NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 A 4.2896 8.2601 123.5822 52.0714 19.2782 175.8571 16 A 4.5598 8.1697 124.3222 49.7445 22.4111 174.0868 17 N 4.7218 8.5512 117.8456 51.8861 42.2341 174.8535 18 R 3.8410 8.5714 120.5607 60.1222 29.9353 178.0751 19 A 4.1126 7.9910 119.7610 54.9604 18.4967 179.6982 20 G 3.5086 7.9769 103.8301 47.9770 0.0000 175.6043 21 R 3.9155 8.2430 121.7390 59.3775 29.9190 178.6382 22 Q 3.9560 8.0911 117.1630 58.5074 28.6987 178.2667 23 A 3.9729 7.9095 121.7389 55.3421 18.4854 179.7019 24 R 3.8680 7.9064 116.4629 59.6021 30.0726 179.2755 25 I 3.6751 7.9275 119.6110 64.5083 36.9019 178.6360 26 V 3.5836 7.9107 117.8229 65.8234 31.4393 177.7188 27 A 4.1403 7.9167 120.5833 55.1407 18.3822 179.5443 28 I 3.6784 8.2156 118.7455 64.7120 37.0119 178.7311 29 L 4.1375 8.1761 118.7761 57.2006 41.4245 179.0344 30 S 4.4436 7.7257 113.9112 60.1442 63.5926 175.7352 31 S 4.5436 8.0116 114.7580 57.8968 63.6885 173.2367 32 A 4.6722 7.3611 123.9696 50.5492 22.1136 175.4740 33 Q 4.3740 8.5449 118.5773 54.5181 29.1383 175.7837 34 V 4.3247 8.2557 123.7571 61.2815 32.7232 176.1812 35 R 4.5081 9.0134 126.6396 57.1512 31.2001 176.8182 36 S 4.8896 7.5626 111.5131 56.2243 67.0636 174.9529 37 Q 3.9186 8.6730 121.2192 59.0138 28.5672 178.4724 38 N 4.2877 8.2038 117.2176 56.3340 38.5318 176.8499 39 E 3.9435 8.0649 120.3427 59.0820 29.7808 178.5143 40 L 3.9070 8.0328 120.2451 58.1358 42.0287 178.8204 41 A 3.9853 8.3212 120.7130 55.0654 18.2745 179.5162 42 A 3.9438 7.9836 119.1165 55.3088 16.8917 179.8759 43 L 3.9964 8.1338 117.5904 57.8961 41.6584 179.7733 44 L 4.2965 8.1452 118.8088 57.5373 41.6228 179.2461 45 A 4.2335 8.7202 122.2168 54.4109 18.0201 179.5139 46 A 4.0346 7.9983 120.1110 54.5037 18.5900 177.9011 47 E 4.5361 7.4929 111.7394 56.1967 29.8454 177.2770 48 G 3.8163 8.1509 106.3605 46.5623 0.0000 174.4559 49 I 3.9831 7.7316 121.9537 60.3255 36.8379 174.9526 50 E 4.4932 8.6299 126.2324 54.7297 30.0380 175.8852 51 V 4.5059 7.9718 116.1657 59.0047 35.8566 175.6915 52 T 4.4098 7.9378 111.9665 60.5579 71.7090 175.5294 53 Q 3.8848 8.4290 120.6471 59.0782 29.0323 177.3746 54 A 3.9686 8.0961 121.4352 55.9315 18.2694 179.6333 55 T 3.8442 7.3986 113.7954 66.7716 68.4134 176.9913 56 L 3.9514 7.7112 120.6834 57.4189 41.6251 179.1792 57 S 4.0417 8.5073 113.6191 61.6539 62.2436 176.5855 58 R 3.9272 7.9755 120.4139 59.3216 29.7453 178.7040 59 D 4.3416 8.6910 118.9602 57.5861 40.8147 179.0639 60 L 3.9634 8.2717 119.7464 57.3931 41.5227 179.1336 61 E 3.9266 8.2919 119.4128 59.4534 29.4171 178.7122 62 E 3.9765 8.1236 117.2952 59.4432 29.6353 179.0162 63 L 4.2326 8.1335 117.2743 55.0225 41.7108 177.5884 64 G 3.9085 8.0067 106.4426 46.1699 0.0000 173.6327 65 A 4.4419 8.3384 121.6523 51.7492 19.0280 178.4914 66 V 4.4479 8.9392 114.8446 59.3387 35.7081 175.4493 67 K 4.1161 8.5215 125.5482 55.4743 31.8731 175.0065 68 L 4.7440 8.6749 130.4848 53.5730 43.9135 175.2554 69 R 4.7651 8.3277 120.5610 55.2991 32.4709 175.3410 70 G 4.0008 8.2583 109.4516 44.2169 0.0000 172.5326 71 A 4.0541 8.4327 122.6698 53.2396 18.8102 177.3444 72 D 4.4068 8.7089 121.9981 55.5935 38.4531 174.4165 73 G 3.9736 8.3299 104.5436 44.9544 0.0000 176.7099 74 G 3.7865 7.8177 106.7667 46.6893 0.0000 175.6684 75 T 4.0355 8.4551 116.7471 64.0034 69.2393 175.6690 76 G 3.9996 8.4950 106.8083 44.6992 0.0000 172.3955 77 I 4.7940 7.9810 112.2205 58.7801 41.2590 174.2002 78 Y 4.6862 8.9586 122.4494 58.2328 38.4799 175.6394 79 V 4.7555 9.1196 116.6043 59.5858 36.6457 174.7315 80 V 4.5969 8.2487 122.6231 59.1110 33.0755 174.2272 81 P 4.4882 0.0000 0.0000 63.5439 33.2448 176.7446 82 E 4.0885 8.4242 120.3396 55.4077 25.4777 178.9166 *90 V 3.9627 8.2453 123.7084 62.6663 32.2991 174.8433 91 S 4.4231 8.5097 115.3423 57.8293 65.5549 174.6513 92 G 3.7460 9.1429 107.0150 45.9442 0.0000 172.2700 93 G 4.3997 7.8640 118.0814 46.5016 0.0000 175.0056 94 T 3.9506 7.7421 116.6760 64.9956 68.4772 176.7252 95 D 4.2894 7.9645 121.2525 56.2239 39.9117 178.0170 96 R 3.8264 8.0295 120.3233 59.3807 29.8088 177.6294 97 M 3.9294 7.7615 117.2087 58.7517 32.3013 178.0394 98 A 3.8668 8.2560 121.0674 54.9185 17.9235 179.4757 99 R 3.8137 8.2468 117.5702 59.8354 30.1365 178.8491 100 L 4.0122 8.0123 118.6379 57.6022 41.6574 179.4312 101 L 3.9885 8.7839 119.8122 57.8162 41.3557 179.5945 102 G 3.7387 7.9900 104.4899 47.7687 0.0000 174.6203 103 E 4.2678 7.5959 119.0111 57.6125 30.4052 177.3381 104 L 4.8027 8.6675 117.5534 53.4728 42.7863 175.7801 105 L 4.0942 7.4727 121.0668 54.4740 41.5550 176.1123 106 V 4.0674 8.9630 128.1567 65.3957 32.2253 176.0585 107 S 4.8187 7.5856 112.2812 57.6644 65.8847 173.6620 108 T 5.1533 8.0706 110.1491 60.5965 72.2870 171.6755 109 D 4.6405 8.5222 120.6318 54.5893 45.5105 173.1975 110 D 5.0030 8.3775 117.9970 53.2638 42.2782 175.1768 111 S 4.4225 9.3436 111.4998 58.5973 66.9767 174.5805 112 G 3.7264 8.2598 117.2362 47.3010 0.0000 173.6660 113 N 5.0010 8.7266 121.3265 52.3716 37.5661 173.5949 114 L 5.3237 8.0734 118.4372 53.5086 45.1686 175.3311 115 A 5.0918 8.8581 124.8587 50.4349 21.8985 175.8519 116 V 4.6799 9.0061 121.1477 61.0779 34.2853 174.2727 117 L 5.1179 8.9330 128.1078 53.0011 44.6612 175.4979 118 R 5.1423 8.8917 122.4899 54.6887 32.4613 175.3485 119 T 5.5867 8.3191 112.3902 57.8395 73.0177 171.3663 120 P 4.5033 0.0000 0.0000 61.5540 32.8521 174.4906 121 P 4.5145 0.0000 0.0000 63.9061 31.6609 177.7395 122 G 3.9701 8.4921 109.9592 46.3079 0.0000 174.7736 123 A 4.4080 7.9612 120.2317 52.9767 18.9004 179.0371 124 A 3.9376 7.7416 120.1749 55.4792 18.3814 179.5659 125 H 4.0879 8.2210 114.2632 58.9031 28.6811 177.1406 126 Y 4.3558 8.0682 120.9419 60.7520 38.6571 177.7104 127 L 3.7161 7.9982 120.8193 58.1721 42.1945 178.8091 128 A 3.9396 8.2722 121.2018 55.1166 18.2412 179.7807 129 S 4.0925 8.4163 112.8611 61.4917 62.8942 176.5545 130 A 3.9299 7.4580 123.4409 54.8463 18.2400 179.3904 131 I 3.8518 7.9490 118.5349 64.6683 37.2275 178.1630 132 D 4.4259 8.4351 120.1029 57.7983 40.4943 179.4002 133 R 4.0379 7.8829 116.5443 58.6666 30.1266 178.4613 134 A 4.0409 7.7910 119.4474 52.3155 19.2783 176.8073 135 A 3.7256 7.8073 119.9414 52.7478 16.9516 177.7181 136 L 4.0848 7.5397 120.9558 54.5193 42.6537 177.6110 137 P 4.2581 0.0000 0.0000 65.4641 31.6136 177.1536 138 Q 4.2728 8.0020 114.9299 55.7710 29.0200 174.4512 139 V 4.6641 7.3199 119.4350 61.2273 32.1971 175.7491 140 V 3.7643 9.1159 129.9241 65.5567 32.1923 175.7375 141 G 4.2044 7.4724 105.6432 46.2619 0.0000 172.0491 142 T 5.3796 8.4695 108.8525 60.0678 72.4348 173.4729 143 I 4.6813 8.6145 122.3665 59.6725 41.2284 174.0259 144 A 5.0412 8.7322 128.4605 49.7643 21.2984 174.2359 145 G 3.9509 9.1414 109.4812 45.8049 0.0000 173.4887 146 D 4.7546 9.2973 123.2888 55.1745 42.7865 176.1435 147 D 5.1917 7.8188 115.1790 51.8635 41.3862 174.6355 148 T 5.2160 7.7122 114.3699 62.4822 73.3980 172.7035 149 I 4.9972 8.6574 124.8158 59.5653 41.4384 174.2735 150 L 4.8638 8.6825 126.9390 53.6151 43.4613 175.6198 151 V 4.7437 8.6894 124.4469 61.0663 34.0796 174.3583 152 V 4.5335 8.8002 128.8708 61.8119 32.6484 174.7662 153 A 4.7204 8.8617 131.2422 51.5566 19.6475 176.7250 154 R 4.1340 8.9456 123.7051 55.5474 31.2468 176.0053 155 E 4.2340 8.9429 126.3860 56.5056 29.9948 174.8596 156 P 4.7178 0.0000 0.0000 62.6636 31.8355 175.9170 157 T 3.8897 7.5050 115.7882 64.7020 68.9836 174.1876 158 T 4.6747 8.1260 115.0100 59.9146 72.5832 175.9636 159 G 3.6387 8.8174 108.1272 47.8152 0.0000 175.8233 160 A 4.1672 7.9829 122.5738 55.0536 18.3390 179.3898 161 Q 3.8475 8.1824 117.9372 59.2506 29.0967 178.0421 162 L 3.8060 7.8442 119.8662 58.0431 41.6444 179.5319 163 A 4.3232 8.6198 120.8973 55.0668 18.2968 179.8632 164 G 3.5517 8.3299 104.5654 48.2101 0.0000 175.4416 165 M 3.9107 8.6773 121.7450 58.4033 32.2858 178.3720 166 F 4.2808 8.2099 118.0966 60.6101 38.8711 177.5872 167 E 4.0956 8.4956 117.6475 59.0187 29.2231 178.6095 168 N 4.4958 7.8168 116.7241 56.4559 39.2800 176.6995 169 L 4.1655 7.8829 118.1486 56.2034 41.8252 177.0656 170 R 4.0922 7.6683 123.5935 56.8253 29.9867 175.6765 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 15 A 8.26 4.29 1.28 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 0.00 0.00 0.00 16 A 8.17 4.56 1.22 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 0.00 0.00 17 N 8.55 4.72 0.00 2.74 2.76 0.00 0.00 6.47 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 18 R 8.57 3.84 0.00 1.86 1.95 0.00 3.30 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 19 A 7.99 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 20 G 7.98 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.24 3.92 0.00 1.87 2.08 0.00 3.08 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 22 Q 8.09 3.96 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 23 A 7.91 3.97 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 24 R 7.91 3.87 0.00 2.03 2.01 0.00 3.30 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.91 0.00 25 I 7.93 3.68 2.01 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 1.37 0.80 0.87 0.00 0.00 26 V 7.91 3.58 2.24 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 0.82 0.00 0.00 1.00 0.00 0.00 27 A 7.92 4.14 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 28 I 8.22 3.68 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.12 0.92 0.00 0.00 29 L 8.18 4.14 0.00 1.62 1.78 0.96 0.87 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 30 S 7.73 4.44 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.01 4.54 0.00 4.06 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 32 A 7.36 4.67 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 33 Q 8.54 4.37 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 34 V 8.26 4.32 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 1.17 0.00 0.00 0.97 0.00 0.00 35 R 9.01 4.51 0.00 1.96 1.98 0.00 3.23 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 36 S 7.56 4.89 0.00 4.06 3.97 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 0.00 0.00 0.00 0.00 37 Q 8.67 3.92 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.91 0.00 0.00 0.00 0.00 0.00 2.15 2.41 0.00 38 N 8.20 4.29 0.00 2.82 2.88 0.00 0.00 6.79 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 39 E 8.06 3.94 0.00 2.10 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 2.32 2.32 0.00 40 L 8.03 3.91 0.00 1.74 1.77 0.88 0.65 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 41 A 8.32 3.99 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 42 A 7.98 3.94 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 43 L 8.13 4.00 0.00 1.87 1.75 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.15 4.30 0.00 1.84 1.83 0.90 0.53 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 45 A 8.72 4.23 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 46 A 8.00 4.03 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 47 E 7.49 4.54 0.00 2.08 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 0.00 2.40 2.38 0.00 48 G 8.15 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 0.00 0.00 0.00 49 I 7.73 3.98 1.99 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 1.30 1.15 0.91 0.00 0.00 50 E 8.63 4.49 0.00 1.94 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 2.23 2.30 0.00 51 V 7.97 4.51 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 0.76 0.00 0.00 0.91 0.00 0.00 52 T 7.94 4.41 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 1.21 0.00 0.00 53 Q 8.43 3.88 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.52 2.37 0.00 54 A 8.10 3.97 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 55 T 7.40 3.84 4.38 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 1.20 0.00 0.00 56 L 7.71 3.95 0.00 1.74 1.61 0.89 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.51 4.04 0.00 3.95 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 58 R 7.98 3.93 0.00 2.05 1.96 0.00 3.30 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 59 D 8.69 4.34 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 60 L 8.27 3.96 0.00 1.58 1.66 0.32 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.29 3.93 0.00 2.06 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 2.32 2.37 0.00 62 E 8.12 3.98 0.00 2.08 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 2.35 2.58 0.00 63 L 8.13 4.23 0.00 1.85 1.73 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.01 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 65 A 8.34 4.44 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 66 V 8.94 4.45 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 0.75 0.00 0.00 1.00 0.00 0.00 67 K 8.52 4.12 0.00 1.20 1.49 0.00 1.34 0.00 0.00 1.42 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.04 0.46 7.81 68 L 8.67 4.74 0.00 1.71 1.46 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.33 4.77 0.00 1.92 1.78 0.00 3.10 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 70 G 8.26 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.43 4.05 1.24 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 72 D 8.71 4.41 0.00 2.82 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 73 G 8.33 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.82 3.79 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 0.00 0.00 0.00 75 T 8.46 4.04 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 1.18 0.00 0.00 76 G 8.49 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.98 4.79 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.00 0.91 0.00 0.00 78 Y 8.96 4.69 0.00 2.88 2.95 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 79 V 9.12 4.76 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 0.84 0.00 0.00 0.95 0.00 0.00 80 V 8.25 4.60 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 0.78 0.00 0.00 0.95 0.00 0.00 81 P 0.00 4.49 0.00 2.07 2.03 0.00 3.67 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 2.04 2.12 0.00 82 E 8.42 4.09 0.00 2.04 1.47 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 2.16 2.24 0.00 *90 V 8.25 3.96 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 1.00 0.00 0.00 91 S 8.51 4.42 0.00 3.84 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 92 G 9.14 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 0.00 0.00 0.00 93 G 7.86 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 0.00 0.00 0.00 0.00 94 T 7.74 3.95 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 95 D 7.96 4.29 0.00 2.90 2.91 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 96 R 8.03 3.83 0.00 1.88 2.11 0.00 3.46 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 97 M 7.76 3.93 0.00 2.23 2.21 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 2.64 2.63 0.00 98 A 8.26 3.87 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 99 R 8.25 3.81 0.00 2.05 2.06 0.00 3.11 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 100 L 8.01 4.01 0.00 1.75 1.55 0.27 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.78 3.99 0.00 1.85 1.76 1.12 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 102 G 7.99 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 0.00 0.00 0.00 103 E 7.60 4.27 0.00 2.14 2.15 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 2.32 2.36 0.00 104 L 8.67 4.80 0.00 1.70 1.66 1.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.47 4.09 0.00 1.86 1.60 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 V 8.96 4.07 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 0.81 0.00 0.00 0.98 0.00 0.00 107 S 7.59 4.82 0.00 3.89 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 0.00 108 T 8.07 5.15 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 1.24 0.00 0.00 109 D 8.52 4.64 0.00 2.73 2.52 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 0.00 110 D 8.38 5.00 0.00 2.77 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 0.00 111 S 9.34 4.42 0.00 3.83 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.26 3.73 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 0.00 113 N 8.73 5.00 0.00 2.89 3.04 0.00 0.00 5.73 6.67 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 0.00 114 L 8.07 5.32 0.00 1.72 1.57 0.93 0.45 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 0.00 115 A 8.86 5.09 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 0.00 116 V 9.01 4.68 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 0.96 0.00 0.00 0.93 0.00 0.00 117 L 8.93 5.12 0.00 1.42 1.34 0.16 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.89 5.14 0.00 1.66 1.79 0.00 3.36 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 119 T 8.32 5.59 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 1.16 0.00 0.00 120 P 0.00 4.50 0.00 2.11 2.03 0.00 3.61 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 121 P 0.00 4.51 0.00 2.04 1.98 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 122 G 8.49 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 7.96 4.41 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 0.00 124 A 7.74 3.94 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 0.00 125 H 8.22 4.09 0.00 3.23 3.41 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 0.00 126 Y 8.07 4.36 0.00 2.95 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.00 3.72 0.00 1.75 1.58 0.81 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.27 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 0.00 129 S 8.42 4.09 0.00 4.09 4.33 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 0.00 130 A 7.46 3.93 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 0.00 131 I 7.95 3.85 2.01 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.82 1.04 0.00 0.00 132 D 8.44 4.43 0.00 2.86 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 0.00 133 R 7.88 4.04 0.00 1.79 1.99 0.00 3.16 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 134 A 7.79 4.04 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 0.00 135 A 7.81 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 0.00 136 L 7.54 4.08 0.00 1.70 1.56 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.26 0.00 2.02 2.10 0.00 3.63 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 2.00 2.10 0.00 138 Q 8.00 4.27 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 139 V 7.32 4.66 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 0.82 0.00 0.00 0.99 0.00 0.00 140 V 9.12 3.76 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 0.78 0.00 0.00 0.99 0.00 0.00 141 G 7.47 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 0.00 0.00 0.00 142 T 8.47 5.38 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 0.00 143 I 8.61 4.68 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.20 0.90 0.00 0.00 144 A 8.73 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 G 9.14 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 0.00 0.00 0.00 146 D 9.30 4.75 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 D 7.82 5.19 0.00 2.89 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 0.00 148 T 7.71 5.22 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 1.18 0.00 0.00 149 I 8.66 5.00 1.74 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 1.14 0.73 0.82 0.00 0.00 150 L 8.68 4.86 0.00 1.64 1.58 0.91 0.46 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 0.00 151 V 8.69 4.74 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 1.12 0.00 0.00 0.85 0.00 0.00 152 V 8.80 4.53 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 0.93 0.00 0.00 0.94 0.00 0.00 153 A 8.86 4.72 1.28 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 0.00 0.00 0.00 154 R 8.95 4.13 0.00 1.87 1.81 0.00 3.15 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 155 E 8.94 4.23 0.00 1.99 1.88 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 2.32 2.31 0.00 156 P 0.00 4.72 0.00 2.16 2.13 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 157 T 7.51 3.89 4.34 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 1.22 0.00 0.00 158 T 8.13 4.67 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 1.21 0.00 0.00 159 G 8.82 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 0.00 0.00 0.00 160 A 7.98 4.17 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 0.00 161 Q 8.18 3.85 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 162 L 7.84 3.81 0.00 1.99 1.85 0.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 163 A 8.62 4.32 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 0.00 164 G 8.33 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 0.00 165 M 8.68 3.91 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.14 0.00 166 F 8.21 4.28 0.00 3.12 3.02 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 0.00 167 E 8.50 4.10 0.00 2.09 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 0.00 2.57 2.50 0.00 168 N 7.82 4.50 0.00 2.85 2.93 0.00 0.00 7.23 7.83 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 0.00 169 L 7.88 4.17 0.00 1.71 1.73 0.85 0.74 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 0.00 170 R 7.67 4.09 0.00 2.06 1.87 0.00 3.30 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 * Residues marked with a * may have inaccurate shift predictions.