NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 3.9810 8.1227 122.3745 51.6955 20.4994 175.0126 2 V 4.3453 8.3558 123.9057 59.8623 32.4676 173.5039 3 S 4.8638 9.0681 123.2545 56.4487 66.1764 172.1758 4 L 5.1036 8.2461 124.0336 53.2972 44.0763 176.2760 5 D 4.6967 8.7857 124.9789 54.7330 39.6645 175.9273 6 R 4.6394 7.6171 114.5858 55.8627 32.3140 174.8590 7 T 4.4625 8.2460 107.6829 61.5261 69.5022 174.0322 8 R 4.7834 7.3078 116.4560 55.7266 32.3079 173.9131 9 A 4.7301 8.8558 121.2059 50.2861 22.6995 175.0302 10 V 4.7932 8.5689 121.8173 61.1703 33.7581 174.5313 11 F 4.3482 9.2838 131.3033 56.5022 41.0655 174.4016 12 D 4.7320 8.2823 127.3689 53.5828 40.4625 176.6358 13 G 4.2361 8.8938 116.8694 48.1315 0.0000 172.6607 14 S 4.4160 8.7139 113.0043 59.0622 63.3989 173.4732 15 E 4.8312 8.3257 120.3309 54.5407 32.5811 176.0467 16 K 4.4340 8.5854 119.3779 58.9612 32.9342 176.8007 17 S 5.5457 7.6310 110.0934 57.5768 64.8708 172.7632 *19 T 4.3485 8.1982 108.9771 62.1804 69.7115 173.1861 20 L 4.7405 8.4424 122.9533 53.0637 44.4968 175.7913 21 D 4.9835 9.3772 124.2336 53.7081 42.5347 175.6907 22 I 5.7327 8.6914 115.9016 58.2805 41.9692 173.8425 23 S 4.8756 8.0368 113.3327 57.9308 65.7199 174.7499 24 N 5.0017 8.5678 120.9632 52.4042 39.9670 174.4579 25 D 4.7172 8.8781 126.1931 54.1526 42.1475 176.1705 26 N 4.6084 8.2996 119.7912 52.8494 38.9668 175.0522 27 K 4.5631 8.5210 126.5023 56.7884 32.5777 177.6354 28 Q 4.6517 8.0138 116.3678 57.0906 35.1245 174.7971 29 L 4.7109 7.5901 116.4090 52.9198 42.9742 174.8714 30 P 4.9006 0.0000 0.0000 63.0013 32.8608 174.5018 31 Y 4.8414 9.5432 116.6056 56.7176 42.8591 174.3444 32 L 5.1708 8.8886 121.1905 53.1825 45.0349 175.7256 33 A 5.0932 9.2064 123.6246 50.3690 21.9919 175.1681 34 Q 4.8943 9.6239 122.3598 55.9869 30.4248 175.3624 35 A 5.0149 9.5128 125.5138 49.8769 22.3098 174.9867 36 W 5.1069 8.0680 118.5011 55.6617 32.5193 173.3365 37 I 5.0868 8.6678 119.7403 59.6541 40.1317 174.8186 38 E 5.4289 9.3237 124.5338 54.8216 33.7364 175.3555 39 N 5.2901 8.9075 119.6311 51.4806 40.0457 175.0063 40 E 3.8113 8.7131 118.5938 59.7503 29.4561 177.7645 41 N 4.7716 8.2863 112.3506 52.8667 38.6548 174.7297 42 Q 3.6873 8.9005 116.6995 56.9748 26.6509 173.0129 43 E 4.4514 8.9230 118.6015 54.5190 30.4876 176.2123 44 K 4.6358 8.5865 125.1999 56.8725 32.9109 175.8825 45 I 4.7385 8.6442 124.9030 60.0417 40.9787 175.2361 46 I 4.4284 8.4973 123.4756 61.3451 38.8590 176.2064 47 T 4.3187 7.7667 108.9549 60.8292 69.1173 172.6178 48 G 3.6266 8.0615 107.3750 43.5908 0.0000 171.9669 49 P 4.9315 0.0000 0.0000 63.5170 32.1078 176.0071 50 V 4.6860 7.2257 120.3855 61.0112 34.2535 174.4256 51 I 4.8005 8.7003 119.9098 59.0924 41.2509 173.6970 52 A 5.3452 8.6677 125.3606 50.9991 20.9071 176.5424 53 T 4.8127 9.1044 118.6901 61.3711 72.3861 171.9335 54 P 4.8456 0.0000 0.0000 61.4156 33.2489 174.9582 55 P 4.7285 0.0000 0.0000 65.2211 32.2752 176.4324 56 V 5.5147 7.6074 113.2672 62.3227 34.9807 173.6339 57 Q 4.7171 8.4533 122.0507 55.1443 31.6931 173.0152 58 R 4.7791 8.5826 121.7295 55.8064 31.6592 175.4671 59 L 4.8111 10.2993 124.7002 52.8800 44.9590 176.1602 60 E 4.6273 8.8821 123.8561 54.8608 31.1329 174.7637 61 P 4.7682 0.0000 0.0000 64.1422 31.2424 176.8134 62 G 3.8449 8.8136 109.2341 45.6067 0.0000 173.5645 63 A 4.2771 8.2308 123.7362 51.5646 19.2853 177.1653 64 K 4.9961 7.8842 119.6976 55.1836 35.4208 176.4844 65 S 4.2987 8.1385 113.2357 58.2389 66.7118 174.1569 *67 V 4.1264 7.9852 117.2950 63.0052 32.9221 175.2858 68 R 4.7920 9.4480 129.2156 54.8194 32.4236 174.5305 69 L 5.4239 8.5370 125.7498 53.1160 44.3309 175.5257 70 S 5.4733 8.9925 117.8112 56.8872 66.9828 172.8083 71 T 4.8724 8.1545 110.9310 60.3095 70.9440 174.1221 72 T 4.3930 8.3208 114.6716 59.5375 71.2765 173.6677 73 P 4.2293 0.0000 0.0000 65.9967 31.6411 178.2038 74 D 4.6204 7.9966 114.9993 55.3655 40.9166 177.8293 75 I 3.5524 7.9478 121.8348 63.6726 38.0555 177.7169 76 S 4.3573 7.6293 113.6371 60.0005 62.8858 175.0718 77 K 4.1933 7.5932 119.4978 57.5696 32.1636 177.1302 78 L 4.4164 7.4875 119.4603 52.9155 42.5373 175.0704 79 P 4.3808 0.0000 0.0000 63.4258 31.7037 176.4921 80 Q 4.5745 8.6283 118.9239 55.9621 29.4377 175.7915 81 D 4.7990 7.7191 116.5338 52.5302 39.8693 175.5466 82 R 4.3964 7.1499 114.0343 55.3486 31.7211 174.0199 83 E 5.1217 8.3290 118.5945 56.0133 30.4879 176.6548 84 S 5.0738 9.0527 117.7887 56.8109 66.4771 172.5287 85 L 4.5648 8.2858 124.9442 53.6386 43.5172 175.1957 86 F 4.9738 8.6628 123.3038 56.2074 44.3255 172.7306 87 Y 5.0478 9.1578 116.0000 56.3727 42.0849 174.6359 88 F 5.1157 9.1153 125.2926 56.4979 42.0039 173.8932 89 N 4.9638 7.6386 122.9486 50.9542 41.9377 173.5207 90 L 4.4388 8.2216 123.7153 53.4168 45.1674 174.6700 91 R 5.1369 8.9785 128.0998 54.4030 32.5351 174.4749 92 E 4.9412 8.7263 124.6045 55.7114 31.5258 176.3982 93 I 4.5844 9.0816 124.3255 58.3868 38.4605 173.1559 94 P 3.6713 0.0000 0.0000 61.2700 32.0509 174.9057 95 P 4.2250 0.0000 0.0000 61.9751 31.8979 176.3595 96 R 3.7614 8.4622 120.5899 56.7878 30.1039 176.3583 97 S 4.2194 8.4444 120.1548 58.4069 62.9385 173.5470 98 E 4.2491 8.6153 125.0458 57.0083 29.5063 177.1706 99 K 4.2479 7.8397 118.8408 56.1601 33.0611 176.5144 100 A 4.4242 8.5044 122.4169 54.1899 20.4438 178.4395 101 N 4.7877 7.7509 113.4888 51.8499 37.2343 174.9559 102 V 4.4430 7.1908 111.1389 59.2333 36.1687 175.1832 103 L 4.5080 8.3712 124.6202 53.2127 43.0352 175.4966 104 Q 4.2471 8.5741 127.8310 55.2996 29.8073 174.6330 105 I 4.2695 8.3157 126.0836 59.8687 38.3688 174.8620 106 A 4.7945 8.4321 127.6997 50.0557 21.7909 174.5322 107 L 4.5615 8.6111 124.0077 53.8821 43.8762 174.9305 108 Q 5.0105 8.7124 127.0251 54.6453 31.4777 174.2604 109 T 4.5041 8.7321 123.6505 61.7653 70.7235 173.3524 110 K 4.9390 8.7262 128.3824 54.6125 34.0412 174.9290 111 I 4.7417 8.4465 121.1706 58.6140 41.0460 175.1704 112 K 3.6665 8.4772 123.3632 56.2636 33.3802 175.7068 113 L 4.7936 8.2991 127.0794 53.2508 44.2153 174.7410 114 F 5.0309 8.7008 126.2796 56.8656 40.9056 174.5753 115 Y 4.8496 9.5859 126.2185 56.6064 39.8805 174.5157 116 R 4.3504 8.4432 129.9415 53.6390 30.7538 173.3917 117 P 4.3470 0.0000 0.0000 62.8024 31.9270 177.0614 118 A 3.8758 9.0029 124.0588 55.4879 18.4653 179.7634 119 A 4.0670 8.1245 117.5612 54.5203 18.4567 177.9717 120 I 4.4207 7.4884 108.3768 59.9861 37.9210 175.6683 121 K 3.7707 7.6807 121.8813 58.1187 32.3011 175.9761 122 T 4.6170 8.3187 117.2347 60.7132 71.4109 174.2753 123 R 4.6804 9.0885 120.3270 53.5353 31.4378 174.3961 124 P 4.6838 0.0000 0.0000 64.5579 31.7013 176.6727 125 N 4.3376 8.9750 117.4826 53.6188 37.1991 174.4031 126 E 4.1455 8.2273 119.8084 55.9440 30.3169 175.9883 127 V 3.9623 8.2018 124.7581 60.6848 34.1525 175.0362 128 W 5.1407 7.5637 120.2342 55.8959 29.6973 177.0245 129 Q 3.8588 7.0062 118.2614 57.9709 28.0849 177.1720 130 D 4.4319 7.6686 115.9723 54.7352 39.6975 176.7291 131 Q 4.3076 7.8253 118.3561 56.3677 29.0718 176.0126 132 L 4.5459 7.4690 118.1066 55.1148 42.7657 176.7582 133 I 4.8837 8.4018 120.6430 59.9010 41.6177 174.3395 134 L 4.6733 8.6733 127.6420 53.4177 43.1447 175.6911 135 N 5.0404 8.9250 123.7026 51.3156 39.6957 174.9723 136 K 3.9332 8.6720 126.4520 56.9681 33.1534 176.3580 137 V 4.4260 8.3813 119.1375 59.7327 36.1370 174.0823 138 S 4.2771 8.2948 117.4857 60.0991 63.0213 175.3692 139 G 4.0589 8.5967 113.5915 44.2641 0.0000 174.2498 140 G 4.7084 5.7713 107.5082 45.8141 0.0000 172.7630 141 Y 5.0377 7.9319 121.5851 55.9727 42.6168 173.9030 142 R 4.8609 9.0999 123.8931 55.0712 31.3248 174.8519 143 I 4.6242 8.8747 129.1066 60.6607 38.6819 174.7122 144 E 4.9993 9.2570 128.5983 54.5962 32.2960 174.2108 145 N 5.1506 9.5001 125.5261 51.0710 40.0407 172.7108 146 P 4.4631 0.0000 0.0000 63.6594 32.3239 177.3033 147 T 4.2238 7.7561 110.4701 60.9683 69.8587 172.9467 148 P 4.4580 0.0000 0.0000 62.5717 31.2785 175.0200 149 Y 5.1277 7.0649 115.6344 55.9291 40.8414 175.3080 150 Y 4.2771 9.2568 120.9020 58.1576 38.7363 175.6139 151 V 4.4310 8.8097 124.0848 61.4897 34.2170 174.7561 152 T 4.7208 8.7037 125.0026 62.2869 70.4003 173.7636 153 V 4.8329 9.0237 128.7637 61.8425 32.4978 176.0191 154 I 4.7531 8.7392 121.0416 60.9985 39.1563 175.8540 155 G 4.3899 7.5839 109.1223 45.4597 0.0000 172.1651 156 L 4.6746 7.6344 125.0885 53.7758 44.6430 174.6631 157 G 3.4902 9.3872 113.4226 45.2587 0.0000 172.8331 158 G 3.8055 8.9717 108.1069 45.7044 0.0000 174.4630 159 S 4.0464 7.0328 114.1525 55.1806 67.3739 174.1438 160 E 3.4623 7.1214 123.6193 59.4077 29.3997 179.2270 161 K 3.8178 7.6236 118.8624 59.5289 32.2894 178.3516 162 Q 3.8956 8.2418 119.9642 59.0415 28.8981 178.0975 163 A 3.9227 8.0349 122.0134 54.9065 18.1904 179.1361 164 E 4.1616 7.8441 115.7313 57.9283 29.7937 177.2771 165 E 4.5874 7.9546 113.1539 55.1132 31.1500 176.0207 166 G 3.6764 8.6146 110.3005 45.0833 0.0000 173.2939 167 E 3.9190 8.7675 124.1806 57.0401 29.9295 176.8370 168 F 4.7638 8.4775 124.4947 56.7103 42.3733 173.8092 169 E 3.9705 8.0358 127.5259 55.8738 28.0805 176.2851 170 T 4.3145 8.1057 120.0570 64.2859 69.5852 174.5746 171 V 4.1832 8.4264 122.4570 60.7889 33.7746 172.5488 *173 L 4.4349 8.3719 117.9479 55.2299 42.9519 177.2341 174 S 4.2977 8.7554 119.5652 57.2486 63.9108 172.2219 175 P 4.0885 0.0000 0.0000 63.9664 31.4772 176.9711 176 R 3.7009 8.6971 120.3993 56.5025 27.9547 174.2227 177 S 4.7359 8.1919 112.7641 58.2796 67.0247 174.3101 178 E 5.2523 8.4812 115.3171 56.3751 31.9159 174.4007 179 Q 4.6976 8.9229 118.7058 55.1384 33.9158 173.6909 180 T 5.0123 8.4383 117.7606 62.4986 70.4068 174.4982 181 V 4.5738 9.0495 124.6717 60.7582 35.1226 174.9466 182 K 4.6857 8.8866 126.3422 56.4273 32.6636 176.5009 183 S 4.6937 8.8616 117.1683 57.8576 66.0860 176.5034 184 A 3.9955 8.3041 128.6216 51.3980 18.9445 177.0251 185 N 4.2629 8.1528 118.8053 53.5404 39.6536 174.1827 186 Y 5.0465 8.8205 122.5399 56.1937 40.9201 175.3907 187 N 4.6130 9.4078 123.2283 56.0107 39.0419 175.4367 188 T 4.7717 7.5907 107.7983 58.7028 68.1336 171.3888 189 P 4.7407 0.0000 0.0000 63.9375 33.2332 175.5087 190 Y 5.1895 9.8429 121.2550 56.1053 41.2502 174.3615 191 L 5.1422 9.2476 125.1410 53.2911 45.8299 174.9475 192 S 5.3814 9.2751 120.3378 56.8759 65.7542 172.0694 193 Y 5.2771 7.9980 121.6489 55.9388 42.0795 173.2425 194 I 4.8620 8.2829 120.6214 59.8914 38.8788 176.0681 195 N 4.6936 8.8015 125.2051 51.4007 39.3444 175.6087 196 D 4.2314 8.3717 118.0642 57.6184 40.7068 177.5341 197 Y 4.5282 7.1807 113.8176 57.7240 37.8145 176.5871 198 G 3.9794 8.3946 108.1746 45.3173 0.0000 174.7880 199 G 3.7181 8.6146 107.9105 46.2047 0.0000 173.3004 200 R 5.3646 7.8942 119.4739 52.5050 29.9226 173.6801 201 P 4.3531 0.0000 0.0000 62.1090 33.3602 175.3317 202 V 4.7810 8.1344 121.1097 61.2001 33.8778 174.5341 203 L 4.7284 9.4757 128.1828 53.0416 44.2969 175.1732 204 S 4.1721 8.3726 118.2592 56.8512 63.3738 172.9180 205 F 4.7204 8.7221 126.5607 55.8272 41.1357 175.2337 206 I 4.3658 8.8406 123.9925 59.9003 39.2581 174.0875 207 C 5.0286 8.8563 125.4873 55.7661 40.8934 173.8795 208 N 4.4885 9.0032 125.4049 51.8298 37.6653 175.2764 209 G 3.7527 8.6239 114.7265 44.4579 0.0000 171.0387 210 S 4.6465 8.6832 116.9831 57.7677 66.5809 173.4821 211 R 4.8637 7.9836 120.7283 54.9755 31.7788 175.4269 212 C 6.2273 9.2752 124.1629 54.5815 39.5899 173.2867 213 S 5.1697 8.6730 116.8998 56.5782 67.0176 172.3631 214 V 4.0818 7.8040 119.8775 62.8172 32.5324 175.6984 215 K 4.5186 8.1474 125.7911 57.2012 34.1569 174.1211 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 1 A 8.12 3.98 1.17 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 2 V 8.36 4.35 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 0.77 0.00 0.00 0.83 0.00 0.00 3 S 9.07 4.86 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 4 L 8.25 5.10 0.00 1.83 1.57 1.05 1.36 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 5 D 8.79 4.70 0.00 2.73 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 6 R 7.62 4.64 0.00 2.01 1.91 0.00 2.98 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 7 T 8.25 4.46 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 1.24 0.00 0.00 8 R 7.31 4.78 0.00 2.01 2.00 0.00 3.28 0.00 0.00 3.43 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 9 A 8.86 4.73 1.14 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 0.00 0.00 10 V 8.57 4.79 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 0.86 0.00 0.00 1.05 0.00 0.00 11 F 9.28 4.35 0.00 3.30 3.06 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 12 D 8.28 4.73 0.00 2.69 2.37 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 13 G 8.89 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 0.00 0.00 0.00 0.00 14 S 8.71 4.42 0.00 3.96 3.99 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 0.00 0.00 0.00 15 E 8.33 4.83 0.00 1.82 1.79 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 2.16 2.28 0.00 16 K 8.59 4.43 0.00 1.92 1.93 0.00 1.62 0.00 0.00 1.91 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.55 7.81 17 S 7.63 5.55 0.00 4.13 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 *19 T 8.20 4.35 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 1.20 0.00 0.00 20 L 8.44 4.74 0.00 1.34 1.44 -0.14 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 21 D 9.38 4.98 0.00 2.79 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 22 I 8.69 5.73 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.36 0.98 0.00 0.00 23 S 8.04 4.88 0.00 3.95 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 24 N 8.57 5.00 0.00 2.85 2.88 0.00 0.00 7.38 8.01 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 25 D 8.88 4.72 0.00 2.49 2.64 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 26 N 8.30 4.61 0.00 2.91 3.07 0.00 0.00 7.20 5.99 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 27 K 8.52 4.56 0.00 1.78 1.82 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.52 7.81 28 Q 8.01 4.65 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.69 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 29 L 7.59 4.71 0.00 1.80 1.57 0.98 1.07 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 30 P 0.00 4.90 0.00 2.11 2.11 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 31 Y 9.54 4.84 0.00 2.76 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 32 L 8.89 5.17 0.00 1.77 1.60 0.95 0.71 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 33 A 9.21 5.09 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 34 Q 9.62 4.89 0.00 2.36 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 35 A 9.51 5.01 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 36 W 8.07 5.11 0.00 3.36 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 37 I 8.67 5.09 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.85 0.99 0.00 0.00 38 E 9.32 5.43 0.00 2.06 1.84 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 2.55 2.57 0.00 39 N 8.91 5.29 0.00 2.85 3.13 0.00 0.00 6.92 7.58 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 40 E 8.71 3.81 0.00 1.80 2.05 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 2.34 2.35 0.00 41 N 8.29 4.77 0.00 2.89 2.82 0.00 0.00 6.95 7.69 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 42 Q 8.90 3.69 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.70 0.00 0.00 0.00 0.00 0.00 1.28 1.92 0.00 43 E 8.92 4.45 0.00 2.10 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 44 K 8.59 4.64 0.00 1.69 1.67 0.00 1.06 0.00 0.00 1.44 0.00 0.00 2.86 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.40 1.65 7.81 45 I 8.64 4.74 1.98 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.99 0.00 0.00 46 I 8.50 4.43 1.87 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 1.47 0.85 0.92 0.00 0.00 47 T 7.77 4.32 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 48 G 8.06 3.63 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 0.00 0.00 0.00 49 P 0.00 4.93 0.00 1.90 2.27 0.00 3.87 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.84 0.00 50 V 7.23 4.69 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 0.51 0.00 0.00 -0.05 0.00 0.00 51 I 8.70 4.80 1.89 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 1.28 0.65 0.89 0.00 0.00 52 A 8.67 5.35 1.46 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 53 T 9.10 4.81 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 1.25 0.00 0.00 54 P 0.00 4.85 0.00 2.15 2.20 0.00 3.77 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 2.10 2.03 0.00 55 P 0.00 4.73 0.00 2.13 2.20 0.00 3.92 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.99 0.00 56 V 7.61 5.51 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.98 0.00 0.00 57 Q 8.45 4.72 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 58 R 8.58 4.78 0.00 1.87 1.89 0.00 3.20 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 59 L 10.30 4.81 0.00 1.77 1.57 0.96 0.90 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 60 E 8.88 4.63 0.00 1.95 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 2.43 2.33 0.00 61 P 0.00 4.77 0.00 2.16 2.21 0.00 3.52 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 62 G 8.81 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 0.00 0.00 0.00 63 A 8.23 4.28 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 64 K 7.88 5.00 0.00 1.74 1.72 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.39 7.81 65 S 8.14 4.30 0.00 3.83 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 *67 V 7.99 4.13 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 1.23 0.00 0.00 1.09 0.00 0.00 68 R 9.45 4.79 0.00 1.90 1.93 0.00 3.13 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 69 L 8.54 5.42 0.00 1.84 1.69 0.84 0.64 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 S 8.99 5.47 0.00 3.90 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 71 T 8.15 4.87 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 0.60 0.00 0.00 72 T 8.32 4.39 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 1.17 0.00 0.00 73 P 0.00 4.23 0.00 2.18 2.15 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 74 D 8.00 4.62 0.00 2.70 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 75 I 7.95 3.55 1.81 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.84 0.93 0.00 0.00 76 S 7.63 4.36 0.00 3.98 3.99 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 0.00 0.00 0.00 77 K 7.59 4.19 0.00 1.91 1.90 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.48 7.81 78 L 7.49 4.42 0.00 1.71 1.65 0.55 1.15 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 79 P 0.00 4.38 0.00 2.06 2.00 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 80 Q 8.63 4.57 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.09 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 81 D 7.72 4.80 0.00 2.68 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 82 R 7.15 4.40 0.00 1.72 1.74 0.00 2.94 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.59 0.00 83 E 8.33 5.12 0.00 2.16 2.33 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 2.43 2.27 0.00 84 S 9.05 5.07 0.00 4.04 3.66 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 0.00 0.00 0.00 0.00 85 L 8.29 4.56 0.00 0.62 1.23 0.10 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.66 4.97 0.00 3.07 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 87 Y 9.16 5.05 0.00 2.95 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 88 F 9.12 5.12 0.00 3.08 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 N 7.64 4.96 0.00 1.44 1.42 0.00 0.00 6.02 7.60 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 90 L 8.22 4.44 0.00 1.60 1.40 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 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1.84 1.69 0.93 0.34 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 0.00 108 Q 8.71 5.01 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.51 0.00 0.00 0.00 0.00 0.00 2.13 2.37 0.00 109 T 8.73 4.50 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 1.23 0.00 0.00 110 K 8.73 4.94 0.00 1.63 1.66 0.00 1.55 0.00 0.00 1.24 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.39 7.81 111 I 8.45 4.74 2.05 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 1.53 0.77 1.02 0.00 0.00 112 K 8.48 3.67 0.00 1.21 0.74 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.23 1.39 7.81 113 L 8.30 4.79 0.00 1.68 1.53 1.06 0.84 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 0.00 114 F 8.70 5.03 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 0.00 115 Y 9.59 4.85 0.00 3.34 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 0.00 116 R 8.44 4.35 0.00 1.98 1.76 0.00 3.12 0.00 0.00 3.32 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 117 P 0.00 4.35 0.00 2.27 2.32 0.00 3.71 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 2.00 2.18 0.00 118 A 9.00 3.88 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 0.00 119 A 8.12 4.07 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 0.00 120 I 7.49 4.42 1.59 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.68 0.70 0.00 0.00 121 K 7.68 3.77 0.00 1.82 1.80 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.39 7.81 122 T 8.32 4.62 4.37 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 0.53 0.00 0.00 123 R 9.09 4.68 0.00 1.69 1.82 0.00 3.29 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.45 0.00 124 P 0.00 4.68 0.00 2.05 2.05 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 125 N 8.97 4.34 0.00 2.92 2.95 0.00 0.00 6.93 7.70 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 0.00 126 E 8.23 4.15 0.00 2.07 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 2.63 2.37 0.00 127 V 8.20 3.96 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 0.82 0.00 0.00 0.84 0.00 0.00 128 W 7.56 5.14 0.00 3.50 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 7.01 3.86 0.00 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 7.01 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 130 D 7.67 4.43 0.00 2.65 2.66 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 0.00 0.00 0.00 0.00 131 Q 7.83 4.31 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.96 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 132 L 7.47 4.55 0.00 1.81 1.72 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.40 4.88 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.07 1.06 0.00 0.00 134 L 8.67 4.67 0.00 1.35 1.31 -0.13 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.93 5.04 0.00 2.77 2.80 0.00 0.00 6.27 7.29 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 0.00 136 K 8.67 3.93 0.00 1.95 1.67 0.00 1.61 0.00 0.00 1.43 0.00 0.00 2.63 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.90 1.47 7.81 137 V 8.38 4.43 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 0.88 0.00 0.00 0.90 0.00 0.00 138 S 8.29 4.28 0.00 3.81 3.76 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 0.00 139 G 8.60 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 5.77 4.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 7.93 5.04 0.00 2.92 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 0.00 142 R 9.10 4.86 0.00 1.88 1.87 0.00 3.23 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 143 I 8.87 4.62 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.73 0.92 0.00 0.00 144 E 9.26 5.00 0.00 2.03 1.80 0.00 0.00 0.00 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 2.24 0.00 145 N 9.50 5.15 0.00 2.83 2.65 0.00 0.00 6.79 8.25 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 0.00 146 P 0.00 4.46 0.00 2.22 2.16 0.00 3.85 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 147 T 7.76 4.22 4.42 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 1.49 0.00 0.00 148 P 0.00 4.46 0.00 1.30 1.95 0.00 2.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 149 Y 7.06 5.13 0.00 2.63 2.70 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 0.00 150 Y 9.26 4.28 0.00 2.67 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.81 4.43 2.16 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 0.76 0.00 0.00 1.17 0.00 0.00 152 T 8.70 4.72 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 153 V 9.02 4.83 2.44 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 1.15 0.00 0.00 1.04 0.00 0.00 154 I 8.74 4.75 1.98 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 1.32 0.85 1.02 0.00 0.00 155 G 7.58 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 7.63 4.67 0.00 0.88 0.96 0.66 1.03 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 0.00 157 G 9.39 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 G 8.97 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 0.00 159 S 7.03 4.05 0.00 3.71 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 0.00 160 E 7.12 3.46 0.00 1.57 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 161 K 7.62 3.82 0.00 1.74 1.66 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.56 1.43 7.81 162 Q 8.24 3.90 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 163 A 8.03 3.92 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 0.00 164 E 7.84 4.16 0.00 1.93 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 0.00 2.28 2.50 0.00 165 E 7.95 4.59 0.00 2.04 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 0.00 2.43 2.19 0.00 166 G 8.61 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 0.00 0.00 0.00 167 E 8.77 3.92 0.00 2.03 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 2.37 2.33 0.00 168 F 8.48 4.76 0.00 3.07 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 0.00 169 E 8.04 3.97 0.00 1.65 1.71 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 2.22 2.22 0.00 170 T 8.11 4.31 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 1.36 0.00 0.00 171 V 8.43 4.18 2.21 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 1.02 0.00 0.00 0.97 0.00 0.00 *173 L 8.37 4.43 0.00 1.71 1.73 0.98 0.99 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 0.00 174 S 8.76 4.30 0.00 3.66 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 P 0.00 4.09 0.00 1.66 1.74 0.00 3.07 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 1.66 1.54 0.00 176 R 8.70 3.70 0.00 1.75 1.85 0.00 3.11 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.42 0.00 177 S 8.19 4.74 0.00 3.86 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 0.00 178 E 8.48 5.25 0.00 2.03 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 2.19 2.34 0.00 179 Q 8.92 4.70 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 180 T 8.44 5.01 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 1.26 0.00 0.00 181 V 9.05 4.57 2.27 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 1.16 0.00 0.00 1.04 0.00 0.00 182 K 8.89 4.69 0.00 1.70 1.75 0.00 1.87 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.44 7.81 183 S 8.86 4.69 0.00 4.06 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 0.00 184 A 8.30 4.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 N 8.15 4.26 0.00 2.53 2.62 0.00 0.00 6.80 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 Y 8.82 5.05 0.00 3.10 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 0.00 187 N 9.41 4.61 0.00 2.81 2.96 0.00 0.00 6.94 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 T 7.59 4.77 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 1.29 0.00 0.00 189 P 0.00 4.74 0.00 1.84 2.19 0.00 3.85 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 2.08 1.94 0.00 190 Y 9.84 5.19 0.00 2.75 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 0.00 191 L 9.25 5.14 0.00 1.50 1.69 0.78 1.15 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 0.00 192 S 9.28 5.38 0.00 3.82 3.60 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 0.00 193 Y 8.00 5.28 0.00 3.27 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.28 4.86 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 1.01 0.00 0.00 195 N 8.80 4.69 0.00 2.65 2.95 0.00 0.00 6.60 8.77 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 0.00 196 D 8.37 4.23 0.00 1.58 2.38 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 0.00 197 Y 7.18 4.53 0.00 2.98 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 0.00 198 G 8.39 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 0.00 199 G 8.61 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 0.00 200 R 7.89 5.36 0.00 1.58 1.74 0.00 3.25 0.00 0.00 3.87 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.00 201 P 0.00 4.35 0.00 1.55 1.78 0.00 2.68 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 202 V 8.13 4.78 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 0.95 0.00 0.00 0.88 0.00 0.00 203 L 9.48 4.73 0.00 1.87 1.28 0.98 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 204 S 8.37 4.17 0.00 3.67 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 F 8.72 4.72 0.00 2.93 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 I 8.84 4.37 1.85 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 1.14 1.11 0.91 0.00 0.00 207 C 8.86 5.03 0.00 2.91 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 N 9.00 4.49 0.00 2.70 2.77 0.00 0.00 7.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 G 8.62 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 0.00 210 S 8.68 4.65 0.00 3.89 3.83 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 0.00 211 R 7.98 4.86 0.00 1.96 1.81 0.00 3.21 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 212 C 9.28 6.23 0.00 2.97 3.10 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 0.00 0.00 0.00 213 S 8.67 5.17 0.00 3.85 3.99 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 0.00 0.00 0.00 214 V 7.80 4.08 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 0.59 0.00 0.00 -0.33 0.00 0.00 215 K 8.15 4.52 0.00 1.90 2.05 0.00 1.47 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.36 7.81 * Residues marked with a * may have inaccurate shift predictions.