NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 36 Q 3.5213 8.3449 121.7033 54.7225 30.1469 175.0123 37 P 3.9424 0.0000 0.0000 61.6546 32.0269 175.4049 38 G 3.8036 8.9669 108.8884 44.2767 0.0000 174.2725 39 D 4.3344 8.5236 120.4958 57.2295 40.8701 178.9160 40 D 4.4278 8.0018 118.7613 57.4448 40.5634 178.3718 41 A 3.9896 7.9221 120.6453 55.2501 18.1277 179.6775 42 V 3.5315 7.8862 116.0570 65.7127 31.6758 177.5028 43 A 4.3842 7.7423 118.8446 52.3737 19.8631 178.1116 44 S 4.3943 7.2290 112.9095 56.4857 61.8387 173.4555 *46 Q 4.0932 7.7298 125.4725 56.8083 30.0558 174.5625 47 T 4.8182 8.2255 116.6702 62.4592 70.3242 173.9623 48 Y 4.7654 9.4455 124.4572 56.9818 40.3565 175.5421 49 S 4.7840 8.8555 117.0723 57.5918 65.1982 175.6625 50 V 3.6429 8.6563 118.7704 66.1841 31.1718 177.5092 51 A 4.0434 8.8389 120.9512 55.5332 17.9529 179.6805 52 Q 4.0961 8.0234 115.3263 59.1667 28.9067 178.4696 53 F 4.3504 8.2727 120.7582 61.0649 39.7390 176.7288 54 L 4.0564 8.3081 117.3986 55.7506 41.4277 178.5698 55 Q 3.9637 7.8169 121.2559 58.9137 28.9465 176.6797 56 P 4.1788 0.0000 0.0000 66.0360 30.9244 178.2251 57 F 3.9731 7.9010 116.0150 60.3585 38.8713 177.2581 58 T 4.0951 7.6802 115.1207 66.2298 68.2714 176.6833 59 L 4.3986 7.4953 120.4218 56.3845 42.2902 177.3368 60 N 4.4793 8.0089 119.4317 51.2785 40.2818 172.8343 61 P 4.2762 0.0000 0.0000 65.0505 31.6138 178.4400 62 A 3.9697 8.0092 119.5634 54.8744 18.3019 179.4746 63 K 3.7864 8.3535 117.8642 59.5039 32.3663 178.6554 64 A 3.6927 7.9188 121.4533 55.3128 17.9312 179.4344 65 S 4.2391 8.1326 111.6126 61.8093 62.2087 176.4236 66 S 4.1209 7.7637 114.2987 61.4365 62.2179 175.5837 67 D 4.4131 8.2290 120.9556 56.6419 40.7650 177.2555 68 Y 4.5879 7.9734 115.3272 56.3278 38.3267 175.1086 69 L 3.9902 7.0836 123.1111 56.8367 42.2820 177.2765 70 G 3.8533 9.1438 114.4598 45.4557 0.0000 173.0533 71 K 4.6026 8.0964 119.5636 55.0143 34.4719 175.4381 72 W 5.1812 8.7943 122.0667 55.4668 30.7208 176.1432 73 V 4.7336 8.9887 117.3341 59.3691 35.6475 174.4998 74 K 4.9288 8.8651 124.3123 54.8986 34.3793 174.7248 75 V 5.0062 8.8735 127.8187 61.0601 34.5672 173.9776 76 R 5.1110 8.3556 127.6259 54.7895 32.3206 174.8394 77 G 4.0824 8.5981 111.5000 45.9329 0.0000 171.8258 78 V 4.6087 8.3412 120.7289 61.6762 32.4660 175.7674 79 I 4.1734 8.7319 129.8153 61.7363 37.4653 176.8820 80 V 4.4383 8.9865 119.8759 61.6448 33.5114 175.4422 81 D 4.8894 7.6165 118.2272 53.9746 44.6487 174.0300 82 I 5.0957 8.2341 124.3619 59.9071 40.9849 174.7853 83 R 4.7396 8.9428 124.7653 54.6156 34.8874 173.8773 84 R 4.6646 8.6131 123.0422 54.8759 31.5336 175.4008 85 K 4.5355 8.4682 125.2165 54.1677 36.1596 175.6935 86 S 4.4869 8.5959 118.8441 58.6836 63.5243 173.8833 87 G 4.4727 8.5278 110.6970 43.5899 0.0000 172.8254 88 I 4.1309 8.3048 119.8036 60.9437 38.6845 175.5239 89 A 3.7284 9.4107 122.9321 53.5220 15.4906 178.3027 90 G 3.9064 8.0020 106.2445 45.5672 0.0000 172.9194 91 S 4.8004 7.5431 115.8161 57.5836 65.5218 172.3085 92 Y 5.1751 7.7997 116.7850 56.1941 41.1128 173.1862 93 Y 4.8398 8.4499 117.5880 56.1912 42.2802 173.1994 94 F 5.4305 9.8339 116.9027 55.8709 43.7635 174.3484 95 I 5.2032 8.8510 122.2795 59.6801 40.0227 174.6543 96 V 4.9445 9.1861 126.9200 61.5175 34.1921 174.6433 97 T 5.4880 9.1109 123.6154 60.7724 72.5729 173.0130 *99 R 4.3962 8.2020 118.2493 55.8176 31.6044 174.4514 100 D 4.7261 8.4381 119.0525 53.9535 41.8383 176.6224 101 E 3.9807 9.0130 127.0353 58.8983 29.5265 177.3896 102 Q 4.5286 8.5725 115.6560 54.9464 28.6226 175.4677 103 N 4.7656 8.3392 113.9395 54.1599 36.7245 176.6841 104 K 4.1763 7.8396 119.2349 58.9559 32.3014 177.1243 105 T 4.7154 7.2162 112.1799 60.2767 70.3750 173.0430 106 D 4.6903 8.5599 123.6853 53.4278 40.3012 176.7464 107 K 4.2700 7.9388 120.4722 56.2472 32.9083 176.3653 108 R 4.6687 8.2728 121.2489 54.7610 31.9068 175.2270 109 L 4.7684 8.4201 123.6051 53.5090 44.8921 175.1136 110 T 5.0550 7.7820 111.8937 60.0101 72.4089 172.7657 111 F 5.0280 9.5900 120.8639 55.7722 43.3532 173.4148 112 N 5.5226 8.9881 121.7979 52.2049 40.3937 173.5547 113 F 4.8804 9.5862 126.1781 55.5550 41.4883 176.6154 114 G 4.2368 8.8348 112.5905 44.9503 0.0000 174.4618 115 S 4.3219 8.4524 114.0839 61.0074 62.8846 175.4179 116 H 4.4696 8.2862 115.3430 57.1682 29.1824 174.8388 117 N 5.0779 7.9040 120.4072 52.9516 39.3422 176.2453 118 S 3.8246 8.1572 114.2845 60.6758 63.3389 174.7374 119 A 3.9115 7.9967 123.5767 55.4496 18.2253 178.8269 120 D 4.3197 7.8978 116.6398 57.4050 41.0520 179.0914 121 V 2.9886 6.7315 117.7280 65.6102 31.2086 177.7060 122 E 3.9935 8.2312 116.6488 57.8583 29.3505 177.8238 123 A 4.4949 7.0702 119.4230 51.0097 19.9313 176.7173 124 L 4.2615 7.0133 117.2715 54.1483 42.9384 176.6625 125 S 4.5316 8.0366 114.7021 56.9065 66.5850 173.9042 126 N 4.5890 8.6733 123.1665 54.8497 38.8117 176.0747 127 G 3.9637 9.2722 111.9203 45.0531 0.0000 173.5722 128 S 4.7132 7.7410 115.9835 56.9512 64.9678 173.9985 129 V 4.2409 8.3299 123.1248 63.2499 32.0623 174.9250 130 A 4.8406 9.2617 128.3993 50.5846 23.4936 174.7131 131 T 5.0630 8.3851 114.8025 61.9042 71.9166 173.2554 132 I 4.9055 8.9281 127.5541 59.3685 40.8468 174.7370 133 V 4.7172 8.8440 127.0670 61.9135 33.2690 174.9460 134 G 4.6360 9.3574 113.6127 45.2480 0.0000 170.7319 135 Q 4.4785 8.4201 121.3857 53.7209 31.5493 174.4852 136 V 4.1162 8.3595 126.7719 62.8529 32.7886 175.0907 137 H 4.9612 8.3735 125.4221 53.7124 31.7769 173.8096 138 Q 3.8846 8.5251 120.4771 56.5415 29.0430 175.7469 139 V 4.0169 8.0935 125.7993 61.9437 31.3366 175.0235 140 Q 4.5598 7.8591 125.3874 55.1729 32.4537 174.9909 141 D 4.8366 8.8061 117.7604 54.8985 38.4602 173.2702 142 S 4.5077 7.2209 110.9346 58.3554 65.5298 175.0158 143 T 4.5471 8.4519 111.6192 61.1907 69.6244 174.1685 144 I 4.1937 7.3068 122.7997 58.6684 39.9004 173.2131 145 P 4.3805 0.0000 0.0000 62.7112 33.2066 175.0573 146 T 4.7053 7.8771 117.7842 60.9989 69.7485 174.6397 147 L 4.0918 8.1885 127.4616 54.8178 43.0067 176.6062 148 Q 4.6136 8.7034 120.9948 53.2643 32.2878 174.9322 149 N 4.1648 8.2063 115.6215 53.7777 36.0520 172.3009 150 P 5.0069 0.0000 0.0000 62.0560 33.8568 176.8062 151 K 4.8044 8.9062 121.3153 54.6664 35.5451 175.2295 152 V 4.0525 9.1606 128.4347 62.6702 32.2950 175.4295 153 V 4.0296 8.5913 129.2394 61.6091 31.9386 176.0322 154 K 4.1583 8.5334 126.7038 56.7354 32.0584 177.0555 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 36 Q 8.34 3.52 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 1.98 1.86 0.00 37 P 0.00 3.94 0.00 1.83 1.68 0.00 2.43 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.21 0.00 38 G 8.97 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 0.00 0.00 0.00 39 D 8.52 4.33 0.00 2.63 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 40 D 8.00 4.43 0.00 2.73 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.92 3.99 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 V 7.89 3.53 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 0.83 0.00 0.00 0.89 0.00 0.00 43 A 7.74 4.38 1.33 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 0.00 0.00 44 S 7.23 4.39 0.00 4.00 3.90 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 0.00 0.00 0.00 *46 Q 7.73 4.09 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 47 T 8.23 4.82 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 1.28 0.00 0.00 48 Y 9.45 4.77 0.00 2.97 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 49 S 8.86 4.78 0.00 4.16 4.08 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 50 V 8.66 3.64 2.16 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 1.18 0.00 0.00 1.13 0.00 0.00 51 A 8.84 4.04 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 52 Q 8.02 4.10 0.00 2.49 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.93 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 53 F 8.27 4.35 0.00 2.49 2.96 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 54 L 8.31 4.06 0.00 1.72 1.64 0.87 0.62 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 55 Q 7.82 3.96 0.00 2.32 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 56 P 0.00 4.18 0.00 2.02 2.24 0.00 3.84 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.18 0.00 57 F 7.90 3.97 0.00 3.01 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 58 T 7.68 4.10 4.44 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 1.22 0.00 0.00 59 L 7.50 4.40 0.00 1.68 1.68 0.92 0.90 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 60 N 8.01 4.48 0.00 2.63 2.59 0.00 0.00 7.30 7.36 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 61 P 0.00 4.28 0.00 2.27 2.45 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 2.14 2.30 0.00 62 A 8.01 3.97 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.35 3.79 0.00 1.80 1.73 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.38 7.81 64 A 7.92 3.69 0.13 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 0.00 0.00 0.00 65 S 8.13 4.24 0.00 4.09 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 0.00 66 S 7.76 4.12 0.00 3.93 4.04 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 0.00 0.00 0.00 67 D 8.23 4.41 0.00 2.66 2.48 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 68 Y 7.97 4.59 0.00 3.26 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 69 L 7.08 3.99 0.00 1.74 1.62 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 70 G 9.14 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 71 K 8.10 4.60 0.00 2.06 1.91 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.47 7.81 72 W 8.79 5.18 0.00 3.22 3.20 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 73 V 8.99 4.73 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 0.77 0.00 0.00 0.28 0.00 0.00 74 K 8.87 4.93 0.00 1.90 1.94 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.45 7.81 75 V 8.87 5.01 2.23 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 1.05 0.00 0.00 0.56 0.00 0.00 76 R 8.36 5.11 0.00 1.89 1.82 0.00 3.38 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 77 G 8.60 4.08 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 0.00 0.00 0.00 78 V 8.34 4.61 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 0.83 0.00 0.00 0.95 0.00 0.00 79 I 8.73 4.17 2.00 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 1.34 0.64 0.95 0.00 0.00 80 V 8.99 4.44 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 0.72 0.00 0.00 0.99 0.00 0.00 81 D 7.62 4.89 0.00 2.79 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 82 I 8.23 5.10 1.85 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 1.30 0.96 0.84 0.00 0.00 83 R 8.94 4.74 0.00 1.78 1.73 0.00 3.13 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 84 R 8.61 4.66 0.00 1.87 1.73 0.00 3.00 0.00 0.00 3.03 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.00 0.00 85 K 8.47 4.54 0.00 0.79 1.23 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.12 1.02 7.81 86 S 8.60 4.49 0.00 3.75 3.81 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 87 G 8.53 4.47 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 0.00 0.00 0.00 88 I 8.30 4.13 1.88 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 1.37 0.69 0.92 0.00 0.00 89 A 9.41 3.73 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 90 G 8.00 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 0.00 0.00 0.00 91 S 7.54 4.80 0.00 3.85 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 92 Y 7.80 5.18 0.00 2.83 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 93 Y 8.45 4.84 0.00 3.22 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 94 F 9.83 5.43 0.00 3.07 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 95 I 8.85 5.20 1.99 0.00 0.00 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 1.34 1.71 1.05 0.00 0.00 96 V 9.19 4.94 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 1.04 0.00 0.00 0.84 0.00 0.00 97 T 9.11 5.49 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 *99 R 8.20 4.40 0.00 1.94 2.14 0.00 3.14 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 100 D 8.44 4.73 0.00 2.82 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 0.00 101 E 9.01 3.98 0.00 2.00 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 2.32 2.37 0.00 102 Q 8.57 4.53 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 103 N 8.34 4.77 0.00 2.93 2.88 0.00 0.00 7.03 6.99 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 0.00 104 K 7.84 4.18 0.00 1.75 1.91 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.56 7.81 105 T 7.22 4.72 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 1.28 0.00 0.00 106 D 8.56 4.69 0.00 2.81 2.77 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 0.00 107 K 7.94 4.27 0.00 1.77 1.75 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.41 7.81 108 R 8.27 4.67 0.00 1.69 1.87 0.00 3.36 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 109 L 8.42 4.77 0.00 1.73 1.52 0.77 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.78 5.06 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 1.24 0.00 0.00 111 F 9.59 5.03 0.00 3.06 2.74 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 0.00 112 N 8.99 5.52 0.00 2.75 2.68 0.00 0.00 7.09 6.54 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 0.00 113 F 9.59 4.88 0.00 3.21 3.04 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 0.00 0.00 0.00 114 G 8.83 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 0.00 115 S 8.45 4.32 0.00 3.32 2.90 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 0.00 0.00 0.00 116 H 8.29 4.47 0.00 3.32 3.51 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 0.00 117 N 7.90 5.08 0.00 2.77 2.95 0.00 0.00 6.79 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 0.00 118 S 8.16 3.82 0.00 4.12 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 0.00 119 A 8.00 3.91 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 0.00 120 D 7.90 4.32 0.00 2.94 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 0.00 121 V 6.73 2.99 1.11 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 0.42 0.00 0.00 -0.26 0.00 0.00 122 E 8.23 3.99 0.00 1.87 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 2.26 0.00 123 A 7.07 4.49 1.23 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 0.00 124 L 7.01 4.26 0.00 1.64 1.52 0.66 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 125 S 8.04 4.53 0.00 3.79 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 0.00 126 N 8.67 4.59 0.00 2.74 2.74 0.00 0.00 7.28 7.80 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 0.00 127 G 9.27 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 0.00 0.00 0.00 128 S 7.74 4.71 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 0.00 129 V 8.33 4.24 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 0.76 0.00 0.00 0.99 0.00 0.00 130 A 9.26 4.84 1.13 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 0.00 0.00 0.00 131 T 8.39 5.06 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 1.24 0.00 0.00 132 I 8.93 4.91 1.18 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.51 0.63 0.00 0.00 133 V 8.84 4.72 2.16 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 1.27 0.00 0.00 0.97 0.00 0.00 134 G 9.36 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 0.00 0.00 0.00 0.00 135 Q 8.42 4.48 0.00 0.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.89 0.00 0.00 0.00 0.00 0.00 1.78 1.21 0.00 136 V 8.36 4.12 2.37 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 1.02 0.00 0.00 0.98 0.00 0.00 137 H 8.37 4.96 0.00 2.94 3.16 0.00 5.78 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Q 8.53 3.88 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.96 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 139 V 8.09 4.02 2.16 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 0.85 0.00 0.00 0.91 0.00 0.00 140 Q 7.86 4.56 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.28 6.14 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 141 D 8.81 4.84 0.00 2.81 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 0.00 142 S 7.22 4.51 0.00 3.57 3.64 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 0.00 143 T 8.45 4.55 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 1.21 0.00 0.00 144 I 7.31 4.19 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.60 0.72 0.00 0.00 145 P 0.00 4.38 0.00 1.86 1.82 0.00 2.87 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.86 0.00 146 T 7.88 4.71 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 1.16 0.00 0.00 147 L 8.19 4.09 0.00 1.04 1.33 0.30 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 148 Q 8.70 4.61 0.00 1.42 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.15 0.00 0.00 0.00 0.00 0.00 1.92 1.82 0.00 149 N 8.21 4.16 0.00 2.96 3.06 0.00 0.00 6.91 8.02 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 0.00 150 P 0.00 5.01 0.00 1.38 1.97 0.00 3.29 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.51 0.00 151 K 8.91 4.80 0.00 1.91 1.65 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.23 7.81 152 V 9.16 4.05 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 0.72 0.00 0.00 0.96 0.00 0.00 153 V 8.59 4.03 2.23 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 0.81 0.00 0.00 0.94 0.00 0.00 154 K 8.53 4.16 0.00 1.77 1.69 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.36 7.81 * Residues marked with a * may have inaccurate shift predictions.