.4097 119.4270 59.4613 30.0738 178.2662 34 Q 4.3054 9.0376 118.5652 59.2186 28.8774 179.1026 35 L 3.8562 8.7253 121.2617 58.1901 42.1207 179.1076 36 W 4.0330 8.3570 118.7664 59.1746 28.8944 178.9777 37 G 2.4633 8.4232 106.2199 47.3093 0.0000 176.1095 38 T 3.8602 7.6852 117.4485 66.5499 68.4949 176.7788 39 L 3.8462 7.6855 120.8405 57.6100 41.4770 179.5442 40 L 3.8588 8.0849 120.2028 58.0672 42.0911 178.8108 41 A 3.8634 7.8561 120.9473 55.1424 18.2175 179.7718 42 S 3.9850 8.4016 113.7921 61.6788 62.7239 176.6644 43 A 3.9438 7.9095 121.9288 55.3065 18.4094 179.2661 44 A 4.0387 8.2463 119.0915 55.1507 18.2296 179.5627 45 A 4.0956 7.8975 118.2540 54.5941 18.5352 179.1711 46 T 3.9920 7.4692 106.7007 62.1658 69.2806 176.0270 47 R 3.7699 7.6184 118.8681 56.4574 29.0406 175.5313 48 N 4.6132 7.9024 118.5041 51.8214 38.8993 173.6983 49 P 4.2856 0.0000 0.0000 66.0451 31.4319 178.1320 50 Q 3.9641 8.0321 118.8699 58.8961 28.9238 178.2288 51 V 3.6309 7.6847 119.0142 65.6230 31.6448 177.6564 52 L 3.8999 7.8345 119.5947 57.9285 41.8949 178.5797 53 A 3.9754 8.0510 120.6612 55.4090 18.4315 179.2666 54 D 4.3054 7.9703 116.6818 57.7525 40.9802 179.3420 55 I 4.0267 8.1419 120.5844 64.3914 36.6225 178.8511 56 G 3.7703 8.8047 106.6533 47.4117 0.0000 175.5879 57 A 3.9847 7.8742 122.6862 55.2123 18.6782 179.0407 58 E 3.8098 8.2224 116.9675 59.0365 29.6723 178.9457 59 A 3.5586 8.3433 121.7040 55.1735 17.9966 179.5001 60 T 3.8524 7.4902 107.1000 65.0402 68.2149 175.4084 61 D 4.6781 7.2623 118.9023 54.6028 40.8002 176.5945 62 H 4.7898 8.1290 114.3230 55.5638 34.2516 173.5818 63 L 4.8739 7.1882 118.1975 52.4712 44.3507 177.0473 64 S 4.4909 8.4100 116.7479 57.4634 65.5771 175.0647 65 A 3.9433 8.5973 124.6349 55.7212 18.0518 180.0493 66 A 3.9530 8.0279 118.2122 55.1340 18.4807 179.6497 67 A 4.1685 8.1683 119.3508 55.4310 18.4411 179.5966 68 R 3.7945 8.5984 117.6109 60.2339 30.0683 178.4332 69 H 4.2479 8.6303 115.5812 58.6490 28.6903 177.5776 70 A 4.3853 8.3057 122.4458 54.6850 18.3293 179.6619 71 A 3.9326 8.1531 119.7100 55.4046 18.3882 179.9261 72 L 4.0701 7.7890 117.6764 57.7458 41.6914 179.9489 73 G 3.7335 8.4735 105.4512 47.3049 0.0000 175.8115 74 A 4.0840 8.0828 122.5107 54.9563 18.4325 179.1072 75 A 4.0583 7.8312 118.0764 55.2214 18.5298 179.3976 76 A 4.1614 7.9058 117.8860 55.2424 18.7963 181.3288 77 I 4.1505 7.7454 117.6217 61.3332 37.4571 177.3513 *79 G 3.7892 7.8778 106.0204 45.6586 0.0000 173.9133 *81 N 4.9608 8.0064 118.4150 53.2627 40.3797 176.5692 82 N 4.4142 8.1589 114.8124 55.8519 38.4878 177.4293 83 V 3.6299 7.6861 119.3574 65.6012 31.9367 177.3101 84 F 3.9713 8.0914 119.8032 61.7290 39.1627 176.4883 85 Y 3.7272 8.0267 116.1471 60.7735 37.6498 178.7503 86 R 3.6016 7.4758 119.7573 59.1885 29.9382 178.8319 87 G 3.3628 7.4768 104.1947 47.6109 0.0000 175.1904 88 R 3.9373 7.6365 121.3450 59.1253 29.8764 178.8562 89 G 3.6065 8.0621 105.5613 47.8446 0.0000 175.6781 90 F 4.6822 7.9057 119.0426 59.5978 39.1417 176.1537 91 L 4.6330 7.9293 118.4637 54.8117 42.9694 176.3537 92 E 3.8161 8.9179 115.5192 57.5591 27.8580 176.6453 93 G 4.4898 8.1920 104.1964 46.2842 0.0000 175.8575 94 R 4.1467 8.2496 118.9726 58.9152 30.3317 176.9785 95 Y 4.5997 7.9888 113.3462 57.7047 38.7166 177.1558 96 D 4.5126 8.6893 123.5556 56.9893 40.9593 177.5557 97 D 4.7247 8.0468 116.2656 53.8708 39.7885 176.6546 98 L 4.1897 7.6933 119.1736 54.2174 42.3378 172.5135 99 R 3.9215 8.2367 127.0506 54.7154 29.7472 173.4355 100 P 4.2207 0.0000 0.0000 65.8774 31.0304 178.3215 101 G 3.8135 7.9614 104.9958 45.8332 0.0000 172.7152 102 L 4.5068 7.5903 118.8725 52.2617 43.4045 176.9323 103 R 4.2133 8.3836 123.1554 56.5929 30.9039 177.2007 104 M 4.6227 8.0613 117.9386 53.5381 30.1664 176.1922 105 N 4.3206 8.3159 119.8059 57.3884 39.6690 176.1183 106 I 3.7376 7.7822 118.0250 63.9357 38.3315 177.7660 107 I 3.2015 7.4221 120.3980 64.1897 37.2459 177.8906 108 A 4.3049 7.2062 119.3216 50.4472 18.8090 176.9184 109 N 4.8798 7.2821 130.0644 54.3894 40.7684 172.1834 110 P 4.8512 0.0000 0.0000 62.2513 31.2014 178.4599 111 G 4.0961 8.7463 103.2457 44.3482 0.0000 170.8787 112 I 4.6627 7.4621 111.8447 57.4284 40.9072 173.0432 113 P 4.2155 0.0000 0.0000 62.8474 31.4914 176.5984 114 K 3.7774 9.0645 123.7653 59.9131 31.9261 177.9326 115 A 3.8878 8.1122 120.0396 55.6490 18.0454 179.2870 116 N 3.6876 8.0695 114.5688 56.0041 38.4651 177.4654 117 F 3.7090 7.6609 121.5090 61.2238 39.5004 176.8823 118 E 3.9167 8.4590 118.5777 59.1357 29.2126 179.1021 119 L 3.8787 7.3338 120.1229 57.8736 42.1084 179.1563 120 W 4.4118 7.6464 118.9521 59.9881 29.0143 178.8152 121 S 4.0158 8.1103 115.3433 61.2399 62.2220 176.6297 122 F 4.1296 8.3369 123.4039 61.2315 39.2332 177.0909 123 A 3.9198 8.3672 120.4876 55.1778 18.1035 179.8354 124 V 3.5288 7.9938 116.8284 66.2134 31.6060 178.4762 125 S 4.5468 8.4605 115.9782 60.7657 62.3157 176.6637 126 A 3.7936 7.2826 122.7633 55.0649 18.1852 179.4300 127 I 3.7608 7.2289 116.7027 64.6239 37.2900 178.2081 128 N 4.5228 8.3651 116.1944 53.6634 38.9540 175.0020 129 G 3.5511 7.9132 107.6634 47.2689 0.0000 174.5456 130 C 4.5317 7.6726 119.7373 57.0720 33.1423 172.6355 131 S 4.0488 8.4554 124.4847 61.7694 62.7285 175.3707 132 H 3.9227 8.2679 121.8291 59.3589 29.3803 176.7212 133 C 4.0879 8.0476 117.6501 62.4046 28.0731 175.6153 134 L 3.9180 8.1393 122.4772 58.0372 41.6242 179.5235 135 V 3.5881 8.1870 119.2217 64.7320 31.4354 177.8333 136 A 3.7927 7.7941 122.0408 55.2852 18.0930 179.4571 137 H 4.3930 8.3546 114.5156 58.8269 28.7441 177.7604 138 E 3.8398 8.5814 121.3231 59.5134 29.4314 178.5307 139 H 4.1855 8.6202 116.6166 59.2758 28.7533 177.8039 140 T 3.8601 7.9367 117.3632 66.5910 68.2037 176.3391 141 L 3.9056 8.0620 120.9308 58.0633 41.7125 179.8804 142 R 4.0301 7.9215 117.5230 59.7708 29.8189 179.2876 143 T 3.9339 8.0335 114.4217 66.0622 68.3741 175.7873 144 V 4.3003 7.6564 112.8111 61.0212 32.4845 176.9043 145 G 3.8464 7.8224 105.3862 45.8480 0.0000 174.3959 146 V 3.8538 7.8151 120.2267 61.7145 32.3839 176.3039 147 D 4.5688 8.4454 127.3547 52.9842 41.5733 177.6930 148 R 3.9485 8.5490 118.6401 59.2432 29.2616 178.7289 149 E 3.9688 8.1935 119.8946 59.1777 29.8268 178.3943 150 A 4.0273 8.5375 121.2511 55.0541 18.4655 179.6912 151 I 3.3780 7.7765 118.3582 64.4176 37.0814 178.3190 152 F 4.2629 8.6784 121.9233 61.4619 39.1081 176.7459 153 E 3.8489 8.3471 118.6787 59.1563 29.2917 178.7208 154 A 4.0276 7.9265 120.8138 54.8055 18.4647 179.3683 155 L 3.9116 8.1252 118.9422 58.2149 42.1302 179.3028 156 K 3.7320 8.0226 118.3697 59.3578 31.8946 179.1310 157 A 3.8667 8.1125 120.7833 55.1093 18.2960 179.4726 158 A 4.2455 8.4695 120.5821 54.6402 18.4160 179.7644 159 A 3.8482 7.9546 119.1577 55.2784 18.4105 179.7458 160 I 3.5836 7.9211 118.7044 64.7500 37.2005 178.8337 161 V 3.5363 7.9910 119.1389 66.0048 31.2824 177.9976 162 S 4.1612 8.0888 113.1927 61.1839 62.1334 176.4054 163 G 3.5850 8.1502 108.5854 47.6975 0.0000 175.8387 164 V 3.5623 8.1603 120.9123 65.7511 31.5595 178.0258 165 A 3.9697 8.1939 120.6030 55.0230 18.1744 179.4954 166 Q 3.8697 8.2503 117.8978 59.2994 29.0869 178.1395 167 A 4.0959 8.2432 122.0936 55.1740 18.4255 179.4288 168 L 3.8967 8.2641 118.7667 58.0794 42.1734 178.8542 169 A 4.0331 8.1069 121.0659 55.3313 18.3566 179.7201 170 T 3.8217 7.9502 108.3886 65.1113 68.6921 176.8189 171 I 3.8233 7.6285 116.8461 63.5101 37.2692 178.0239 172 E 3.8733 8.1562 119.3935 58.9938 29.4041 178.6673 173 A 4.2716 8.0108 119.2426 53.4818 18.5730 177.9774 174 L 4.6187 7.3981 115.9456 54.5874 42.2445 176.8336 175 S 4.3996 7.5466 120.9025 58.7599 62.8710 174.0769 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 4 E 8.30 4.38 0.00 2.02 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 0.00 2.32 2.30 0.00 5 K 8.10 3.77 0.00 1.88 1.86 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.56 7.81 6 L 8.65 3.92 0.00 1.93 1.68 0.98 0.45 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 7 K 8.07 3.91 0.00 1.92 1.86 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.53 7.81 8 A 8.23 4.10 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 9 A 8.00 4.03 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 10 L 6.94 3.96 0.00 1.67 1.55 0.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.27 0.00 0.49 1.50 0.00 3.62 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.68 0.00 12 E 7.93 4.15 0.00 1.92 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 2.16 2.18 0.00 13 Y 6.82 4.49 0.00 3.03 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 14 A 7.24 4.84 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 15 K 8.35 3.93 0.00 1.81 1.87 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.66 7.81 16 D 8.10 4.36 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.72 3.77 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.59 0.88 0.00 0.00 18 K 7.98 3.89 0.00 1.80 2.00 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 19 L 8.15 3.96 0.00 1.70 1.78 0.92 0.97 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 20 N 8.56 4.26 0.00 2.93 2.82 0.00 0.00 6.66 6.50 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 21 L 8.07 3.89 0.00 1.83 1.84 0.86 0.69 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 22 S 7.61 4.11 0.00 4.07 3.91 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 0.00 0.00 0.00 23 S 8.31 4.25 0.00 4.03 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 24 I 7.86 3.67 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.55 0.84 0.00 0.00 25 T 7.58 3.91 4.13 0.00 0.00 0.00 0.00 0.00 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 26 R 7.27 4.69 0.00 1.80 1.91 0.00 3.24 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 27 S 8.11 4.28 0.00 3.93 3.76 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 28 S 8.39 4.68 0.00 4.01 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 0.00 29 V 7.70 3.74 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 0.85 0.00 0.00 1.00 0.00 0.00 30 L 7.58 4.72 0.00 1.66 1.58 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.37 4.75 0.00 3.01 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 Q 8.82 4.20 0.00 2.23 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.97 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 33 E 8.41 4.13 0.00 2.20 2.22 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 2.86 2.72 0.00 34 Q 9.04 4.31 0.00 2.52 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 35 L 8.73 3.86 0.00 1.67 1.71 0.63 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 36 W 8.36 4.03 0.00 3.64 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 37 G 8.42 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.69 3.86 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 1.24 0.00 0.00 39 L 7.69 3.85 0.00 1.53 1.48 -0.38 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.08 3.86 0.00 1.78 1.61 0.90 1.20 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 41 A 7.86 3.86 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 42 S 8.40 3.98 0.00 3.97 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 43 A 7.91 3.94 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 44 A 8.25 4.04 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 45 A 7.90 4.10 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 46 T 7.47 3.99 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 1.32 0.00 0.00 47 R 7.62 3.77 0.00 1.99 2.11 0.00 3.20 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 48 N 7.90 4.61 0.00 2.82 2.71 0.00 0.00 6.89 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.29 0.00 2.30 2.29 0.00 3.75 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 2.07 2.02 0.00 50 Q 8.03 3.96 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.96 0.00 0.00 0.00 0.00 0.00 2.71 2.48 0.00 51 V 7.68 3.63 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 1.05 0.00 0.00 0.93 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 1.21 0.00 0.00 61 D 7.26 4.68 0.00 2.51 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.13 4.79 0.00 2.77 3.20 0.00 5.79 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.19 4.87 0.00 1.74 1.56 0.84 0.94 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 64 S 8.41 4.49 0.00 4.08 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 65 A 8.60 3.94 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 66 A 8.03 3.95 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 67 A 8.17 4.17 1.62 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 0.00 0.00 68 R 8.60 3.79 0.00 2.08 2.15 0.00 3.12 0.00 0.00 3.19 7.56 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 0.00 129 G 7.91 3.55 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 0.00 0.00 0.00 130 C 7.67 4.53 0.00 3.10 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 0.00 131 S 8.46 4.05 0.00 4.09 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 0.00 132 H 8.27 3.92 0.00 3.17 3.32 0.00 5.67 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 0.00 133 C 8.05 4.09 0.00 3.06 3.07 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 0.00 134 L 8.14 3.92 0.00 1.74 1.73 0.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.19 3.59 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 0.86 0.00 0.00 0.72 0.00 0.00 136 A 7.79 3.79 1.10 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 0.00 137 H 8.35 4.39 0.00 3.44 3.48 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.58 3.84 0.00 2.50 2.22 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 2.22 2.68 0.00 139 H 8.62 4.19 0.00 3.34 3.31 0.00 5.70 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 0.00 140 T 7.94 3.86 4.52 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 1.26 0.00 0.00 141 L 8.06 3.91 0.00 1.75 1.61 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 142 R 7.92 4.03 0.00 2.00 1.94 0.00 3.10 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 143 T 8.03 3.93 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 1.20 0.00 0.00 144 V 7.66 4.30 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 0.76 0.00 0.00 1.01 0.00 0.00 145 G 7.82 3.85 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 0.00 0.00 0.00 146 V 7.82 3.85 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 0.73 0.00 0.00 0.88 0.00 0.00 147 D 8.45 4.57 0.00 2.97 2.75 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 0.00 148 R 8.55 3.95 0.00 2.04 2.21 0.00 2.89 0.00 0.00 3.21 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 149 E 8.19 3.97 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 2.43 2.38 0.00 150 A 8.54 4.03 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 0.00 151 I 7.78 3.38 1.76 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 1.08 0.76 0.26 0.00 0.00 152 F 8.68 4.26 0.00 3.18 3.25 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 0.00 153 E 8.35 3.85 0.00 2.34 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 0.00 2.30 2.35 0.00 154 A 7.93 4.03 1.54 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 0.00 0.00 155 L 8.13 3.91 0.00 2.09 1.80 0.78 0.58 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 0.00 156 K 8.02 3.73 0.00 1.84 1.70 0.00 1.45 0.00 0.00 1.41 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.15 0.85 7.81 157 A 8.11 3.87 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 0.00 158 A 8.47 4.25 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 0.00 159 A 7.95 3.85 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 0.00 160 I 7.92 3.58 1.94 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 1.56 0.90 0.84 0.00 0.00 161 V 7.99 3.54 2.19 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 0.98 0.00 0.00 0.89 0.00 0.00 162 S 8.09 4.16 0.00 4.03 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 0.00 163 G 8.15 3.58 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 0.00 164 V 8.16 3.56 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 1.06 0.00 0.00 0.97 0.00 0.00 165 A 8.19 3.97 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 0.00 166 Q 8.25 3.87 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 167 A 8.24 4.10 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 0.00 168 L 8.26 3.90 0.00 1.91 1.67 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 169 A 8.11 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.95 3.82 4.30 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 1.30 0.00 0.00 171 I 7.63 3.82 1.88 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 1.80 0.85 0.96 0.00 0.00 172 E 8.16 3.87 0.00 1.99 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 2.35 2.59 0.00 173 A 8.01 4.27 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 0.00 174 L 7.40 4.62 0.00 1.81 1.69 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 175 S 7.55 4.40 0.00 3.95 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 * Residues marked with a * may have inaccurate shift predictions.