NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 I 4.2857 8.0201 118.5522 59.8954 38.6306 174.5505 11 A 4.0095 8.4787 130.1576 53.2072 22.9471 174.9500 12 P 4.1266 0.0000 0.0000 62.6540 33.6146 174.9018 13 Y 4.0360 7.2629 116.2848 57.3474 38.0857 174.5224 14 P 4.4466 0.0000 0.0000 62.8102 32.2120 175.4107 15 Q 4.6004 8.1221 117.2457 53.9824 30.4647 175.6854 16 A 4.2312 8.4411 123.1187 52.0526 19.1706 178.1525 17 E 4.1788 8.7231 124.8679 56.2635 30.4321 176.5119 18 K 4.2657 8.3603 121.6038 56.5969 32.0001 173.2735 19 G 4.0850 9.2906 113.4977 42.9959 0.0000 172.4182 20 M 5.0179 7.3759 117.6565 53.4322 35.1492 174.6399 21 K 4.7519 8.7534 117.5127 55.6810 36.4885 175.0730 22 R 4.2656 8.4857 122.2845 55.1183 31.3594 175.2961 23 Q 4.6716 8.7547 125.1740 53.9904 32.2950 174.6469 24 V 4.8206 8.2585 121.7821 61.0720 34.9463 174.4289 25 I 4.4318 8.8314 127.4543 59.3569 40.2681 174.1907 26 Q 4.6649 8.4872 127.4414 54.1393 30.8411 174.8640 27 L 4.2199 8.2377 126.6601 54.3311 42.6635 176.8539 28 T 4.3041 8.3451 118.7603 62.1823 69.3152 173.2849 29 P 4.8083 0.0000 0.0000 62.3758 31.9347 175.5552 30 Q 4.7506 8.4138 119.9014 53.5821 32.2953 175.5497 31 E 4.0365 8.7059 118.5949 59.3629 29.7229 177.3268 32 D 4.5010 7.5179 118.6627 52.8561 41.8941 174.5170 33 E 4.2115 8.5148 122.0100 56.8852 29.5705 179.2454 34 S 4.2560 7.9977 117.2215 61.1548 63.3228 174.7190 35 T 4.6639 7.2865 110.6948 61.5170 69.1674 174.7424 36 L 5.2932 7.7734 119.4756 54.6701 46.2452 175.8020 37 K 4.9728 9.0891 119.9092 55.1722 37.6637 175.1696 38 V 4.9985 9.0553 121.0243 61.2987 34.8598 173.5624 39 E 5.0391 9.6917 129.3424 54.5430 31.4827 174.5429 40 L 4.7407 8.6748 128.1575 54.3983 42.9282 176.8503 41 L 4.6506 9.3044 124.5198 53.1849 43.4998 174.5937 42 I 4.7118 7.7055 124.8394 59.8800 39.2701 175.0278 43 G 3.4517 8.3594 113.6000 46.4704 0.0000 171.9088 44 Q 4.9974 7.6647 118.7423 54.6647 34.0028 174.7401 45 T 4.9565 8.6327 118.0140 62.6650 69.4444 174.0452 46 L 4.8945 8.8089 125.9582 52.8023 46.3588 175.3566 47 E 5.0075 8.6227 119.4890 55.2863 30.7336 176.1972 48 V 4.5748 8.9689 117.6701 59.6071 36.6651 175.1964 49 D 4.9418 8.3198 121.8771 51.9414 41.4473 175.1510 50 C 4.3291 8.7060 112.8993 57.9027 41.5252 173.8038 51 N 4.6375 8.1683 117.8521 52.7905 38.9860 174.5126 52 L 4.3637 8.3155 120.2854 54.9448 42.5631 175.7320 53 H 5.5182 8.9222 121.7122 53.8597 31.1586 174.3732 54 R 4.6571 8.6487 118.9347 54.2427 32.4211 174.8119 55 L 4.5209 8.7167 125.1665 54.8926 43.8015 175.6726 56 G 4.1655 9.9105 110.1713 44.4755 0.0000 172.2025 57 G 4.4568 7.8136 105.4895 42.7449 0.0000 172.7199 58 K 4.7498 8.2060 121.6087 54.3172 35.8500 174.4419 59 L 5.2738 8.7380 127.9492 53.5944 43.8224 174.8878 60 E 4.7867 9.0792 126.4212 54.3747 32.9753 173.6804 61 N 4.8385 8.6940 124.6061 52.1618 40.3541 174.0768 62 K 4.5183 8.2283 125.1288 54.5114 36.3398 174.9916 63 T 4.8737 8.0570 113.4573 59.7306 70.9726 173.8044 64 L 4.3786 9.3468 128.7383 54.6016 43.2987 175.9643 65 E 4.1535 9.0197 128.0189 57.5932 30.1532 177.6823 66 G 3.9965 8.9189 112.3295 45.5761 0.0000 173.9404 67 W 4.1341 7.5890 116.2615 55.7865 31.5634 176.3640 68 G 3.9637 8.2625 104.6388 46.5650 0.0000 172.6458 69 Y 5.1085 7.9581 116.1269 56.6365 40.4373 174.3054 70 D 5.5438 8.8113 121.1137 53.0602 43.4911 175.2079 71 Y 5.0463 8.2758 118.7240 55.8875 42.3288 173.1897 72 Y 5.1411 9.5869 117.8883 56.2547 41.9535 175.0404 73 V 4.9627 9.0346 123.6302 61.3199 33.9674 173.8178 74 F 5.4151 9.3350 132.2041 57.3536 40.3440 174.4822 75 D 4.3520 8.1214 125.0571 52.5104 43.1365 174.8938 76 K 3.8637 8.5508 114.0063 57.4935 29.5094 175.5124 77 V 4.2206 7.5782 117.5185 62.8604 32.1153 175.1635 78 S 4.9229 8.3948 122.2368 56.3515 66.8722 173.7130 79 S 4.3848 8.6688 118.0450 57.9851 63.3635 172.5559 80 P 4.6106 0.0000 0.0000 63.6132 31.9500 176.0087 81 V 4.5307 8.5966 115.5062 60.0595 34.4972 175.0103 82 S 5.7162 8.4563 117.7429 55.9989 67.2232 173.6790 83 T 4.1616 8.3359 111.1535 61.1058 69.7223 175.0906 84 M 4.3478 8.0333 123.4154 54.9100 31.1810 174.6918 85 M 4.6464 8.2925 116.1350 53.4742 34.5474 175.5795 86 H 4.6912 8.4248 116.0007 55.2727 29.8964 175.7821 87 C 5.1151 8.3994 119.4746 54.5771 43.3791 172.7381 88 P 4.6337 0.0000 0.0000 62.2484 31.5365 177.5846 89 D 4.4839 7.5824 126.6230 53.9352 42.9622 181.8092 *92 K 4.4352 9.0909 114.7248 57.2796 33.3079 174.2409 93 E 4.7450 8.7389 122.1653 54.5255 32.6105 175.0754 94 K 4.8696 8.4583 120.4794 56.1030 33.3148 176.2400 95 K 4.6027 9.1551 124.7326 54.9306 36.3637 174.9630 96 F 4.9165 8.9060 128.5458 57.8998 39.6665 175.1783 97 V 3.9130 8.8664 128.8939 62.0496 32.0998 175.5621 98 T 4.3809 8.1226 124.6914 62.8629 70.2693 173.7358 99 A 5.0181 8.3841 125.2951 50.0578 20.8770 177.3667 100 Y 4.2784 8.6110 121.9722 56.8988 37.4517 175.3856 101 L 4.0837 8.0933 127.5647 54.6801 43.0068 178.7172 102 G 3.4430 5.9856 107.5367 46.6747 0.0000 176.5939 103 D 3.9533 8.4830 120.8504 56.6194 41.0452 177.7034 104 A 4.1571 7.5587 119.6625 53.6683 18.4602 177.7985 105 G 3.8137 7.5488 102.7192 46.0931 0.0000 173.1974 106 M 4.7639 7.6159 121.4741 54.0541 32.7618 175.2002 107 L 4.6764 8.9429 126.9555 52.8893 44.6800 176.1190 108 R 4.3609 8.3449 121.4939 56.3240 30.9910 175.4037 109 Y 4.0898 8.6935 127.6217 57.3740 39.4601 174.7112 110 N 5.0396 8.3465 126.0346 51.8091 40.5079 174.6581 111 S 4.2445 8.6964 120.9972 59.6977 63.7841 175.9214 112 K 4.1031 8.3347 121.1210 58.6479 31.9547 177.1439 113 L 4.7404 7.1295 116.1092 51.9714 44.5304 174.3704 114 P 4.6188 0.0000 0.0000 62.3520 33.3458 174.8999 115 I 4.3225 8.5488 121.5343 59.7640 39.1923 175.0497 116 V 4.5610 8.3393 126.4450 61.0058 34.0258 174.0534 117 V 5.0595 8.7821 128.3334 61.3556 34.5711 173.5017 118 Y 5.2417 9.6755 126.0148 56.7031 40.0445 174.9988 119 T 5.4662 8.6699 112.9228 59.2208 73.3605 171.7273 120 P 4.7585 0.0000 0.0000 62.4145 31.9316 177.3932 121 D 4.4262 8.8041 120.4524 57.5602 40.7825 178.2866 122 N 4.7583 8.1389 113.1415 52.8557 37.8408 174.2665 123 V 4.5915 7.7171 119.7439 61.6769 33.2781 174.7131 124 D 5.0421 9.4042 127.7678 52.9875 43.4017 175.4326 125 V 4.8277 8.2293 121.1324 61.2622 34.0467 174.7137 126 K 4.9016 9.1368 126.4859 55.1810 36.6946 174.0869 127 Y 5.3187 7.6726 117.1538 56.6093 40.7488 173.9478 128 R 4.6673 9.1382 119.7113 54.8552 34.0843 173.6898 129 V 4.9936 8.4766 124.7802 61.6100 33.2880 174.8080 130 W 4.8229 9.3162 126.7445 54.7373 32.2634 174.5112 131 K 5.1004 8.6054 123.5549 54.3848 34.1370 175.5296 132 A 4.3201 8.8436 129.7872 51.7505 19.1355 176.7644 133 E 4.1275 8.6590 121.9082 55.7340 31.0893 177.1490 134 E 4.3419 8.4569 127.3067 53.8586 28.3000 176.3832 135 K 4.3263 7.1725 115.6288 55.6913 36.6820 175.5268 136 I 4.3974 8.4369 124.3185 59.7466 39.2175 174.8337 137 D 4.8869 8.5435 124.8900 52.7971 43.0872 175.2565 138 N 4.9412 8.2068 116.6369 51.2963 40.9867 174.9222 139 A 4.3400 8.2686 123.9819 51.7773 19.5701 176.8194 140 V 4.3429 7.8716 117.9973 60.9855 34.0822 175.0226 141 V 3.9792 8.3189 126.4921 62.2972 31.6859 175.9751 142 R 4.2062 8.2944 125.4618 56.6675 31.0291 174.9361 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 10 I 8.02 4.29 1.87 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 1.35 1.21 0.91 0.00 0.00 11 A 8.48 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.13 0.00 0.65 0.61 0.00 2.69 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.60 0.00 13 Y 7.26 4.04 0.00 2.94 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.45 0.00 2.01 1.94 0.00 3.61 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 15 Q 8.12 4.60 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 16 A 8.44 4.23 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 17 E 8.72 4.18 0.00 2.06 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 0.00 2.38 2.27 0.00 18 K 8.36 4.27 0.00 1.77 1.62 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.01 7.81 19 G 9.29 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 20 M 7.38 5.02 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 21 K 8.75 4.75 0.00 1.77 1.87 0.00 1.30 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.41 7.81 22 R 8.49 4.27 0.00 1.67 1.72 0.00 2.95 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.64 0.00 23 Q 8.75 4.67 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.21 2.20 0.00 24 V 8.26 4.82 1.97 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 0.73 0.00 0.00 0.73 0.00 0.00 25 I 8.83 4.43 1.50 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.42 -0.15 0.00 0.00 26 Q 8.49 4.66 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.99 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 27 L 8.24 4.22 0.00 1.33 1.09 -0.12 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.35 4.30 4.36 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 1.26 0.00 0.00 29 P 0.00 4.81 0.00 2.07 2.03 0.00 3.71 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 30 Q 8.41 4.75 0.00 1.82 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.06 0.00 0.00 0.00 0.00 0.00 2.30 1.81 0.00 31 E 8.71 4.04 0.00 1.93 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 2.31 2.29 0.00 32 D 7.52 4.50 0.00 2.67 2.45 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 33 E 8.51 4.21 0.00 2.12 2.25 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 2.30 2.33 0.00 34 S 8.00 4.26 0.00 3.98 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 35 T 7.29 4.66 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 36 L 7.77 5.29 0.00 1.32 1.43 0.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 37 K 9.09 4.97 0.00 1.76 1.65 0.00 1.53 0.00 0.00 1.46 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.41 7.81 38 V 9.06 5.00 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 0.86 0.00 0.00 0.86 0.00 0.00 39 E 9.69 5.04 0.00 2.25 2.31 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 2.33 2.29 0.00 40 L 8.67 4.74 0.00 1.46 1.50 0.55 1.06 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 41 L 9.30 4.65 0.00 1.63 1.85 0.97 0.80 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 42 I 7.71 4.71 1.31 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.53 -0.02 0.00 0.00 43 G 8.36 3.45 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 0.00 0.00 0.00 44 Q 7.66 5.00 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.75 0.00 0.00 0.00 0.00 0.00 2.55 2.33 0.00 45 T 8.63 4.96 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 1.26 0.00 0.00 46 L 8.81 4.89 0.00 1.53 1.52 0.91 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.62 5.01 0.00 1.84 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 2.24 2.32 0.00 48 V 8.97 4.57 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.88 0.00 0.00 49 D 8.32 4.94 0.00 2.78 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 50 C 8.71 4.33 0.00 3.11 3.29 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 51 N 8.17 4.64 0.00 3.00 2.74 0.00 0.00 7.00 7.13 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 52 L 8.32 4.36 0.00 1.63 1.61 0.92 0.94 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 53 H 8.92 5.52 0.00 2.96 3.21 0.00 5.84 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.65 4.66 0.00 1.87 2.00 0.00 2.73 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 55 L 8.72 4.52 0.00 1.81 1.58 1.12 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 56 G 9.91 4.17 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 0.00 0.00 0.00 57 G 7.81 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.21 4.75 0.00 1.78 1.56 0.00 1.63 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.39 7.81 59 L 8.74 5.27 0.00 1.91 1.66 1.14 0.88 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 60 E 9.08 4.79 0.00 2.09 1.75 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 2.14 2.20 0.00 61 N 8.69 4.84 0.00 2.77 2.60 0.00 0.00 6.84 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 62 K 8.23 4.52 0.00 0.79 0.87 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.16 1.13 7.81 63 T 8.06 4.87 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 1.21 0.00 0.00 64 L 9.35 4.38 0.00 2.12 1.71 0.91 0.02 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 65 E 9.02 4.15 0.00 2.09 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 66 G 8.92 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 67 W 7.59 4.13 0.00 3.07 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 0.00 0.00 0.00 68 G 8.26 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 69 Y 7.96 5.11 0.00 2.95 3.01 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 70 D 8.81 5.54 0.00 2.58 2.28 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 71 Y 8.28 5.05 0.00 3.30 3.13 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 72 Y 9.59 5.14 0.00 3.01 2.97 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 73 V 9.03 4.96 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 1.02 0.00 0.00 1.11 0.00 0.00 74 F 9.33 5.42 0.00 3.08 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 75 D 8.12 4.35 0.00 2.60 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 76 K 8.55 3.86 0.00 1.85 1.83 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.32 7.81 77 V 7.58 4.22 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 1.27 0.00 0.00 0.86 0.00 0.00 78 S 8.39 4.92 0.00 3.78 3.69 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 79 S 8.67 4.38 0.00 3.76 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 80 P 0.00 4.61 0.00 1.99 2.05 0.00 3.66 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 2.05 2.15 0.00 81 V 8.60 4.53 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 0.96 0.00 0.00 82 S 8.46 5.72 0.00 3.54 3.45 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 83 T 8.34 4.16 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 84 M 8.03 4.35 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 85 M 8.29 4.65 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.79 0.00 86 H 8.42 4.69 0.00 3.18 3.25 0.00 5.65 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 87 C 8.40 5.12 0.00 2.95 2.98 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 88 P 0.00 4.63 0.00 2.04 2.05 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 89 D 7.58 4.48 0.00 2.69 1.73 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 *92 K 9.09 4.44 0.00 1.66 1.89 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 93 E 8.74 4.74 0.00 2.04 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 2.20 2.26 0.00 94 K 8.46 4.87 0.00 1.67 1.79 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.44 7.81 95 K 9.16 4.60 0.00 1.76 1.58 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.44 7.81 96 F 8.91 4.92 0.00 2.99 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 97 V 8.87 3.91 1.97 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 0.92 0.00 0.00 0.95 0.00 0.00 98 T 8.12 4.38 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 1.18 0.00 0.00 99 A 8.38 5.02 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 0.00 100 Y 8.61 4.28 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.09 4.08 0.00 1.61 1.60 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 102 G 5.99 3.44 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 0.00 103 D 8.48 3.95 0.00 2.68 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 0.00 104 A 7.56 4.16 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 0.00 105 G 7.55 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 0.00 0.00 0.00 106 M 7.62 4.76 0.00 1.83 1.80 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 107 L 8.94 4.68 0.00 1.48 1.47 0.36 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 108 R 8.34 4.36 0.00 1.85 1.86 0.00 3.28 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 109 Y 8.69 4.09 0.00 3.09 2.84 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 0.00 110 N 8.35 5.04 0.00 2.80 2.60 0.00 0.00 6.90 7.63 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 0.00 111 S 8.70 4.24 0.00 4.12 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 0.00 112 K 8.33 4.10 0.00 1.81 1.92 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.58 7.81 113 L 7.13 4.74 0.00 1.61 1.40 0.53 0.33 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 0.00 114 P 0.00 4.62 0.00 1.94 1.97 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 115 I 8.55 4.32 1.62 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.45 0.73 0.00 0.00 116 V 8.34 4.56 1.73 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 0.58 0.00 0.00 0.07 0.00 0.00 117 V 8.78 5.06 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 1.16 0.00 0.00 0.86 0.00 0.00 118 Y 9.68 5.24 0.00 3.04 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 0.00 119 T 8.67 5.47 4.49 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 1.35 0.00 0.00 120 P 0.00 4.76 0.00 2.29 2.07 0.00 3.87 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 121 D 8.80 4.43 0.00 2.75 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 0.00 122 N 8.14 4.76 0.00 2.85 2.95 0.00 0.00 5.81 7.68 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 0.00 123 V 7.72 4.59 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 0.89 0.00 0.00 1.12 0.00 0.00 124 D 9.40 5.04 0.00 3.00 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 0.00 125 V 8.23 4.83 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 0.77 0.00 0.00 0.92 0.00 0.00 126 K 9.14 4.90 0.00 1.52 1.42 0.00 0.90 0.00 0.00 1.28 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 0.82 7.81 127 Y 7.67 5.32 0.00 2.99 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 R 9.14 4.67 0.00 1.83 1.83 0.00 2.67 0.00 0.00 2.93 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.41 0.00 129 V 8.48 4.99 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 1.09 0.00 0.00 1.26 0.00 0.00 130 W 9.32 4.82 0.00 3.32 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 0.00 131 K 8.61 5.10 0.00 1.72 1.66 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.38 7.81 132 A 8.84 4.32 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 0.00 133 E 8.66 4.13 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 134 E 8.46 4.34 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 135 K 7.17 4.33 0.00 1.90 1.66 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.42 7.81 136 I 8.44 4.40 1.88 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 1.42 0.62 0.92 0.00 0.00 137 D 8.54 4.89 0.00 2.66 2.60 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 0.00 0.00 0.00 0.00 138 N 8.21 4.94 0.00 2.68 2.70 0.00 0.00 6.86 7.35 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 0.00 139 A 8.27 4.34 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 0.00 140 V 7.87 4.34 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 0.93 0.00 0.00 141 V 8.32 3.98 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 0.86 0.00 0.00 0.93 0.00 0.00 142 R 8.29 4.21 0.00 1.78 1.74 0.00 3.29 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 1.53 1.62 0.00 * Residues marked with a * may have inaccurate shift predictions.