NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 S 4.4083 8.3349 115.2885 58.3975 64.0261 174.8625 14 L 4.0680 7.8305 116.4681 54.0650 41.7475 175.8645 15 T 4.3905 8.4307 108.7849 61.6392 71.1584 174.6409 16 M 4.1583 7.8455 123.2829 55.5736 32.5890 175.3310 17 K 4.9763 8.3224 121.7960 55.3860 34.6735 175.9710 18 S 4.6317 9.0039 117.5477 56.9714 67.5666 173.6504 19 Q 4.7016 8.7316 125.1630 55.1714 28.7137 174.3757 20 L 4.3428 8.9419 129.6988 54.4539 43.8783 175.0174 21 Q 4.8878 9.0012 127.5639 55.1526 30.9447 174.1798 22 I 4.9284 8.8074 127.2232 59.9558 40.2152 174.5387 23 T 4.7775 9.0245 125.4212 62.3737 70.3055 174.3484 24 V 4.1135 8.8579 127.9628 62.6092 32.2219 176.2201 25 I 4.1943 9.0773 130.3764 62.5645 37.9761 176.1113 26 S 5.0713 7.7944 113.2555 58.0231 65.7451 173.5752 27 A 5.1705 8.3800 121.1278 50.3301 23.1992 175.1748 28 K 4.6693 8.9604 118.8340 54.6686 34.8337 175.2957 29 L 5.0695 8.8386 125.8363 52.4419 43.7612 176.9488 30 K 4.1203 8.8575 124.0734 56.0904 32.6544 176.8805 31 E 3.9074 8.7603 125.4122 56.1412 30.2644 175.2344 32 N 4.6341 8.6462 126.4986 52.4339 40.1190 175.2152 *33 K 4.1928 8.3772 127.9868 53.1435 31.1947 172.4211 *36 W 4.6843 8.4119 134.4380 56.3973 32.2059 175.9986 37 F 4.4081 8.1205 114.9636 56.9242 39.2605 175.7608 38 G 4.1296 8.3540 111.0606 44.7450 0.0000 170.9384 39 P 4.7551 0.0000 0.0000 62.6150 33.5829 175.8297 40 S 5.8318 9.3003 116.1618 55.2575 63.3141 171.6849 41 P 5.4854 0.0000 0.0000 62.5357 33.4764 175.0659 42 Y 5.4185 9.0516 119.1834 55.7681 42.3673 173.5540 43 V 4.6870 8.3437 119.4225 60.9726 34.4714 173.6236 44 E 5.1451 9.3777 128.4822 54.4817 32.2568 174.3783 45 V 4.5786 9.0326 127.4374 61.3175 33.7853 174.4026 46 T 5.2066 7.9793 117.7191 60.0092 72.0204 173.2820 47 V 4.2844 8.7469 119.6033 61.7454 34.9924 172.4821 48 D 4.2769 9.8278 123.5465 55.5461 38.1543 174.6117 49 G 3.9585 8.2455 104.5075 45.4168 0.0000 172.7753 50 Q 4.7026 7.9178 118.6200 54.1078 31.4449 174.4574 51 S 5.0647 8.2847 113.9450 56.9529 65.4714 173.1761 52 K 4.7615 9.3102 126.3065 54.4991 35.7765 175.3289 53 K 5.2639 8.5409 122.7696 54.6567 35.2833 176.2462 54 T 4.3077 8.6346 115.0950 61.2089 70.0698 173.7160 55 E 4.4295 9.2241 122.7232 55.7994 30.5396 176.8173 56 K 5.1453 8.5200 120.2483 56.7479 34.8716 175.6048 57 C 4.8993 9.0705 118.3315 58.2477 30.8371 172.7801 58 N 4.9373 8.7840 119.5450 52.5001 39.7046 174.9679 59 N 4.2896 8.4566 119.6371 54.0694 36.7477 174.2928 60 T 4.6444 8.0651 109.9291 60.9397 71.3038 173.9385 61 N 4.7090 8.8935 123.8557 52.8466 39.8355 174.7728 62 S 5.1834 7.8196 113.9581 55.4203 62.2923 172.8331 63 P 3.9476 0.0000 0.0000 62.6754 32.8786 177.4496 64 K 4.2305 7.9618 121.5068 54.8399 33.6525 175.6047 65 W 4.3911 8.9628 125.3354 57.1859 30.2163 177.8834 66 K 3.8436 7.9351 116.8775 57.7451 29.8766 174.8586 67 Q 4.8005 8.2897 119.4284 53.6049 31.5004 172.9932 68 P 5.0269 0.0000 0.0000 62.6661 32.4644 175.4665 69 L 5.1019 9.1931 122.7975 53.0891 46.0586 175.3403 70 T 5.2279 8.4191 109.6396 60.3367 71.8265 173.4411 71 V 4.5498 8.5298 114.7403 60.0356 36.8256 174.4550 72 I 4.8142 8.3577 123.6193 60.1164 38.3539 175.2278 73 V 4.6958 8.7448 120.1012 59.6951 36.4735 174.8245 74 T 5.0817 8.5353 111.9864 58.4788 71.1299 173.8857 75 P 4.4046 0.0000 0.0000 64.8896 31.4330 178.4361 76 V 4.3818 7.1609 110.2060 60.9439 32.0628 176.0504 77 S 4.4248 7.9847 117.1141 58.5667 64.0800 173.2342 78 K 5.0240 8.4339 121.0595 54.7231 34.4339 175.6696 79 L 4.3643 9.0206 125.8520 53.9867 43.5149 175.2997 80 H 5.2070 8.8362 123.1077 54.4743 32.9007 173.0858 81 F 5.3264 8.7492 121.7874 55.7259 43.0625 174.1690 82 R 4.8795 9.0293 120.9655 54.2881 34.1887 174.3343 83 V 4.5696 8.4735 123.6781 61.0563 33.4729 174.4355 84 W 5.1238 8.6684 127.9486 54.9105 32.4464 174.6120 85 S 5.2893 9.1954 117.9057 56.8265 64.0387 172.7860 86 H 5.4524 9.3050 127.8599 56.3515 30.4459 174.5603 87 Q 4.5461 8.8241 123.0500 54.4940 32.5891 175.7217 88 T 4.0428 8.6236 118.6325 66.2729 68.7928 175.8012 89 L 4.5450 7.7455 117.3228 54.2698 42.2135 175.5482 90 K 4.5322 7.4747 116.7788 55.5331 35.1542 175.3387 91 S 4.1913 8.6206 114.2266 59.2970 63.1164 174.4291 92 D 4.7573 8.4803 123.1416 54.7764 41.7717 175.7577 93 V 4.3484 8.6353 121.8236 61.4945 33.3599 174.6919 94 L 3.7518 8.5831 130.3940 54.9944 41.6680 176.2425 95 L 4.1365 8.8257 128.3146 57.2016 42.4139 177.2456 96 G 4.0840 7.1588 103.3938 46.0428 0.0000 172.0249 97 T 5.2936 8.5093 109.1317 60.1480 72.7948 172.6137 98 A 5.0148 8.7399 122.8833 51.2017 23.4192 174.5904 99 A 5.2574 8.3664 118.9368 50.9201 22.7439 175.8104 100 L 4.6240 9.0189 121.4018 53.7060 46.1364 174.6518 101 D 4.9430 8.8421 126.2223 53.4137 42.0227 176.9147 102 I 3.8497 8.6384 128.5426 64.4957 37.0293 177.9531 103 Y 4.4557 8.5688 122.2353 60.2671 38.6509 177.7246 104 E 3.8928 8.4325 119.0950 59.6248 29.5589 179.2936 105 T 3.8502 8.0435 115.7412 66.5292 68.4386 176.4935 106 L 3.9688 8.2743 121.2535 57.9558 41.4790 179.6364 107 K 3.7594 7.7002 117.0504 59.5399 32.0907 179.0743 108 S 4.3517 7.8484 112.3209 59.7715 63.6461 173.5843 109 N 4.9529 7.3260 121.6541 53.6703 39.1355 173.8360 110 N 4.3559 9.1788 108.9655 54.4415 36.5040 174.7755 111 M 3.1757 8.7215 114.6571 55.7126 29.9166 176.0658 112 K 4.7418 7.8736 119.3497 55.2580 35.5463 176.0471 113 L 4.4319 9.4040 129.0496 53.6214 41.9490 174.7435 114 E 4.5133 8.5276 122.8102 53.9700 31.0510 176.2806 115 E 3.6793 8.7664 128.2428 57.0736 27.9056 176.1715 116 V 4.0436 8.0023 118.8527 62.0793 33.2571 175.5517 117 V 4.6516 8.3463 128.3244 61.8723 32.8430 175.1387 118 V 4.4715 8.8680 127.1705 61.5042 34.8824 173.8654 119 T 4.9957 8.5764 123.8608 61.9177 70.4536 173.8194 120 L 4.8224 8.7374 125.4900 52.7389 45.2455 176.0719 121 Q 4.5044 8.6708 121.5317 55.9731 29.8180 175.2966 122 L 4.7191 8.9578 123.6321 53.3273 43.7914 175.8983 123 G 4.2656 9.0561 111.8085 44.5111 0.0000 173.6051 124 G 3.8463 8.9006 110.8075 46.1261 0.0000 173.7633 125 D 4.4101 8.9286 123.9025 57.4120 41.9364 178.3920 126 K 4.0561 8.0430 120.4536 56.8255 32.0157 178.7046 127 E 4.5746 7.5964 121.8604 52.7661 29.8717 173.9548 128 P 4.3575 0.0000 0.0000 65.3398 31.6746 178.0633 129 T 4.0256 7.8030 105.8073 63.4143 69.2719 173.7897 130 E 4.4875 8.2006 123.7943 55.4669 31.2039 175.5776 131 T 4.7294 8.5313 121.8003 63.3993 69.0938 174.5290 132 I 4.2246 9.4923 119.6959 60.1111 39.6043 175.9923 133 G 3.7184 6.9300 109.6709 46.2584 0.0000 170.3345 134 D 5.2563 8.0994 117.9810 51.7503 43.7591 174.1766 135 L 5.1261 8.9359 120.4829 53.5544 45.6443 174.9342 136 S 5.3917 9.3653 122.5699 56.8173 65.6739 173.2372 137 I 5.1613 8.6710 116.4569 59.4607 41.8660 173.2958 138 C 5.2840 9.1600 122.6410 57.6424 34.5558 172.4096 139 L 5.3077 8.9461 126.1623 53.2481 44.2408 174.9964 140 D 4.9078 9.2528 121.5784 53.8229 45.2902 175.6210 141 G 4.2486 9.7880 113.3049 45.0161 0.0000 173.2700 142 L 4.8189 7.7739 119.9112 53.4053 45.7240 174.3025 143 Q 4.9540 8.6563 122.6153 54.5904 32.3266 173.8824 144 L 4.5320 8.9046 122.2393 55.4424 44.0512 176.2375 145 E 4.2048 8.9388 125.0202 56.6155 28.8410 174.8980 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 S 8.33 4.41 0.00 3.85 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 14 L 7.83 4.07 0.00 1.69 1.58 0.75 0.41 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 15 T 8.43 4.39 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 1.19 0.00 0.00 16 M 7.85 4.16 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.56 0.00 17 K 8.32 4.98 0.00 1.63 1.72 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.45 7.81 18 S 9.00 4.63 0.00 3.69 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 19 Q 8.73 4.70 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 20 L 8.94 4.34 0.00 1.81 1.66 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 21 Q 9.00 4.89 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.51 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 22 I 8.81 4.93 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.72 1.07 0.00 0.00 23 T 9.02 4.78 4.28 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 0.00 0.00 0.00 1.27 0.00 0.00 24 V 8.86 4.11 2.01 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 0.67 0.00 0.00 0.93 0.00 0.00 25 I 9.08 4.19 2.04 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 1.33 0.65 0.96 0.00 0.00 26 S 7.79 5.07 0.00 3.85 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.38 5.17 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.96 4.67 0.00 1.79 1.68 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.49 7.81 29 L 8.84 5.07 0.00 1.57 1.56 0.97 0.93 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 30 K 8.86 4.12 0.00 1.66 1.72 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.47 7.81 31 E 8.76 3.91 0.00 1.85 1.78 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 2.19 2.17 0.00 32 N 8.65 4.63 0.00 2.70 2.68 0.00 0.00 6.92 6.68 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 *33 K 8.38 4.19 0.00 1.81 1.63 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.31 0.98 7.81 *36 W 8.41 4.68 0.00 3.24 2.76 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 37 F 8.12 4.41 0.00 3.22 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 38 G 8.35 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 0.00 0.00 0.00 39 P 0.00 4.76 0.00 2.21 2.26 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.02 0.00 40 S 9.30 5.83 0.00 3.88 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 41 P 0.00 5.49 0.00 2.55 2.34 0.00 3.95 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 42 Y 9.05 5.42 0.00 3.24 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 43 V 8.34 4.69 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 1.08 0.00 0.00 0.07 0.00 0.00 44 E 9.38 5.15 0.00 2.40 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 0.00 2.30 2.33 0.00 45 V 9.03 4.58 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 0.67 0.00 0.00 0.99 0.00 0.00 46 T 7.98 5.21 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 1.24 0.00 0.00 47 V 8.75 4.28 1.98 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 0.53 0.00 0.00 0.94 0.00 0.00 48 D 9.83 4.28 0.00 2.90 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 49 G 8.25 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 50 Q 7.92 4.70 0.00 2.21 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.70 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 51 S 8.28 5.06 0.00 3.83 3.68 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 52 K 9.31 4.76 0.00 1.64 1.62 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.73 7.81 53 K 8.54 5.26 0.00 1.55 1.70 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.45 7.81 54 T 8.63 4.31 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 0.91 0.00 0.00 55 E 9.22 4.43 0.00 1.97 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 2.36 2.42 0.00 56 K 8.52 5.15 0.00 2.04 2.06 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.56 7.81 57 C 9.07 4.90 0.00 2.75 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 58 N 8.78 4.94 0.00 2.63 2.77 0.00 0.00 7.15 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.46 4.29 0.00 2.88 2.95 0.00 0.00 6.70 6.82 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 60 T 8.07 4.64 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 1.15 0.00 0.00 61 N 8.89 4.71 0.00 2.62 2.99 0.00 0.00 6.88 7.57 0.00 0.00 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 S 7.82 5.18 0.00 3.61 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 63 P 0.00 3.95 0.00 0.49 1.64 0.00 3.75 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 1.46 1.82 0.00 64 K 7.96 4.23 0.00 1.48 1.69 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.20 1.43 7.81 65 W 8.96 4.39 0.00 3.59 3.16 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 0.00 0.00 0.00 0.00 66 K 7.94 3.84 0.00 1.92 1.90 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.40 7.81 67 Q 8.29 4.80 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 68 P 0.00 5.03 0.00 2.14 2.06 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 69 L 9.19 5.10 0.00 1.56 1.55 0.91 0.38 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 70 T 8.42 5.23 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 71 V 8.53 4.55 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 0.71 0.00 0.00 0.92 0.00 0.00 72 I 8.36 4.81 1.86 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 1.34 0.56 0.91 0.00 0.00 73 V 8.74 4.70 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 0.75 0.00 0.00 1.01 0.00 0.00 74 T 8.54 5.08 4.40 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 1.24 0.00 0.00 75 P 0.00 4.40 0.00 2.22 2.26 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 76 V 7.16 4.38 1.93 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 0.16 0.00 0.00 0.83 0.00 0.00 77 S 7.98 4.42 0.00 3.87 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 78 K 8.43 5.02 0.00 1.60 1.71 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.44 7.81 79 L 9.02 4.36 0.00 1.72 1.13 1.09 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 80 H 8.84 5.21 0.00 3.14 3.03 0.00 5.72 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 F 8.75 5.33 0.00 2.85 2.81 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 82 R 9.03 4.88 0.00 1.64 0.98 0.00 3.00 0.00 0.00 2.99 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.56 0.00 83 V 8.47 4.57 2.01 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 1.08 0.00 0.00 0.92 0.00 0.00 84 W 8.67 5.12 0.00 1.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.20 5.29 0.00 3.92 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 86 H 9.30 5.45 0.00 3.46 3.38 0.00 5.94 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 8.82 4.55 0.00 2.18 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.50 2.69 0.00 88 T 8.62 4.04 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 1.21 0.00 0.00 89 L 7.75 4.55 0.00 1.62 1.69 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 90 K 7.47 4.53 0.00 1.83 1.79 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.49 7.81 91 S 8.62 4.19 0.00 3.94 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 92 D 8.48 4.76 0.00 2.40 2.92 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 93 V 8.64 4.35 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 0.85 0.00 0.00 1.02 0.00 0.00 94 L 8.58 3.75 0.00 0.86 1.32 -0.02 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.83 4.14 0.00 1.57 1.67 0.96 0.80 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 96 G 7.16 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 0.00 0.00 0.00 97 T 8.51 5.29 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 1.12 0.00 0.00 98 A 8.74 5.01 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 99 A 8.37 5.26 1.26 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 0.00 0.00 100 L 9.02 4.62 0.00 1.90 1.75 0.96 1.18 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 0.00 101 D 8.84 4.94 0.00 2.77 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 0.00 102 I 8.64 3.85 2.10 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 1.46 0.51 1.03 0.00 0.00 103 Y 8.57 4.46 0.00 3.04 3.08 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 0.00 104 E 8.43 3.89 0.00 2.18 1.98 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 2.61 2.38 0.00 105 T 8.04 3.85 4.40 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 1.23 0.00 0.00 106 L 8.27 3.97 0.00 1.79 1.69 1.11 1.06 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 0.00 107 K 7.70 3.76 0.00 1.76 1.76 0.00 1.49 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 1.10 7.81 108 S 7.85 4.35 0.00 4.02 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 0.00 109 N 7.33 4.95 0.00 2.80 2.71 0.00 0.00 7.06 6.59 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 0.00 110 N 9.18 4.36 0.00 2.87 2.87 0.00 0.00 7.24 7.66 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 0.00 111 M 8.72 3.18 0.00 2.37 2.18 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 112 K 7.87 4.74 0.00 1.71 1.63 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.42 7.81 113 L 9.40 4.43 0.00 1.68 1.63 0.96 0.70 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 0.00 114 E 8.53 4.51 0.00 1.82 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 115 E 8.77 3.68 0.00 2.05 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 2.28 2.36 0.00 116 V 8.00 4.04 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 0.88 0.00 0.00 0.98 0.00 0.00 117 V 8.35 4.65 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 0.84 0.00 0.00 0.94 0.00 0.00 118 V 8.87 4.47 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 0.97 0.00 0.00 0.93 0.00 0.00 119 T 8.58 5.00 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 1.23 0.00 0.00 120 L 8.74 4.82 0.00 1.35 1.42 0.47 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 8.67 4.50 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 122 L 8.96 4.72 0.00 1.64 1.53 0.94 0.62 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 0.00 123 G 9.06 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 0.00 0.00 0.00 0.00 124 G 8.90 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 0.00 125 D 8.93 4.41 0.00 2.51 2.59 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 0.00 126 K 8.04 4.06 0.00 1.81 1.72 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.00 7.81 127 E 7.60 4.57 0.00 1.97 1.81 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 2.24 2.33 0.00 128 P 0.00 4.36 0.00 2.07 2.11 0.00 3.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 129 T 7.80 4.03 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 1.21 0.00 0.00 130 E 8.20 4.49 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 131 T 8.53 4.73 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 1.27 0.00 0.00 132 I 9.49 4.22 1.85 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 1.27 1.32 0.89 0.00 0.00 133 G 6.93 3.72 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 0.00 0.00 0.00 134 D 8.10 5.26 0.00 2.79 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 0.00 135 L 8.94 5.13 0.00 1.68 1.35 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 136 S 9.37 5.39 0.00 3.77 3.72 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 0.00 137 I 8.67 5.16 1.93 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.21 0.65 0.00 0.00 138 C 9.16 5.28 0.00 2.98 2.79 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 0.00 0.00 0.00 0.00 139 L 8.95 5.31 0.00 1.60 1.56 0.98 0.80 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 0.00 140 D 9.25 4.91 0.00 2.77 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 0.00 141 G 9.79 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 0.00 0.00 0.00 0.00 142 L 7.77 4.82 0.00 1.75 1.48 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 143 Q 8.66 4.95 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.59 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 144 L 8.90 4.53 0.00 1.68 1.65 0.97 1.53 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 0.00 145 E 8.94 4.20 0.00 2.11 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 2.18 2.33 0.00 * Residues marked with a * may have inaccurate shift predictions.