NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 4.0190 8.0093 121.4469 61.5621 37.9807 174.4690 6 T 4.5173 8.1297 115.0323 58.1801 71.6266 170.5516 7 E 4.1472 9.5711 122.9270 58.6660 30.6247 177.1037 8 N 5.5023 8.0577 114.8621 51.6789 41.6502 174.0286 9 M 4.9683 9.0692 122.6097 53.9206 36.7012 174.4321 10 H 5.4067 8.5597 117.5901 54.7480 32.9568 172.8478 11 M 5.0134 8.4285 114.2797 54.4371 34.6302 173.9107 12 K 5.0256 8.9281 121.1812 54.5587 35.6012 174.9229 13 L 5.4003 8.8823 125.1812 53.7216 46.4574 174.9743 14 Y 4.9227 8.6712 123.6547 56.9590 41.7463 173.1058 15 M 5.3354 9.4506 127.2692 54.0129 36.0003 173.8489 16 E 4.7652 8.2128 123.8646 55.0057 34.0400 175.1089 17 G 3.8956 6.5468 110.7818 46.2390 0.0000 171.3838 18 T 5.0987 7.6829 115.1137 61.8411 72.2741 173.1970 19 V 4.4784 8.5997 125.8220 61.7389 33.0889 175.1156 20 N 4.5331 9.4223 127.5907 55.0684 35.9616 174.3447 21 N 4.1708 8.2397 107.7428 54.3703 37.0168 174.2392 22 H 4.8061 7.8607 118.7479 54.5824 31.4353 172.7494 23 H 5.0860 8.8793 126.3804 56.3558 30.9670 173.8637 24 F 5.2809 8.2299 118.4029 56.4090 42.0042 172.6903 25 K 5.1435 9.2714 116.9719 55.6450 36.7878 175.3586 26 C 5.6170 9.3439 119.5375 58.8495 33.3598 172.8935 27 T 5.3794 8.6980 110.3033 60.7071 72.5925 172.4057 28 S 5.0648 8.2136 114.0345 58.0193 66.7551 173.9454 29 E 5.1275 8.5706 119.3246 55.2036 34.4585 174.7759 30 G 4.7868 8.6894 107.6448 46.9240 0.0000 171.7022 31 E 5.2249 8.0502 116.4212 55.2835 33.6482 174.2272 32 G 4.2435 8.7829 106.5308 46.2170 0.0000 172.5871 33 K 5.2231 8.5708 119.4253 52.9864 32.0897 175.5981 34 P 3.7978 0.0000 0.0000 65.2545 31.4051 177.3293 35 Y 4.3143 7.9942 112.9947 58.6591 38.5816 175.7694 36 E 4.4446 8.5731 118.8396 55.3442 30.3400 177.1199 37 G 4.3216 8.1170 107.1532 46.0072 0.0000 173.2065 38 T 5.0347 7.2929 109.8856 60.8525 71.0706 173.7503 39 Q 4.8078 8.0870 118.6212 55.8137 32.3854 172.9559 40 T 5.1164 8.3704 116.9941 62.0833 72.8150 172.6319 41 M 5.0920 9.0840 124.7251 53.8369 36.0263 173.8777 42 R 4.7104 9.2987 125.3371 54.5815 32.7331 174.9598 43 I 4.9004 8.3211 125.2808 59.2811 40.5918 175.0008 44 K 4.9836 9.0127 124.4247 54.6675 36.1302 175.9511 45 V 4.3434 8.6090 125.0040 62.4438 30.9824 175.8805 46 V 4.2769 8.5374 120.6536 61.6635 32.3757 176.2289 47 E 4.6904 8.3162 118.9625 56.6753 33.6370 176.5112 48 G 4.1166 9.4526 111.7042 45.3805 0.0000 173.8444 49 G 3.8435 7.7001 108.2760 44.3536 0.0000 172.0834 50 P 4.4672 0.0000 0.0000 61.3997 32.6119 176.4404 51 L 3.7583 7.9929 121.6872 54.1876 41.9207 176.2553 52 P 4.5281 0.0000 0.0000 63.2309 31.5357 176.0110 53 F 5.0205 6.4409 111.4128 54.0076 40.9157 174.6309 54 A 4.0022 9.0752 125.4586 53.0693 18.7244 178.8544 55 F 4.1663 8.8371 122.7306 60.5407 39.4485 177.4283 56 D 4.7765 8.3041 118.4185 57.3262 40.4099 177.9407 57 I 4.4244 7.4213 111.9539 62.9043 37.9165 177.1355 58 L 4.3876 7.8889 119.8602 55.0910 41.9921 177.7309 59 A 4.6579 8.0606 122.8207 55.0970 18.1341 179.5801 60 T 3.8215 7.7395 105.5094 63.8989 68.8564 174.9876 61 S 4.7653 8.1724 117.5373 59.3739 63.1497 174.2307 62 F 4.7632 8.0187 119.5013 57.6093 39.9198 176.4786 *66 S 4.2205 7.7954 111.5781 58.4040 62.6727 174.1716 67 K 3.8903 7.9630 119.7055 58.5227 32.4611 179.0529 68 T 4.1471 8.2155 114.8848 65.6835 69.5844 175.1344 69 F 4.4643 8.2782 123.2571 56.6869 37.8791 175.4912 70 I 4.8803 7.0778 120.0053 59.0744 40.4671 176.6449 71 N 4.3713 9.2113 126.7042 54.7429 39.5896 173.3590 72 H 4.9376 8.7147 125.7282 54.6776 27.8449 176.4817 73 T 4.1824 8.0933 113.2621 62.6505 70.4477 175.5554 74 Q 3.4392 9.3519 118.8316 58.9080 26.7517 174.2459 75 G 3.9635 8.1129 101.6767 46.5466 0.0000 175.1579 76 I 3.8976 7.8060 121.3551 59.7291 37.9734 175.0824 77 P 4.1207 0.0000 0.0000 62.6443 31.5773 176.5815 78 D 4.2181 8.3927 123.3657 52.8964 40.6445 176.1520 79 F 3.9122 8.2362 128.7040 60.3145 39.2886 176.0024 80 F 4.0444 7.7048 116.8555 59.8558 39.0480 178.0256 81 K 4.4415 8.3894 116.9065 59.4635 31.5706 179.2354 82 Q 4.1486 8.0828 118.5455 58.6878 28.5999 178.2854 83 S 4.0178 7.4907 114.1656 59.3157 62.7664 174.2105 84 F 4.8952 6.9648 119.9430 56.0986 39.6567 174.0435 85 P 4.9313 0.0000 0.0000 63.6466 31.9008 177.0461 86 E 3.9094 8.0897 119.0379 57.6956 29.8575 177.7652 87 G 3.5052 9.1882 106.1326 45.4711 0.0000 171.3413 88 F 5.3527 7.2443 111.8337 55.9300 41.7383 173.1053 89 T 5.2465 9.3932 109.4110 59.6785 72.0901 172.8729 90 W 5.8407 8.4614 118.3479 55.0890 32.1434 173.7558 91 E 5.4184 9.1403 119.3904 55.1691 33.7157 174.7386 92 R 5.1725 8.7737 120.8155 55.2096 34.4556 173.8683 93 V 4.7722 8.6760 125.5695 60.2951 34.0679 174.3153 94 T 4.8811 8.8102 122.5775 61.9055 70.9543 173.5787 95 T 4.7522 8.5946 123.5793 61.7571 71.2008 173.2156 96 Y 4.5314 8.7894 125.5377 57.5821 38.8233 177.1132 97 E 4.1766 9.3630 123.3980 58.0567 29.6373 177.2675 98 D 4.7167 8.5514 117.3605 52.5571 40.3224 175.7501 99 G 3.6653 8.2566 112.8113 45.9943 0.0000 175.4088 100 G 2.4061 7.5607 107.0375 46.0858 0.0000 172.8789 101 V 4.9094 7.9433 122.8717 60.6857 35.0789 173.8980 102 L 5.3127 9.3109 130.2104 53.5993 44.4889 174.9237 103 T 5.0587 8.8312 117.6279 60.7651 71.1447 173.7625 104 A 5.2714 9.2060 126.1760 50.3898 22.6245 174.7125 105 T 4.8106 8.7091 112.7164 59.7617 71.8509 173.0800 106 Q 4.4666 8.3478 125.2877 54.0278 32.9037 172.8420 107 D 5.0785 8.6105 124.5959 52.6305 44.4971 174.7053 108 T 5.3109 8.5586 122.0059 61.8193 71.4468 173.1933 109 S 5.1216 9.0555 120.7131 56.3617 66.9748 172.4860 110 L 4.7509 8.7108 122.9796 53.7041 43.7026 175.9862 111 Q 4.2245 8.6109 126.9985 54.6885 29.8796 173.6755 112 D 4.4071 8.9793 127.0557 54.9873 38.8812 174.2679 113 G 3.8587 8.2813 102.4143 46.1219 0.0000 172.3937 114 C 4.6838 7.6050 119.0318 56.9438 34.6708 173.3212 115 L 4.5868 8.6330 127.5846 55.0467 42.6011 176.1947 116 I 4.7470 9.1993 125.1710 59.8291 39.2996 174.0922 117 Y 5.5238 8.9247 125.5137 56.4198 40.7317 174.6183 118 N 5.2045 9.1149 121.7782 52.0461 41.7395 172.6183 119 V 4.6511 9.1335 126.8670 60.8405 34.4531 174.4461 120 K 5.0525 8.8426 126.1626 54.6348 35.8287 175.1368 121 I 4.9300 8.4202 124.8816 59.5858 40.8645 175.0808 122 R 4.5966 9.3005 126.5938 55.2758 33.0313 173.6422 123 G 4.7466 9.3037 114.7039 44.6768 0.0000 171.7191 124 V 4.8414 8.4861 115.5617 59.8430 36.6609 175.2252 125 N 4.0412 8.9955 117.9072 54.4078 37.3054 173.9504 126 F 4.1354 8.2205 114.9742 56.1127 39.6307 173.7171 127 P 4.4342 0.0000 0.0000 62.3784 31.6433 177.7459 128 S 4.2814 8.7961 117.6554 60.5022 63.1762 174.5017 129 N 4.7641 8.0433 116.2513 52.8021 39.3847 174.7914 130 G 3.9508 7.8015 108.8572 44.0316 0.0000 173.1344 131 P 4.2140 0.0000 0.0000 65.5563 31.7552 179.5998 132 V 3.5128 7.8724 117.1219 66.3876 31.3347 177.8656 133 M 3.9194 7.9169 116.1910 57.7454 32.1276 177.6964 134 Q 4.1702 8.1266 115.8687 55.0326 30.1539 175.5582 135 K 3.8227 7.7517 118.3611 58.0254 29.4953 175.1630 136 K 4.7445 8.7221 112.8888 56.4768 33.6729 177.8834 137 T 4.8625 7.9324 109.0126 59.6667 71.6568 173.2811 138 L 4.6781 8.3210 120.3991 54.4575 43.6241 177.9908 139 G 3.9812 8.5248 103.6534 45.1446 0.0000 172.9619 140 W 5.3122 8.1580 118.1500 55.0492 30.7021 176.6506 141 E 4.4132 9.1029 122.8156 55.9040 29.8500 176.4994 142 A 4.4987 8.5398 123.5944 53.0967 19.3540 176.5575 143 S 4.6775 8.7348 112.0717 57.7449 66.8885 173.3561 144 T 5.1077 8.3854 116.7420 61.7933 71.4266 173.0181 145 E 4.8411 9.2110 126.8180 54.5675 32.9699 173.9715 146 M 4.8163 9.0221 125.9017 53.8251 34.6138 174.2628 147 L 5.7523 8.7758 126.4509 52.3951 44.6513 175.1743 148 Y 5.1150 7.4647 119.3778 54.6770 41.6717 172.5355 149 P 4.7294 0.0000 0.0000 62.7896 32.4840 176.1384 150 A 4.2020 9.2205 123.7216 52.7467 22.4295 176.1667 151 D 4.2569 9.4287 124.4175 55.6768 36.9896 173.9376 152 G 3.9315 7.8380 110.4823 46.3296 0.0000 178.8858 153 G 3.9165 7.4802 109.2306 44.3406 0.0000 171.4003 154 L 4.8727 7.6225 118.3902 52.8020 45.1063 175.7196 155 E 4.8824 8.3382 120.9649 54.3663 33.0627 175.2471 156 G 5.0405 8.5138 109.3769 43.7116 0.0000 172.1524 157 R 5.2429 8.7110 120.8544 54.3585 34.3299 174.3611 158 S 4.8710 8.7384 116.1205 57.1877 66.4081 172.3073 159 D 5.4523 8.6142 123.9236 52.8626 43.7386 175.2680 160 M 5.0443 8.9762 120.2914 53.5057 37.0121 174.0881 161 A 5.2045 8.7863 122.2536 50.2013 22.1728 174.8725 162 L 4.0131 8.9206 126.2309 53.5245 43.3923 176.1951 163 K 4.1694 8.5837 127.0520 56.9540 32.9834 176.6340 164 L 4.8897 8.4785 124.5993 52.7715 44.5388 176.2978 165 V 3.5554 8.5325 121.9193 65.0279 31.3714 176.3828 166 G 3.9757 8.6168 115.7097 44.8525 0.0000 172.1238 167 G 3.6135 7.5685 112.2981 45.7816 0.0000 175.2485 168 G 3.9726 7.8885 107.7692 46.0470 0.0000 171.4084 169 H 5.4498 8.6210 115.2178 53.8311 32.6876 172.9779 170 L 4.7326 8.8515 124.1772 53.5529 44.1239 175.0153 171 I 5.1155 8.4560 126.9441 60.0572 39.6712 174.3617 172 C 5.2035 8.9614 119.8593 56.3894 33.5616 172.0016 173 N 5.3645 8.8463 118.3385 51.7688 41.7744 172.9244 174 L 4.9626 9.1031 125.7759 52.8785 44.6230 175.3710 175 K 4.8177 8.8432 123.7828 55.0798 34.3827 175.4817 176 T 5.0298 8.6682 121.6948 61.8300 72.5956 173.4806 177 T 4.7397 8.5373 120.0917 62.0622 72.3211 172.4208 178 Y 5.3765 8.9532 124.8466 56.3842 40.5435 175.0531 179 R 5.1510 9.2386 122.7152 54.4481 33.7375 175.0622 180 S 4.6593 9.1434 118.3999 58.0352 63.1870 173.9684 181 K 4.3229 8.5240 123.4434 56.3400 32.5622 176.9291 182 K 4.3033 7.3835 120.3977 54.3241 33.3099 174.6501 183 P 4.3327 0.0000 0.0000 62.3498 32.2590 177.1409 184 A 4.0190 8.8435 124.9056 55.2995 18.3801 180.2180 185 K 4.0521 7.9507 113.3561 59.7390 32.7279 177.6731 186 N 4.4892 7.9797 115.3576 54.0548 38.8162 174.6385 187 L 4.5878 7.4923 119.2236 52.5900 42.8399 176.4754 188 K 4.1937 8.9005 126.5211 55.4428 31.0084 176.1080 189 M 4.2730 8.2822 126.1185 54.4271 32.5845 175.1060 190 P 4.6021 0.0000 0.0000 61.8085 32.9074 176.4049 191 G 4.0178 8.3198 107.4602 44.7698 0.0000 172.6326 192 V 4.1399 8.3755 120.1917 63.2991 32.1713 175.8050 193 Y 4.6615 8.4905 125.0849 56.1233 42.1822 172.9316 194 Y 5.1198 9.1144 115.3571 56.2859 42.6317 174.9615 195 V 4.7820 8.7111 122.7094 61.2839 34.3617 174.0593 196 D 5.3369 8.7280 128.2711 53.5856 42.5833 175.8376 197 R 5.1588 9.1027 118.6128 54.7767 34.2874 173.9415 198 R 4.6910 8.7197 118.9167 54.8141 33.3516 173.1853 199 L 5.1082 8.7673 128.9348 53.5625 43.7768 175.0094 200 E 4.8184 8.9830 126.1891 54.2986 32.7880 175.4287 201 R 4.4030 8.7386 124.8489 56.5706 29.9646 175.9321 202 I 4.2234 8.7226 128.3143 62.6618 38.2192 176.3689 203 K 4.5437 7.7136 118.3497 55.8609 36.1174 173.8197 204 E 5.2391 8.7510 119.6261 56.1547 32.5282 173.3421 205 A 4.5089 9.1900 120.9182 50.7599 23.7632 175.4661 206 D 4.3279 9.2776 115.2982 55.6658 38.4585 174.2438 207 K 3.8424 8.5959 110.4603 57.9594 29.3370 176.8119 208 E 3.6079 8.4647 114.0239 57.2285 27.1234 175.6365 209 T 4.2253 7.5379 108.4520 62.4197 69.5624 173.4251 210 Y 5.0802 7.7382 124.5686 56.2114 42.5024 173.8351 211 V 4.4108 7.4705 125.3681 60.9130 35.7183 173.1608 212 E 4.8734 8.9491 128.0918 54.4287 32.0684 174.4975 213 Q 5.2046 8.9401 125.6123 54.3838 32.5709 174.0747 214 H 5.2245 9.0554 121.0255 54.5430 34.0657 171.7767 215 E 5.2188 8.7611 124.2388 54.5183 33.5776 174.0172 216 V 4.9901 8.4878 125.4140 59.9060 34.4287 174.5903 217 A 5.0134 8.8835 125.4984 50.4819 22.6073 174.7826 218 V 4.6090 8.6792 122.5733 61.1748 34.3788 174.9108 219 A 5.1888 8.9442 130.0529 51.4213 20.5368 176.2871 220 R 4.5076 8.3915 113.0238 56.2327 33.1045 175.1636 221 Y 5.0981 8.2571 118.9432 57.5719 40.1510 173.7117 222 C 4.5672 8.8709 120.8931 59.1911 32.4660 174.1781 223 D 4.6577 8.6198 126.0076 55.3204 41.1913 176.9729 224 L 4.1852 7.6192 119.0260 53.6712 42.2663 175.1202 225 P 4.2972 0.0000 0.0000 62.8919 31.7424 176.8091 226 S 4.5818 8.2156 117.4672 55.6491 61.8994 173.1312 227 K 3.9961 8.5923 125.7402 59.1631 32.2631 176.9349 228 L 4.1904 7.7840 121.2753 54.9608 41.6494 176.5882 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 5 I 8.01 4.02 1.94 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.78 0.00 0.00 6 T 8.13 4.52 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 1.22 0.00 0.00 7 E 9.57 4.15 0.00 2.04 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 0.00 2.39 2.45 0.00 8 N 8.06 5.50 0.00 2.63 2.70 0.00 0.00 6.67 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 9 M 9.07 4.97 0.00 1.99 1.99 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 2.53 2.48 0.00 10 H 8.56 5.41 0.00 3.06 3.20 0.00 5.66 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 M 8.43 5.01 0.00 2.00 1.69 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 12 K 8.93 5.03 0.00 1.62 1.63 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.29 1.29 7.81 13 L 8.88 5.40 0.00 1.97 1.69 1.29 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.67 4.92 0.00 3.29 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 15 M 9.45 5.34 0.00 2.25 1.82 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 16 E 8.21 4.77 0.00 2.00 1.60 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 2.01 2.10 0.00 17 G 6.55 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.68 5.10 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 1.28 0.00 0.00 19 V 8.60 4.48 1.54 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 0.22 0.00 0.00 0.48 0.00 0.00 20 N 9.42 4.53 0.00 2.93 2.93 0.00 0.00 7.08 8.23 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 21 N 8.24 4.17 0.00 2.92 2.94 0.00 0.00 6.96 8.16 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 22 H 7.86 4.81 0.00 3.40 3.49 0.00 5.58 0.00 0.00 0.00 0.00 6.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.88 5.09 0.00 3.25 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 8.23 5.28 0.00 3.41 3.23 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 25 K 9.27 5.14 0.00 1.83 1.81 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.34 1.49 7.81 26 C 9.34 5.62 0.00 3.21 3.19 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 27 T 8.70 5.38 4.10 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 1.10 0.00 0.00 28 S 8.21 5.06 0.00 3.90 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 29 E 8.57 5.13 0.00 1.92 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 30 G 8.69 4.79 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 31 E 8.05 5.22 0.00 1.89 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 2.23 2.23 0.00 32 G 8.78 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 33 K 8.57 5.22 0.00 1.86 1.88 0.00 1.78 0.00 0.00 1.94 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.40 7.81 34 P 0.00 3.80 0.00 1.52 1.47 0.00 3.99 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.45 0.00 35 Y 7.99 4.31 0.00 2.96 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 36 E 8.57 4.44 0.00 2.10 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 2.32 2.33 0.00 37 G 8.12 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 0.00 0.00 0.00 0.00 38 T 7.29 5.03 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 1.33 0.00 0.00 39 Q 8.09 4.81 0.00 1.53 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.12 0.00 40 T 8.37 5.12 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 1.25 0.00 0.00 41 M 9.08 5.09 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 42 R 9.30 4.71 0.00 1.73 1.84 0.00 3.22 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.55 0.00 43 I 8.32 4.90 1.46 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.48 0.97 0.00 0.00 44 K 9.01 4.98 0.00 1.72 1.74 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.45 7.81 45 V 8.61 4.34 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 0.94 0.00 0.00 1.10 0.00 0.00 46 V 8.54 4.28 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 0.78 0.00 0.00 1.09 0.00 0.00 47 E 8.32 4.69 0.00 2.00 1.92 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 2.38 2.38 0.00 48 G 9.45 4.12 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 0.00 0.00 0.00 49 G 7.70 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 50 P 0.00 4.47 0.00 1.99 2.07 0.00 3.67 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 1.99 2.08 0.00 51 L 7.99 3.76 0.00 1.04 0.13 0.54 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.53 0.00 2.02 2.04 0.00 3.14 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 53 F 6.44 5.02 0.00 2.87 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 54 A 9.08 4.00 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 55 F 8.84 4.17 0.00 3.37 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 56 D 8.30 4.78 0.00 2.74 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 57 I 7.42 4.42 1.95 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.33 0.84 0.00 0.00 58 L 7.89 4.39 0.00 1.30 1.63 0.63 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.06 4.66 1.69 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 0.00 0.00 60 T 7.74 3.82 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 0.74 0.00 0.00 61 S 8.17 4.77 0.00 3.89 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 62 F 8.02 4.76 0.00 3.28 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *66 S 7.80 4.22 0.00 4.22 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 67 K 7.96 3.89 0.00 1.11 0.74 0.00 1.50 0.00 0.00 1.33 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.11 7.81 68 T 8.22 4.15 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 1.29 0.00 0.00 69 F 8.28 4.46 0.00 3.20 3.07 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 0.00 0.00 0.00 0.00 70 I 7.08 4.88 1.97 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.67 0.88 0.00 0.00 71 N 9.21 4.37 0.00 2.77 2.77 0.00 0.00 6.70 8.22 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 72 H 8.71 4.94 0.00 3.00 3.34 0.00 5.95 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.09 4.18 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 1.33 0.00 0.00 74 Q 9.35 3.44 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 75 G 8.11 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 76 I 7.81 3.90 1.57 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.61 -0.06 0.00 0.00 77 P 0.00 4.12 0.00 2.01 2.05 0.00 3.57 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 2.04 2.08 0.00 78 D 8.39 4.22 0.00 2.55 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.24 3.91 0.00 2.70 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 0.00 0.00 0.00 0.00 80 F 7.70 4.04 0.00 3.25 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 81 K 8.39 4.44 0.00 1.73 1.91 0.00 1.56 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.38 1.64 7.81 82 Q 8.08 4.15 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 83 S 7.49 4.02 0.00 3.78 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 84 F 6.96 4.90 0.00 3.13 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 85 P 0.00 4.93 0.00 2.24 2.26 0.00 3.56 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 2.01 2.16 0.00 86 E 8.09 3.91 0.00 2.06 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 2.30 2.37 0.00 87 G 9.19 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 88 F 7.24 5.35 0.00 3.39 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 89 T 9.39 5.25 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 1.19 0.00 0.00 90 W 8.46 5.84 0.00 3.22 3.33 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 91 E 9.14 5.42 0.00 1.90 1.85 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 2.20 2.21 0.00 92 R 8.77 5.17 0.00 1.80 1.85 0.00 2.85 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 93 V 8.68 4.77 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 0.69 0.00 0.00 0.92 0.00 0.00 94 T 8.81 4.88 4.30 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 0.91 0.00 0.00 95 T 8.59 4.75 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 1.17 0.00 0.00 96 Y 8.79 4.53 0.00 3.05 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 97 E 9.36 4.18 0.00 1.99 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 0.00 2.35 2.42 0.00 98 D 8.55 4.72 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.26 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.56 2.41 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 0.00 0.00 0.00 0.00 101 V 7.94 4.91 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 0.94 0.00 0.00 0.92 0.00 0.00 102 L 9.31 5.31 0.00 2.16 1.73 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.83 5.06 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 1.23 0.00 0.00 104 A 9.21 5.27 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.71 4.81 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 1.16 0.00 0.00 106 Q 8.35 4.47 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 107 D 8.61 5.08 0.00 2.62 2.36 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 0.00 108 T 8.56 5.31 3.22 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 1.39 0.00 0.00 109 S 9.06 5.12 0.00 3.91 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 0.00 110 L 8.71 4.75 0.00 1.63 1.71 0.77 0.45 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 0.00 111 Q 8.61 4.22 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 5.96 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 112 D 8.98 4.41 0.00 2.83 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 0.00 113 G 8.28 3.86 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 0.00 0.00 0.00 114 C 7.60 4.68 0.00 3.08 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.63 4.59 0.00 1.51 1.48 1.13 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 116 I 9.20 4.75 1.91 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 1.40 1.15 0.99 0.00 0.00 117 Y 8.92 5.52 0.00 2.94 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 0.00 118 N 9.11 5.20 0.00 2.77 2.59 0.00 0.00 6.45 7.09 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 0.00 119 V 9.13 4.65 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.91 0.00 0.00 120 K 8.84 5.05 0.00 1.56 1.54 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.73 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.22 1.25 7.81 121 I 8.42 4.93 1.93 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 1.09 1.50 1.01 0.00 0.00 122 R 9.30 4.60 0.00 1.85 1.75 0.00 3.09 0.00 0.00 3.18 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 123 G 9.30 4.75 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 0.00 124 V 8.49 4.84 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 0.79 0.00 0.00 0.94 0.00 0.00 125 N 9.00 4.04 0.00 2.81 2.80 0.00 0.00 7.05 7.02 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 0.00 126 F 8.22 4.14 0.00 3.20 2.90 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 0.00 0.00 0.00 127 P 0.00 4.43 0.00 2.21 2.00 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 2.34 2.20 0.00 128 S 8.80 4.28 0.00 4.00 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 0.00 129 N 8.04 4.76 0.00 2.71 2.88 0.00 0.00 6.90 7.65 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 0.00 130 G 7.80 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 0.00 131 P 0.00 4.21 0.00 2.16 2.09 0.00 3.62 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 2.11 2.07 0.00 132 V 7.87 3.51 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 0.67 0.00 0.00 0.79 0.00 0.00 133 M 7.92 3.92 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 134 Q 8.13 4.17 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.72 0.00 0.00 0.00 0.00 0.00 2.48 2.67 0.00 135 K 7.75 3.82 0.00 1.85 1.82 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.40 7.81 136 K 8.72 4.74 0.00 1.58 1.74 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.48 7.81 137 T 7.93 4.86 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 1.16 0.00 0.00 138 L 8.32 4.68 0.00 1.53 1.58 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.52 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 0.00 140 W 8.16 5.31 0.00 3.25 3.20 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 0.00 141 E 9.10 4.41 0.00 1.97 1.95 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 2.58 2.44 0.00 142 A 8.54 4.50 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 0.00 143 S 8.73 4.68 0.00 4.00 3.90 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 0.00 0.00 0.00 144 T 8.39 5.11 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 1.29 0.00 0.00 145 E 9.21 4.84 0.00 1.91 1.66 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 2.10 2.32 0.00 146 M 9.02 4.82 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.47 0.00 147 L 8.78 5.75 0.00 0.64 1.10 0.27 0.34 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 0.00 148 Y 7.46 5.12 0.00 2.94 2.90 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 0.00 0.00 0.00 149 P 0.00 4.73 0.00 1.98 2.01 0.00 3.82 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 2.05 2.26 0.00 150 A 9.22 4.20 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 0.00 151 D 9.43 4.26 0.00 2.85 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 7.84 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 0.00 153 G 7.48 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 0.00 154 L 7.62 4.87 0.00 1.07 1.21 0.30 0.75 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 0.00 155 E 8.34 4.88 0.00 1.16 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 1.96 1.90 0.00 156 G 8.51 5.04 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 0.00 157 R 8.71 5.24 0.00 1.77 1.80 0.00 3.31 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 158 S 8.74 4.87 0.00 3.81 3.52 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 0.00 159 D 8.61 5.45 0.00 2.55 2.51 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 0.00 160 M 8.98 5.04 0.00 1.93 1.69 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 161 A 8.79 5.20 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 0.00 162 L 8.92 4.01 0.00 0.88 1.49 -0.32 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 163 K 8.58 4.17 0.00 1.67 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.61 7.81 164 L 8.48 4.89 0.00 1.63 1.52 0.91 0.49 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 0.00 165 V 8.53 3.56 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 0.71 0.00 0.00 0.91 0.00 0.00 166 G 8.62 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 0.00 167 G 7.57 3.61 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 0.00 0.00 0.00 168 G 7.89 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 0.00 169 H 8.62 5.45 0.00 2.99 3.20 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.85 4.73 0.00 1.78 1.54 1.05 1.33 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 0.00 171 I 8.46 5.12 2.06 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.92 1.00 0.00 0.00 172 C 8.96 5.20 0.00 2.25 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 0.00 0.00 0.00 173 N 8.85 5.36 0.00 2.69 2.59 0.00 0.00 7.38 7.24 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 0.00 174 L 9.10 4.96 0.00 1.59 1.39 0.68 0.37 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 0.00 175 K 8.84 4.82 0.00 1.64 1.67 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.34 7.81 176 T 8.67 5.03 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 0.49 0.00 0.00 177 T 8.54 4.74 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 1.16 0.00 0.00 178 Y 8.95 5.38 0.00 2.58 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 0.00 179 R 9.24 5.15 0.00 1.86 1.89 0.00 3.17 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 180 S 9.14 4.66 0.00 3.25 3.61 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 0.00 181 K 8.52 4.32 0.00 1.88 1.80 0.00 1.86 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.42 1.36 7.81 182 K 7.38 4.30 0.00 1.76 1.56 0.00 1.81 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.70 7.81 183 P 0.00 4.33 0.00 2.20 1.94 0.00 3.64 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 2.10 2.07 0.00 184 A 8.84 4.02 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 0.00 185 K 7.95 4.05 0.00 1.87 1.96 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.46 7.81 186 N 7.98 4.49 0.00 2.85 2.88 0.00 0.00 6.89 7.87 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 0.00 187 L 7.49 4.59 0.00 1.75 1.54 0.73 0.36 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 0.00 188 K 8.90 4.19 0.00 1.69 1.75 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.40 7.81 189 M 8.28 4.27 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 190 P 0.00 4.60 0.00 2.19 2.02 0.00 3.76 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 2.04 2.04 0.00 191 G 8.32 4.02 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 0.00 0.00 0.00 192 V 8.38 4.14 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 0.72 0.00 0.00 0.99 0.00 0.00 193 Y 8.49 4.66 0.00 2.98 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 0.00 194 Y 9.11 5.12 0.00 2.91 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 0.00 195 V 8.71 4.78 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 1.02 0.00 0.00 0.85 0.00 0.00 196 D 8.73 5.34 0.00 2.69 2.56 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 0.00 197 R 9.10 5.16 0.00 1.76 2.09 0.00 2.62 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 198 R 8.72 4.69 0.00 1.92 1.80 0.00 3.22 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 199 L 8.77 5.11 0.00 1.68 1.60 0.94 1.09 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 0.00 200 E 8.98 4.82 0.00 1.98 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 2.26 2.28 0.00 201 R 8.74 4.40 0.00 1.86 1.89 0.00 3.16 0.00 0.00 3.13 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 202 I 8.72 4.22 1.97 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 1.25 0.96 0.91 0.00 0.00 203 K 7.71 4.54 0.00 1.66 1.70 0.00 1.99 0.00 0.00 1.98 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.37 7.81 204 E 8.75 5.24 0.00 1.90 1.72 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 2.12 2.28 0.00 205 A 9.19 4.51 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 0.00 206 D 9.28 4.33 0.00 2.86 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 K 8.60 3.84 0.00 1.87 1.86 0.00 1.83 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.36 7.81 208 E 8.46 3.61 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 2.08 2.20 0.00 209 T 7.54 4.23 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 1.23 0.00 0.00 210 Y 7.74 5.08 0.00 2.88 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 0.00 211 V 7.47 4.41 1.21 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 0.43 0.00 0.00 -0.12 0.00 0.00 212 E 8.95 4.87 0.00 1.88 1.68 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 2.14 2.30 0.00 213 Q 8.94 5.20 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 214 H 9.06 5.22 0.00 3.21 3.09 0.00 5.73 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 E 8.76 5.22 0.00 2.00 1.63 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 2.17 2.22 0.00 216 V 8.49 4.99 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 0.69 0.00 0.00 0.97 0.00 0.00 217 A 8.88 5.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 V 8.68 4.61 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 0.97 0.00 0.00 0.96 0.00 0.00 219 A 8.94 5.19 1.08 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 0.00 220 R 8.39 4.51 0.00 1.94 2.02 0.00 2.80 0.00 0.00 3.20 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 221 Y 8.26 5.10 0.00 3.05 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 0.00 222 C 8.87 4.57 0.00 3.06 2.93 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 0.00 223 D 8.62 4.66 0.00 2.72 2.73 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 0.00 224 L 7.62 4.19 0.00 1.63 1.60 0.89 1.02 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 0.00 225 P 0.00 4.30 0.00 2.04 1.98 0.00 3.63 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 226 S 8.22 4.58 0.00 3.80 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 0.00 227 K 8.59 4.00 0.00 1.78 1.90 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.51 7.81 228 L 7.78 4.19 0.00 1.63 1.57 0.92 0.80 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 * Residues marked with a * may have inaccurate shift predictions.