NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.2549 8.0433 122.7093 55.0050 44.0208 175.0242 3 Y 4.7762 8.4048 123.1548 55.7379 40.9439 172.9976 4 L 4.9101 8.6812 125.8235 53.9381 43.1081 176.6958 5 T 5.1458 8.7230 113.7668 60.5175 70.2170 173.7814 6 Q 4.6194 7.8635 119.4194 55.0333 32.5673 173.3004 7 R 4.8973 8.3411 120.6507 54.3019 31.9224 175.6961 8 L 4.1103 8.3598 128.1067 54.6574 41.9828 177.9603 9 E 3.9645 9.0240 125.1019 58.3939 29.6126 176.4425 10 I 4.3101 7.1398 116.9762 58.4674 38.7839 172.2060 11 P 4.2916 0.0000 0.0000 62.3161 31.6645 178.1663 12 A 4.2958 7.9955 134.1515 51.6662 17.9611 180.3246 13 A 4.4143 7.1353 115.3197 57.4856 19.7479 177.9252 14 A 3.1858 7.5855 120.5527 50.3016 21.2480 178.6396 15 T 3.4031 9.5042 110.9053 62.7968 66.3499 171.2427 16 A 4.7592 7.0902 124.6817 52.1138 21.7748 176.1894 17 S 5.2541 7.8511 113.8119 57.1344 67.5398 173.1055 18 V 4.7549 8.7132 119.3201 60.7197 34.6368 173.7949 19 T 5.0064 8.5828 122.0409 62.4664 69.6197 174.2066 20 L 4.9692 8.9998 126.3325 52.2885 46.5202 174.9733 21 P 4.8823 0.0000 0.0000 61.6631 32.7887 176.8869 22 I 3.7053 8.7051 118.4202 64.1452 37.4322 177.2335 23 D 4.3567 8.1373 118.2317 55.3308 39.6324 177.5683 24 V 4.0690 7.5224 117.9415 64.2864 32.5567 177.0259 25 R 4.2007 8.1721 116.7096 57.2656 30.0071 177.3088 26 V 4.6079 7.1726 112.3262 60.2820 33.2411 175.5956 27 K 4.7558 7.3578 115.5519 54.9650 35.8172 176.4219 28 S 4.7093 8.6043 115.6665 58.6664 65.8809 173.8955 29 R 5.2117 7.5177 118.2059 54.5790 32.3518 175.8288 30 V 4.2012 8.1846 120.1238 60.9055 35.1009 171.0815 31 K 4.5980 8.8834 125.5796 55.5193 33.2725 175.5474 32 V 4.6643 8.8186 120.5944 59.7795 36.1456 174.1610 33 T 4.9533 8.1622 116.6417 61.8507 71.3657 174.7916 34 L 4.2846 9.2044 126.8349 54.5023 42.2415 177.9348 35 N 4.4271 9.3800 120.6067 55.1227 38.4483 175.3901 36 D 4.6651 7.9185 116.7437 52.8005 40.1591 177.0511 37 G 4.0130 8.4188 109.2881 45.3367 0.0000 174.3244 38 R 4.3804 7.9701 118.3053 55.8006 31.7946 175.2092 39 D 5.3686 8.4587 120.3483 53.0146 43.1314 175.7972 40 A 4.5727 8.9135 122.6141 50.4271 23.4040 175.0732 41 G 4.3109 8.1587 107.8152 44.4151 0.0000 172.5992 42 L 4.9515 9.2040 125.6025 53.1561 43.0604 177.1463 43 L 5.1330 9.0833 126.3263 53.6259 41.1953 176.2411 44 L 4.8010 8.2100 118.9532 53.3560 43.3324 177.4424 45 P 4.3548 0.0000 0.0000 62.4213 31.9065 177.0846 46 R 4.0793 7.7505 120.3243 56.9747 30.5716 176.0240 47 G 3.8532 8.6799 105.3916 47.0345 0.0000 173.5464 48 L 4.8083 7.8211 116.8175 52.2675 45.4990 176.0784 49 L 4.7960 8.1793 121.7476 53.2467 44.4770 175.7702 50 L 4.4431 8.6625 127.6711 54.7093 42.2708 176.9659 51 R 4.6541 8.7816 122.4946 53.7427 33.3554 176.0446 52 G 3.9324 9.1382 111.2900 47.4982 0.0000 172.6627 53 G 4.1096 9.2920 110.8052 45.1806 0.0000 173.9926 54 D 4.5652 7.7497 118.6095 54.8825 42.4420 176.3765 55 V 4.8654 8.3085 119.8156 61.3421 34.4490 174.4156 56 L 4.8963 9.3268 128.2095 53.8211 44.0914 175.4221 57 S 5.5235 9.1968 115.5416 56.2062 66.8625 172.6242 58 N 5.1046 8.4845 120.4875 50.8850 39.0245 175.2493 59 E 4.0463 8.8651 116.0494 59.5988 29.6355 178.7750 60 E 3.9755 8.2213 115.6092 55.9477 29.8973 176.3405 61 G 3.8750 7.6549 108.0501 47.4411 0.0000 174.0798 62 T 4.4866 8.9891 104.5284 60.6409 70.1731 173.4747 63 E 4.5521 7.0661 122.1002 54.9748 33.3256 173.6023 64 F 5.5217 8.7326 123.4982 55.7444 42.8940 174.3383 65 V 4.6455 9.3551 122.5448 61.1707 34.9202 173.7605 66 Q 4.8689 9.1914 129.4781 54.9315 30.9296 174.3877 67 V 4.3850 8.8701 127.3553 62.4406 33.0949 174.5310 68 I 4.8629 8.7239 128.6673 59.0380 40.1185 174.8451 69 A 4.6050 8.7204 129.2862 51.9129 18.9215 177.1161 70 A 4.3101 8.7547 124.7779 51.5993 20.0570 176.4995 71 D 4.8767 8.5004 118.8333 54.6039 41.9715 175.9933 72 E 4.7483 8.8325 119.6297 54.6975 35.0134 174.6227 73 E 4.1871 8.7509 121.5449 56.5414 30.4719 176.3182 74 V 4.6187 7.9661 117.8848 59.3208 36.2060 175.0730 75 S 4.7332 8.2344 118.9857 57.4416 64.6532 173.4228 76 V 4.4744 9.2649 124.5607 61.0021 34.2745 174.4893 77 V 4.6499 8.6891 126.7742 61.3072 34.1708 174.1546 78 R 5.3392 7.9453 123.6768 53.8241 32.6436 174.9463 79 C 4.6732 8.3810 121.4272 58.7148 34.0917 173.4732 80 D 4.3879 8.8206 123.9766 56.7911 40.8989 176.3231 81 D 4.6226 7.9232 118.9159 52.5936 40.7149 174.0639 82 P 4.3795 0.0000 0.0000 65.2931 31.7919 178.6272 83 F 4.6578 8.6104 118.0322 59.0678 38.7333 176.4448 *85 L 4.2546 7.9582 121.0418 54.3650 43.7389 179.1187 86 A 3.9569 7.8284 120.2371 55.1665 18.3560 179.8076 87 K 3.7259 7.5353 116.3286 59.4038 31.8889 179.5294 88 A 3.9999 7.6853 120.5697 55.3748 18.4212 179.3130 89 C 4.1118 8.4567 115.6590 62.9198 28.0346 175.8783 90 Y 4.0436 8.1241 121.0482 60.7209 38.2531 177.6935 91 A 3.8514 7.7442 120.2045 55.0861 18.8065 179.3190 92 L 4.1106 8.3845 118.1107 57.6516 41.6869 179.7964 93 G 3.5910 8.2569 106.2397 47.9436 0.0000 175.5365 94 N 4.2022 7.9349 117.8691 55.3207 37.8845 176.6820 95 R 4.1998 7.5058 117.2710 55.3630 30.1137 176.5031 96 H 4.1561 7.5499 114.6213 56.5796 26.7753 175.0195 97 V 3.7637 7.1362 120.6388 61.4966 30.9312 174.0950 98 P 4.3860 0.0000 0.0000 63.4417 31.6088 175.3496 99 L 5.2237 8.3039 122.3863 53.5581 46.3428 174.1909 100 Q 4.6928 9.5483 127.4200 55.0474 30.3061 174.4797 101 I 4.6815 8.2649 126.7935 59.0800 39.7825 173.4881 *103 P 4.0022 0.0000 0.0000 63.5155 32.3576 177.6886 104 G 4.0394 9.0292 109.5958 45.9414 0.0000 172.0196 105 E 5.1788 7.8025 118.2493 54.7553 33.0423 174.2436 106 L 5.2508 9.2339 125.7368 53.2694 46.0749 175.7437 107 R 5.1942 8.9827 119.1983 54.5621 34.8082 173.8612 108 Y 4.8983 7.5627 119.9388 55.2564 42.1562 173.6980 109 H 4.3039 8.5768 117.1260 56.2859 29.2818 174.9431 110 H 4.5183 8.2806 122.7931 56.3478 30.4292 174.2027 111 D 4.5059 8.6298 124.3825 52.4050 43.6825 175.3056 112 H 4.2878 8.8494 124.9678 58.6801 28.4672 177.9792 113 V 3.5522 8.0272 119.7536 66.1291 31.5525 177.7964 114 L 4.0454 8.1109 116.7319 57.6907 41.6879 178.8670 115 D 4.7034 8.3240 118.9612 57.4176 41.0101 180.8712 116 D 4.2865 8.0794 119.5328 54.2147 40.8881 178.5442 *118 L 4.2454 8.0139 121.1617 54.8518 44.0236 179.7045 119 R 4.4826 7.6721 118.9950 58.6607 29.6179 178.8766 120 Q 4.0650 7.5695 116.4681 58.0480 28.6905 177.4741 121 F 4.9931 7.6868 117.1665 57.1062 39.1755 176.4599 122 G 3.9768 8.0108 106.8684 45.6435 0.0000 173.9149 123 L 4.4324 7.6393 119.2775 54.0992 42.6247 175.4825 124 T 4.7381 8.3434 117.9845 62.0709 70.5462 173.3874 125 V 4.8667 8.4798 126.9820 61.4637 33.3045 174.5558 126 T 4.8587 8.9005 117.4000 59.9774 72.5510 171.9626 127 F 4.8419 8.3066 122.4644 56.7533 42.3116 174.3453 128 G 3.8651 6.5462 107.4097 45.8406 0.0000 172.7477 129 Q 4.8818 8.6833 120.5229 54.2996 29.6908 174.9725 130 L 4.9037 8.4936 123.6013 51.8645 46.9637 174.1638 131 P 5.4012 0.0000 0.0000 62.7614 31.9231 175.3500 132 F 5.0807 8.9092 125.8512 56.8766 40.9414 174.8351 133 E 4.3409 10.1245 128.6622 53.4055 29.1320 173.6271 134 P 4.2095 0.0000 0.0000 61.6943 32.4930 176.8179 135 E 3.7023 8.4672 119.6065 56.2656 30.0657 177.5576 136 A 4.0273 8.7725 126.7855 55.4453 19.1691 179.0316 137 G 3.9154 7.7757 104.0061 44.4836 0.0000 173.4359 138 A 4.2136 7.3529 124.3159 52.5526 19.3457 176.3184 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 2 L 8.04 4.25 0.00 1.71 1.47 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 8.40 4.78 0.00 3.10 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 4 L 8.68 4.91 0.00 1.62 1.61 0.91 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.72 5.15 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 1.25 0.00 0.00 6 Q 7.86 4.62 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 7 R 8.34 4.90 0.00 1.83 1.88 0.00 3.25 0.00 0.00 3.37 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 8 L 8.36 4.11 0.00 1.82 1.84 1.29 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 9 E 9.02 3.96 0.00 1.92 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 2.31 2.43 0.00 10 I 7.14 4.31 1.88 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 0.80 0.89 0.00 0.00 11 P 0.00 4.29 0.00 2.01 2.07 0.00 3.67 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 12 A 8.00 4.30 0.39 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 13 A 7.14 4.41 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.59 3.19 1.19 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 0.00 0.00 0.00 0.00 0.00 15 T 9.50 3.40 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 16 A 7.09 4.76 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 17 S 7.85 5.25 0.00 3.95 3.93 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 18 V 8.71 4.75 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 0.91 0.00 0.00 1.00 0.00 0.00 19 T 8.58 5.01 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 20 L 9.00 4.97 0.00 1.52 1.50 0.93 0.78 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 21 P 0.00 4.88 0.00 2.48 2.23 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.97 0.00 22 I 8.71 3.71 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.22 1.17 0.00 0.00 23 D 8.14 4.36 0.00 2.90 2.83 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 0.00 0.00 0.00 24 V 7.52 4.07 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 0.92 0.00 0.00 0.95 0.00 0.00 25 R 8.17 4.20 0.00 1.98 2.07 0.00 3.37 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 26 V 7.17 4.61 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 0.80 0.00 0.00 1.02 0.00 0.00 27 K 7.36 4.76 0.00 1.81 1.66 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.53 1.38 7.81 28 S 8.60 4.71 0.00 3.76 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 29 R 7.52 5.21 0.00 1.66 1.84 0.00 3.43 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 30 V 8.18 4.20 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 0.65 0.00 0.00 0.94 0.00 0.00 31 K 8.88 4.60 0.00 1.81 1.76 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.40 7.81 32 V 8.82 4.66 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 0.68 0.00 0.00 0.93 0.00 0.00 33 T 8.16 4.95 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 1.30 0.00 0.00 34 L 9.20 4.28 0.00 1.84 1.56 0.92 0.58 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 35 N 9.38 4.43 0.00 2.63 2.88 0.00 0.00 6.88 7.94 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 36 D 7.92 4.67 0.00 2.77 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 G 8.42 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 0.00 0.00 0.00 38 R 7.97 4.38 0.00 1.88 1.81 0.00 3.08 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.95 0.00 39 D 8.46 5.37 0.00 2.48 2.50 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 40 A 8.91 4.57 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.16 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 0.00 0.00 0.00 0.00 42 L 9.20 4.95 0.00 1.74 1.63 0.93 0.49 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 43 L 9.08 5.13 0.00 1.71 1.58 1.10 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.21 4.80 0.00 1.56 1.60 0.95 0.85 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 45 P 0.00 4.35 0.00 2.04 1.98 0.00 3.69 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 46 R 7.75 4.08 0.00 1.80 1.87 0.00 3.50 0.00 0.00 2.68 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 47 G 8.68 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 48 L 7.82 4.81 0.00 1.59 1.53 0.93 0.94 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 49 L 8.18 4.80 0.00 1.58 1.50 0.89 0.95 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 50 L 8.66 4.44 0.00 1.59 1.60 0.93 0.69 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 51 R 8.78 4.65 0.00 1.87 1.79 0.00 3.31 0.00 0.00 3.36 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.52 0.00 52 G 9.14 3.93 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 0.00 53 G 9.29 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 54 D 7.75 4.57 0.00 2.81 2.65 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 0.00 0.00 0.00 0.00 55 V 8.31 4.87 2.14 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 1.19 0.00 0.00 1.01 0.00 0.00 56 L 9.33 4.90 0.00 1.61 1.56 0.93 0.72 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 57 S 9.20 5.52 0.00 3.82 3.59 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 58 N 8.48 5.10 0.00 2.83 2.89 0.00 0.00 6.42 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 59 E 8.87 4.05 0.00 2.16 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 0.00 2.36 2.29 0.00 60 E 8.22 3.98 0.00 2.08 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 0.00 2.34 2.23 0.00 61 G 7.65 3.88 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 0.00 0.00 0.00 62 T 8.99 4.49 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 1.20 0.00 0.00 63 E 7.07 4.55 0.00 1.92 1.58 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 2.21 2.34 0.00 64 F 8.73 5.52 0.00 3.05 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 65 V 9.36 4.65 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 0.95 0.00 0.00 0.93 0.00 0.00 66 Q 9.19 4.87 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 67 V 8.87 4.38 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 0.89 0.00 0.00 0.94 0.00 0.00 68 I 8.72 4.86 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 1.17 0.71 0.92 0.00 0.00 69 A 8.72 4.60 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.75 4.31 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 71 D 8.50 4.88 0.00 2.58 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 72 E 8.83 4.75 0.00 1.87 1.76 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 2.27 2.35 0.00 73 E 8.75 4.19 0.00 2.00 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 2.58 2.74 0.00 74 V 7.97 4.62 1.70 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 0.32 0.00 0.00 0.70 0.00 0.00 75 S 8.23 4.73 0.00 2.72 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 76 V 9.26 4.47 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 0.97 0.00 0.00 0.77 0.00 0.00 77 V 8.69 4.65 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 1.02 0.00 0.00 1.04 0.00 0.00 78 R 7.95 5.34 0.00 1.76 1.79 0.00 3.20 0.00 0.00 3.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.37 0.00 79 C 8.38 4.67 0.00 2.97 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 80 D 8.82 4.39 0.00 2.73 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 81 D 7.92 4.62 0.00 2.69 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 82 P 0.00 4.38 0.00 2.27 2.13 0.00 3.71 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 2.14 2.11 0.00 83 F 8.61 4.66 0.00 2.94 3.28 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 *85 L 7.96 4.25 0.00 1.78 1.76 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.83 3.96 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 87 K 7.54 3.73 0.00 1.33 1.33 0.00 1.20 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.06 0.85 7.81 88 A 7.69 4.00 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 89 C 8.46 4.11 0.00 3.20 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 90 Y 8.12 4.04 0.00 3.09 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 91 A 7.74 3.85 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 92 L 8.38 4.11 0.00 1.73 1.66 0.93 0.70 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 93 G 8.26 3.59 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 0.00 0.00 0.00 94 N 7.93 4.20 0.00 2.61 2.69 0.00 0.00 7.05 8.38 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 95 R 7.51 4.20 0.00 1.75 1.86 0.00 3.17 0.00 0.00 3.09 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 96 H 7.55 4.16 0.00 3.33 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.14 3.76 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 0.66 0.00 0.00 0.83 0.00 0.00 98 P 0.00 4.39 0.00 2.44 2.16 0.00 3.85 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.13 0.00 99 L 8.30 5.22 0.00 2.01 1.56 1.25 0.81 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 0.00 100 Q 9.55 4.69 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.49 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 101 I 8.26 4.68 1.89 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 1.40 0.79 0.94 0.00 0.00 *103 P 0.00 4.00 0.00 2.21 2.03 0.00 3.74 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 2.01 2.10 0.00 104 G 9.03 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 0.00 0.00 0.00 105 E 7.80 5.18 0.00 1.98 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 2.23 2.42 0.00 106 L 9.23 5.25 0.00 1.66 1.63 1.02 0.75 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 0.00 107 R 8.98 5.19 0.00 1.89 1.70 0.00 3.18 0.00 0.00 3.31 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 0.00 108 Y 7.56 4.90 0.00 2.98 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 0.00 109 H 8.58 4.30 0.00 3.06 3.27 0.00 5.93 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 0.00 110 H 8.28 4.52 0.00 3.14 3.39 0.00 5.80 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.63 4.51 0.00 2.75 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 0.00 112 H 8.85 4.29 0.00 3.18 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.03 3.55 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 0.80 0.00 0.00 0.92 0.00 0.00 114 L 8.11 4.05 0.00 1.76 1.46 0.52 0.85 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 0.00 115 D 8.32 4.70 0.00 2.93 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 0.00 116 D 8.08 4.29 0.00 2.66 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 *118 L 8.01 4.25 0.00 1.81 1.89 1.17 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.67 4.48 0.00 2.04 1.96 0.00 3.27 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 120 Q 7.57 4.07 0.00 1.64 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.01 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 121 F 7.69 4.99 0.00 3.22 2.89 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 0.00 122 G 8.01 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 0.00 0.00 0.00 123 L 7.64 4.43 0.00 1.99 1.67 1.10 0.74 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 0.00 124 T 8.34 4.74 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 1.23 0.00 0.00 125 V 8.48 4.87 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 0.98 0.00 0.00 1.02 0.00 0.00 126 T 8.90 4.86 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 1.23 0.00 0.00 127 F 8.31 4.84 0.00 2.94 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 G 6.55 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 8.68 4.88 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 130 L 8.49 4.90 0.00 1.48 1.46 0.85 0.80 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 0.00 131 P 0.00 5.40 0.00 2.09 2.08 0.00 3.31 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.81 0.00 132 F 8.91 5.08 0.00 2.83 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 0.00 133 E 10.12 4.34 0.00 1.70 1.74 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 2.18 2.31 0.00 134 P 0.00 4.21 0.00 1.97 1.30 0.00 3.34 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.49 0.00 135 E 8.47 3.70 0.00 1.97 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 2.51 2.47 0.00 136 A 8.77 4.03 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 0.00 137 G 7.78 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 0.00 138 A 7.35 4.21 1.19 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 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.