NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 G 4.0607 8.2127 108.0145 46.2686 0.0000 171.6980 25 K 5.4203 8.8217 120.7781 54.5939 34.1563 175.3579 26 L 5.4459 9.4688 125.9759 53.1798 47.3429 174.9351 27 L 5.1435 8.3368 119.2674 53.5170 44.5250 175.6380 28 F 4.7388 9.3167 123.9678 56.7658 40.3697 175.1958 29 L 4.3227 9.1247 122.8717 52.3585 46.4304 175.1899 30 G 3.7137 8.6735 106.5317 42.8083 0.0000 172.7290 31 L 4.2605 7.9497 121.4884 54.4726 42.1827 176.2511 32 D 4.5446 8.4101 119.4014 54.4543 40.0366 176.2619 33 N 4.5384 9.0745 120.3379 53.2867 37.8931 174.7134 34 A 4.1143 7.5882 118.9193 57.1830 18.3899 178.1478 35 G 3.3064 8.3064 106.7837 45.2040 0.0000 175.7265 36 K 4.0614 8.3720 122.7205 59.6832 32.4446 179.5455 37 T 3.9338 7.8415 114.6351 66.1607 68.4678 177.0459 38 T 3.8184 7.8933 117.4506 66.5886 68.5049 175.8444 39 L 3.7616 7.6157 121.6741 58.0231 41.9588 178.3445 40 L 3.6631 7.2313 118.7392 58.6822 42.0958 178.1767 41 H 4.0302 8.6611 117.9034 59.6381 29.8433 176.5543 42 M 4.0972 8.1298 121.3261 57.8358 31.6815 177.7482 43 L 4.1644 7.6262 116.9736 55.6453 42.1827 177.9279 44 K 4.2541 8.3383 119.0933 57.2395 32.4946 176.4990 45 N 4.8185 7.6304 113.0373 51.9080 39.7298 173.7778 46 D 5.1359 8.1339 114.7646 53.6863 39.8957 172.9392 47 R 4.6563 7.4275 113.4668 53.5230 33.2155 175.3677 48 L 4.0877 8.2063 122.3050 54.1439 43.1590 175.8614 49 A 4.2175 7.6001 121.5299 52.1305 21.1125 176.5630 50 T 4.2784 8.4500 118.6140 60.5476 66.5952 174.0710 51 L 4.4555 7.9142 129.0032 53.4198 44.0829 176.0846 52 Q 4.5639 8.1559 116.5060 53.8639 30.8064 173.0866 53 P 4.1724 0.0000 0.0000 63.1534 31.4418 176.7203 54 T 4.0195 8.5569 119.9907 64.0958 69.0366 173.0182 55 W 4.9393 8.9188 133.1364 58.9515 32.2774 175.5251 56 H 5.0610 7.8718 113.4466 52.7184 31.2198 171.8940 57 P 4.3508 0.0000 0.0000 63.7112 31.7985 175.4113 58 T 4.8659 8.6330 111.7234 60.1396 72.6644 172.5376 59 S 4.7520 7.8912 114.3575 57.2846 65.7429 173.0063 60 E 4.4875 8.1701 119.3765 54.7698 34.2892 174.4817 61 E 4.6547 8.2753 123.5248 54.6680 27.6589 175.0138 62 L 4.1956 7.9498 122.7150 54.4379 43.6840 176.3540 63 A 4.8864 8.6138 124.1726 50.3629 20.8603 176.1761 64 I 4.2781 8.4081 122.4415 62.6919 39.4809 176.2720 65 G 3.9164 8.8110 114.8444 44.6849 0.0000 171.5477 66 N 4.8748 8.4445 116.9641 53.5368 38.8592 174.9601 67 I 4.3575 7.4123 117.7156 59.3115 40.8862 174.3019 68 K 4.4826 8.1765 123.8457 55.0917 33.2035 175.9530 69 F 5.6256 8.8125 125.1313 55.3073 40.7990 176.4264 70 T 4.4057 8.7494 122.3079 63.6526 68.1354 174.0529 71 T 5.1943 8.4680 116.9947 60.2501 72.1486 173.9707 72 F 4.7556 8.9175 120.5426 55.8830 42.2375 173.4913 73 D 5.1737 8.4922 124.5872 52.6171 42.9230 175.1395 74 L 5.1235 7.7656 122.5727 53.3677 44.0695 176.2990 75 G 4.0604 9.0421 108.2868 46.3296 0.0000 173.6302 76 G 4.3883 8.6619 107.9212 44.9360 0.0000 173.4006 77 H 4.3936 8.3630 116.3699 55.2340 29.6542 175.7693 78 I 3.6291 8.7692 122.8559 64.6449 37.9250 177.5704 79 Q 3.9248 8.4735 118.1802 59.3317 28.6159 178.3344 80 A 4.3519 7.6761 117.0116 52.8006 17.8358 178.8370 81 R 3.5828 7.8359 117.9609 57.5691 29.9849 178.5775 82 R 3.9590 7.2595 115.4267 58.6160 29.6382 178.3862 83 L 4.2706 7.8722 120.5938 57.1091 41.5922 178.8596 84 W 4.5426 8.2332 118.8590 59.9880 28.5613 178.4750 85 K 2.0000 7.8346 117.6080 59.5853 31.3433 178.4518 86 D 4.1750 8.1789 119.3448 56.4140 40.7088 177.1086 87 Y 4.4030 7.4330 115.0090 57.8799 38.7452 177.0050 88 F 4.6339 7.5596 118.9814 59.2901 39.1572 173.8551 89 P 4.2656 0.0000 0.0000 64.5016 31.5497 175.0337 90 E 3.8939 9.0527 118.8197 56.9209 27.3637 175.0439 91 V 3.7162 7.4061 118.2721 63.4224 31.7752 175.8093 92 N 4.6850 8.8653 124.2875 53.3396 39.2976 175.0362 93 G 4.0756 6.8079 105.8525 46.0638 0.0000 171.9707 94 I 4.6411 7.7357 120.7958 59.2277 40.8987 175.2406 95 V 3.9132 8.2054 127.2171 60.6201 31.4316 173.3603 96 F 4.5193 8.3492 125.6418 57.5545 40.7436 173.4735 97 L 5.0026 7.8685 124.9484 52.9119 44.5256 176.0446 98 V 4.3996 8.4317 121.6073 61.1025 35.0402 175.5915 99 D 4.7697 8.7381 125.6396 52.6706 39.9431 176.4541 100 A 4.1732 8.9461 122.3337 53.1680 18.7474 178.6608 101 A 5.1477 8.1707 116.0342 50.6669 20.9203 176.7500 102 D 4.8807 8.6670 117.5790 51.8567 40.9701 174.4297 103 P 2.0000 0.0000 0.0000 64.4634 31.7886 178.6836 104 E 3.9621 7.8505 114.9156 58.4168 29.6316 177.5511 105 R 4.7467 7.5991 116.9415 55.3858 31.8427 177.4612 106 F 4.6809 8.6832 121.1273 60.8744 38.6518 177.0593 107 D 4.3886 8.3138 118.0867 57.3729 40.7521 177.9158 108 E 3.9222 8.4140 118.9402 59.7258 29.3073 178.8861 109 A 4.2731 7.7934 118.5984 55.2528 18.7300 179.3096 110 R 3.9517 8.0528 117.1227 59.6665 30.3908 178.6449 111 V 3.6975 8.1440 118.1916 66.4592 31.1306 177.8799 112 E 4.1562 7.9458 116.8290 58.6834 29.6966 178.6947 113 L 3.3926 8.1795 120.9446 57.9429 42.1882 178.2458 114 D 4.6188 8.1514 118.1000 57.8569 40.5999 178.6437 115 A 4.0535 7.3000 117.9404 55.6248 18.5370 179.4637 116 L 4.0881 7.8434 117.0702 57.9189 41.5217 179.6038 117 F 4.1072 7.3934 116.1423 60.5790 38.9914 176.8838 118 N 4.7773 8.4950 114.3369 53.9208 38.5727 175.2904 119 I 3.8643 7.5667 122.3845 60.6962 36.6948 176.4760 120 A 3.9945 8.7132 129.8548 54.9369 18.3005 178.0477 121 E 4.1820 8.1864 115.2879 58.1828 29.9764 176.8341 122 L 4.6300 7.7441 118.1890 54.0189 41.4043 177.7356 123 K 3.7181 7.5804 119.2335 60.0033 32.7846 176.3062 124 D 4.7002 7.7224 121.8733 54.5928 40.9721 177.4530 125 V 4.4519 7.4606 118.1328 60.2451 34.3691 173.9324 126 P 4.8017 0.0000 0.0000 63.3123 31.8578 175.3482 127 F 5.1840 9.5439 122.9651 56.1895 42.3571 175.3815 128 V 5.0886 8.3174 120.8578 60.2474 32.9546 174.4385 129 I 4.4094 8.1152 127.0048 61.0003 39.2057 175.1660 130 L 4.6603 8.3396 123.0976 53.3392 44.3281 176.8237 131 G 4.2914 8.1038 117.6663 45.4220 0.0000 170.3515 132 N 5.3853 7.7332 119.0769 53.6734 41.2429 175.4043 133 K 4.1471 8.7525 117.0776 57.2471 29.1945 178.1705 134 I 3.8964 7.9408 115.2895 64.0240 37.6600 177.2897 135 D 4.4239 8.1431 116.2598 54.0441 39.1471 175.9447 136 A 4.4110 7.9611 124.2358 50.9074 19.4558 177.1978 137 P 4.2991 0.0000 0.0000 65.4570 31.4865 176.9675 138 N 4.8448 7.9931 114.7165 52.7029 38.9034 174.1730 139 A 4.5182 7.5893 120.1719 52.4238 18.9931 178.1040 140 V 4.5601 8.4602 121.3413 60.8914 33.8664 175.9442 141 S 4.4103 8.8289 121.1685 57.9784 63.8800 174.8413 142 E 3.9694 9.1043 121.3735 58.9350 29.3755 178.1500 143 A 4.2817 8.0742 120.4929 54.7239 18.8557 178.8301 144 E 3.9376 8.1504 117.9290 59.4153 29.9561 179.5204 145 L 3.7923 7.7912 119.9771 57.8587 42.2786 178.6417 146 R 3.8093 7.6650 116.7185 59.6614 29.9018 179.1572 147 S 3.9642 8.0404 114.3252 61.1719 62.7599 176.4716 148 A 4.0359 8.0675 123.9602 54.5203 18.2608 178.0143 149 L 4.4324 7.9081 113.1821 53.7148 42.1797 176.4495 150 G 4.0341 7.5458 106.6112 47.2855 0.0000 174.1049 151 L 4.7439 8.6490 114.6941 53.9711 43.0495 179.4376 152 L 3.9887 8.2155 120.7445 56.9243 41.6148 176.9341 153 N 4.7808 7.6229 113.6980 51.5204 39.8531 173.4990 154 T 4.6986 7.8990 112.2126 59.1343 73.5003 176.5279 155 T 3.9662 8.1294 119.7303 62.0331 65.8389 175.3408 156 G 4.0916 6.0628 102.0718 47.0214 0.0000 173.2140 *164 R 4.0151 7.7116 118.2589 54.7660 30.9205 173.2828 165 P 4.4798 0.0000 0.0000 63.5576 32.5107 175.9503 166 V 5.2791 8.7258 124.0318 61.4585 33.1660 171.3971 167 E 4.3857 7.9286 126.4815 53.5810 32.3734 174.4084 168 V 4.4673 7.9062 125.7733 61.9528 33.4502 174.7698 169 F 4.8484 8.5612 121.9967 56.2512 43.3853 173.4884 170 M 4.9246 8.3532 120.8715 54.2454 34.8864 174.6476 171 C 4.8158 8.1173 114.8447 58.3775 33.1066 172.1548 172 S 5.5104 8.8950 113.4432 56.6703 65.0294 174.9369 173 V 4.0322 8.9491 126.8761 65.6858 31.9276 177.7888 174 V 3.6370 8.0380 118.2219 65.9426 31.2004 176.1936 175 M 4.4145 7.8441 116.1611 54.1219 32.2596 176.6975 176 R 4.1904 8.1401 114.9937 54.7651 27.9719 174.7137 177 N 4.0316 8.5397 114.8239 53.7501 42.7583 174.9540 178 G 4.7284 8.6884 112.7709 47.0587 0.0000 175.2392 179 Y 4.4895 7.0556 117.7279 59.6130 38.3200 177.6555 180 L 4.1725 7.5364 120.5196 57.9745 41.8045 179.1771 181 E 4.1206 8.2402 117.6965 59.0991 29.3423 178.8120 182 A 2.0000 7.3416 121.3242 54.6009 18.2834 179.6515 183 F 3.9017 8.0982 115.8655 60.1900 38.8166 177.6835 184 Q 4.0861 7.9986 118.7739 59.3039 28.9515 178.1088 185 W 4.3096 8.6023 129.6158 60.2245 30.6844 177.5228 186 L 3.3867 7.8139 119.3721 58.1974 41.4872 179.0699 187 S 4.3313 7.7623 114.0991 61.4752 62.7654 174.2825 188 Q 4.0947 8.0132 124.7471 56.0940 28.3831 175.8808 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 24 G 8.21 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 0.00 0.00 0.00 25 K 8.82 5.42 0.00 2.07 2.05 0.00 1.94 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.57 7.81 26 L 9.47 5.45 0.00 1.77 1.58 0.57 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.34 5.14 0.00 1.45 1.48 1.09 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 28 F 9.32 4.74 0.00 2.82 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 29 L 9.12 4.32 0.00 1.49 0.85 1.12 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.67 3.71 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 0.00 0.00 0.00 31 L 7.95 4.26 0.00 1.78 1.73 1.12 1.07 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 32 D 8.41 4.54 0.00 2.86 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 33 N 9.07 4.54 0.00 2.85 3.18 0.00 0.00 7.09 7.96 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 34 A 7.59 4.11 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 35 G 8.31 3.31 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 0.00 36 K 8.37 4.06 0.00 1.83 2.06 0.00 1.55 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.43 7.81 37 T 7.84 3.93 4.22 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 1.17 0.00 0.00 38 T 7.89 3.82 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 1.23 0.00 0.00 39 L 7.62 3.76 0.00 1.75 2.01 0.56 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.23 3.66 0.00 1.06 1.56 0.37 0.66 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 41 H 8.66 4.03 0.00 3.24 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 M 8.13 4.10 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 43 L 7.63 4.16 0.00 1.69 1.55 0.69 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.34 4.25 0.00 1.58 1.79 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.37 7.81 45 N 7.63 4.82 0.00 2.80 2.76 0.00 0.00 6.91 8.08 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 46 D 8.13 5.14 0.00 2.73 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 47 R 7.43 4.66 0.00 1.92 1.74 0.00 3.19 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.81 0.00 48 L 8.21 4.09 0.00 1.57 1.54 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.60 4.22 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 50 T 8.45 4.28 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 1.20 0.00 0.00 51 L 7.91 4.46 0.00 1.65 1.63 0.94 0.96 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 52 Q 8.16 4.56 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.89 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 53 P 0.00 4.17 0.00 2.01 2.08 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 54 T 8.56 4.02 4.32 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 1.32 0.00 0.00 55 W 8.92 4.94 0.00 3.13 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 56 H 7.87 5.06 0.00 2.97 3.01 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.35 0.00 2.15 1.76 0.00 3.70 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 2.44 2.24 0.00 58 T 8.63 4.87 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 1.21 0.00 0.00 59 S 7.89 4.75 0.00 2.91 2.72 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 0.00 0.00 0.00 0.00 60 E 8.17 4.49 0.00 1.67 1.68 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 2.08 2.06 0.00 61 E 8.28 4.65 0.00 1.92 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 0.00 2.20 2.30 0.00 62 L 7.95 4.20 0.00 1.77 1.62 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.61 4.89 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 64 I 8.41 4.28 2.03 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.70 0.86 0.00 0.00 65 G 8.81 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 66 N 8.44 4.87 0.00 2.72 2.83 0.00 0.00 6.52 7.45 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 67 I 7.41 4.36 1.52 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.93 -0.27 0.00 0.00 68 K 8.18 4.48 0.00 1.50 1.67 0.00 1.65 0.00 0.00 1.85 0.00 0.00 2.72 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.35 7.81 69 F 8.81 5.63 0.00 2.97 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 70 T 8.75 4.41 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 1.18 0.00 0.00 71 T 8.47 5.19 4.59 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 1.51 0.00 0.00 72 F 8.92 4.76 0.00 2.81 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 73 D 8.49 5.17 0.00 2.34 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 0.00 0.00 0.00 74 L 7.77 5.12 0.00 1.57 1.53 0.65 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 75 G 9.04 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 0.00 0.00 0.00 76 G 8.66 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 0.00 0.00 0.00 0.00 77 H 8.36 4.39 0.00 3.52 3.48 0.00 5.50 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 8.77 3.63 1.89 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 1.39 1.28 0.94 0.00 0.00 79 Q 8.47 3.92 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 80 A 7.68 4.35 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 0.00 0.00 81 R 7.84 3.58 0.00 1.62 0.98 0.00 2.88 0.00 0.00 2.91 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.70 0.00 82 R 7.26 3.96 0.00 2.01 2.02 0.00 3.06 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 1.63 1.65 0.00 83 L 7.87 4.27 0.00 2.06 1.92 1.02 0.79 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 84 W 8.23 4.54 0.00 3.27 3.42 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 85 K 7.83 2.00 0.00 1.82 1.94 0.00 1.47 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.36 7.81 86 D 8.18 4.17 0.00 2.45 2.26 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 0.00 87 Y 7.43 4.40 0.00 2.82 2.72 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 0.00 0.00 0.00 0.00 88 F 7.56 4.63 0.00 3.11 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 89 P 0.00 4.27 0.00 2.04 2.03 0.00 3.85 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.17 0.00 90 E 9.05 3.89 0.00 2.09 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 2.26 2.29 0.00 91 V 7.41 3.72 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 0.77 0.00 0.00 1.08 0.00 0.00 92 N 8.87 4.68 0.00 3.09 2.94 0.00 0.00 6.87 7.46 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 93 G 6.81 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 94 I 7.74 4.64 0.56 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.71 0.48 0.00 0.00 95 V 8.21 3.91 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 0.00 0.00 0.42 0.00 0.00 0.18 0.00 0.00 96 F 8.35 4.52 0.00 3.22 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 97 L 7.87 5.00 0.00 1.37 1.46 0.87 0.76 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 98 V 8.43 4.40 2.13 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 0.82 0.00 0.00 1.11 0.00 0.00 99 D 8.74 4.77 0.00 2.86 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 0.00 100 A 8.95 4.17 1.49 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 0.00 0.00 101 A 8.17 5.15 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 0.00 102 D 8.67 4.88 0.00 2.96 2.58 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 0.00 103 P 0.00 2.00 0.00 1.84 1.53 0.00 3.46 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 104 E 7.85 3.96 0.00 1.84 1.96 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 2.26 2.30 0.00 105 R 7.60 4.75 0.00 1.88 1.92 0.00 3.36 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.73 0.00 106 F 8.68 4.68 0.00 3.08 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 0.00 107 D 8.31 4.39 0.00 2.75 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 0.00 108 E 8.41 3.92 0.00 2.08 2.26 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 2.48 2.48 0.00 109 A 7.79 4.27 1.61 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 0.00 110 R 8.05 3.95 0.00 1.99 2.19 0.00 3.38 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 111 V 8.14 3.70 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 0.98 0.00 0.00 1.03 0.00 0.00 112 E 7.95 4.16 0.00 2.42 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 0.00 2.59 2.52 0.00 113 L 8.18 3.39 0.00 1.28 1.61 -0.17 1.17 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 0.00 114 D 8.15 4.62 0.00 2.74 2.78 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 0.00 115 A 7.30 4.05 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 0.00 116 L 7.84 4.09 0.00 1.63 1.81 1.19 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 117 F 7.39 4.11 0.00 3.05 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 0.00 118 N 8.49 4.78 0.00 2.82 2.89 0.00 0.00 7.10 7.30 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 0.00 119 I 7.57 3.86 1.87 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.96 0.94 0.00 0.00 120 A 8.71 3.99 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 0.00 121 E 8.19 4.18 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 2.39 2.40 0.00 122 L 7.74 4.63 0.00 1.56 1.71 -0.05 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.58 3.72 0.00 1.89 1.73 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.48 7.81 124 D 7.72 4.70 0.00 2.73 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 0.00 125 V 7.46 4.45 2.36 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 0.87 0.00 0.00 1.02 0.00 0.00 126 P 0.00 4.80 0.00 2.10 1.93 0.00 3.78 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 127 F 9.54 5.18 0.00 3.20 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 0.00 128 V 8.32 5.09 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 1.23 0.00 0.00 1.23 0.00 0.00 129 I 8.12 4.41 1.96 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.93 1.08 0.00 0.00 130 L 8.34 4.66 0.00 1.57 1.62 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.10 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 0.00 132 N 7.73 5.39 0.00 2.93 2.78 0.00 0.00 7.78 5.97 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 0.00 133 K 8.75 4.15 0.00 2.04 2.02 0.00 2.04 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.36 1.46 7.81 134 I 7.94 3.90 1.90 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 1.66 0.78 1.01 0.00 0.00 135 D 8.14 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0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 152 L 8.22 3.99 0.00 1.59 1.71 0.90 0.97 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 0.00 153 N 7.62 4.78 0.00 2.64 2.68 0.00 0.00 6.76 7.42 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 0.00 154 T 7.90 4.70 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 1.17 0.00 0.00 155 T 8.13 3.97 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 1.48 0.00 0.00 156 G 6.06 4.09 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 0.00 0.00 0.00 *164 R 7.71 4.02 0.00 1.81 1.84 0.00 3.07 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 165 P 0.00 4.48 0.00 2.20 1.98 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 166 V 8.73 5.28 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 1.07 0.00 0.00 0.93 0.00 0.00 167 E 7.93 4.39 0.00 1.16 1.12 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 1.47 1.47 0.00 168 V 7.91 4.47 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 0.83 0.00 0.00 0.90 0.00 0.00 169 F 8.56 4.85 0.00 3.04 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 0.00 170 M 8.35 4.92 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.44 0.00 171 C 8.12 4.82 0.00 3.37 3.17 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 0.00 0.00 0.00 0.00 172 S 8.90 5.51 0.00 3.88 3.74 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 0.00 173 V 8.95 4.03 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 0.87 0.00 0.00 0.94 0.00 0.00 174 V 8.04 3.64 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 0.89 0.00 0.00 0.95 0.00 0.00 175 M 7.84 4.41 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.66 0.00 176 R 8.14 4.19 0.00 1.87 1.99 0.00 3.20 0.00 0.00 3.05 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 177 N 8.54 4.03 0.00 2.64 2.51 0.00 0.00 7.23 7.34 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 0.00 178 G 8.69 4.73 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 0.00 0.00 0.00 179 Y 7.06 4.49 0.00 3.33 3.33 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 0.00 180 L 7.54 4.17 0.00 1.61 1.79 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 181 E 8.24 4.12 0.00 2.24 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 0.00 2.47 2.49 0.00 182 A 7.34 2.00 1.01 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 0.00 0.00 183 F 8.10 3.90 0.00 3.26 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 0.00 184 Q 8.00 4.09 0.00 2.27 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 185 W 8.60 4.31 0.00 3.82 3.41 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 0.00 186 L 7.81 3.39 0.00 1.71 1.67 0.79 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 187 S 7.76 4.33 0.00 4.14 4.01 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 0.00 188 Q 8.01 4.09 0.00 1.73 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.