NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.3276 8.1885 115.3962 57.9324 64.0500 173.5784 7 A 3.0255 8.3417 128.0195 54.9340 17.8453 177.2850 8 Q 3.7650 8.3875 117.5576 59.4174 29.1753 178.0690 9 A 3.9184 7.6677 121.1960 54.8305 18.4320 179.7598 10 I 3.5971 7.8244 119.0510 64.3543 37.1104 178.6296 11 I 3.6143 7.3568 120.3176 63.9676 36.5145 178.3279 12 R 3.7986 7.5328 119.6947 59.2448 29.7920 178.1502 13 E 3.9210 8.0048 118.2822 58.4366 29.7258 177.2155 14 L 4.2654 7.6121 116.3891 53.6702 42.7299 176.1919 15 G 3.7118 7.3459 105.1673 46.3614 0.0000 174.1622 16 L 4.5068 8.0577 118.8887 54.6410 42.5872 177.3727 17 E 5.0367 9.5626 120.9196 53.6516 34.2785 173.3285 18 P 4.4998 0.0000 0.0000 63.7637 31.9305 175.3974 19 H 4.7903 9.1180 123.8676 53.6723 31.5362 173.8048 20 P 4.2022 0.0000 0.0000 65.5833 31.3390 177.1308 21 E 4.3765 8.3814 113.6504 55.7840 30.2340 175.1422 22 G 4.1181 8.2094 105.7082 45.7437 0.0000 174.7955 23 G 3.6557 8.4422 108.1534 44.3402 0.0000 172.0961 24 F 5.6249 8.3503 115.9205 56.0261 43.0749 174.2766 25 Y 5.6798 9.9611 120.2546 56.7455 42.5655 173.1845 26 H 4.2483 8.6015 117.1133 55.0699 33.7920 172.1125 27 Q 4.6690 8.2246 128.3105 56.1487 29.1107 175.3019 28 T 4.4726 8.1124 116.0357 61.6655 70.1121 174.5042 29 F 4.7241 7.5011 121.7078 57.6614 42.9114 172.6042 30 R 4.2930 7.8004 125.5402 54.2024 32.3203 173.7901 31 D 4.0435 7.7391 127.1291 54.7080 41.6221 177.7472 32 K 3.9606 8.8775 124.1490 58.0877 32.7610 176.9242 33 A 4.4769 8.9821 122.7302 51.6178 20.5452 176.8342 34 G 3.4837 8.2368 105.6870 45.9681 0.0000 174.6443 35 G 3.9076 7.9450 107.6054 43.9673 0.0000 174.6803 36 E 3.9077 8.8475 117.5129 59.6639 29.4920 179.5563 37 R 3.8489 7.9073 117.1340 57.1407 30.6480 178.1598 38 G 4.2593 7.8434 100.8806 46.5586 0.0000 173.7517 39 H 4.4536 8.5620 117.3275 58.9060 29.3334 175.7040 40 S 5.6840 7.7970 110.2190 58.9021 66.0526 174.2901 41 T 5.1931 8.8867 109.6739 60.1065 72.5470 172.6467 42 A 5.2609 8.9719 123.1957 50.7330 23.1045 175.1154 43 I 4.8800 8.1201 118.8308 60.3200 42.4391 173.5814 44 Y 5.2285 8.7406 122.9667 57.1916 39.8866 174.1943 45 Y 5.4473 9.3921 123.9848 56.0698 43.0204 173.5267 46 L 5.2298 8.6273 126.9221 53.4136 46.1141 174.8138 47 L 5.1831 8.7323 124.7445 53.0256 45.4577 175.2563 48 E 5.2996 8.4234 120.5931 53.6919 33.4516 175.6063 49 K 3.3273 8.7011 122.6691 60.3399 32.1331 174.8608 50 G 3.8552 9.7825 121.6638 44.0877 0.0000 173.3151 51 V 3.5315 8.6052 126.1377 61.6091 31.5269 175.8532 52 R 4.9777 8.2515 120.8785 54.1268 33.6622 173.4599 53 S 5.0630 8.8426 114.0472 58.1171 63.3094 173.7715 54 H 4.7947 9.1366 124.9059 54.4503 30.1337 175.3307 55 W 4.9456 8.8294 120.3496 58.0898 29.6027 175.2681 56 H 5.3338 9.7036 119.1188 55.5619 32.0931 172.2681 57 R 4.7539 8.4732 113.1301 55.1420 33.0470 174.5886 58 V 4.5023 8.3048 122.1189 61.6892 31.8750 175.8365 59 T 3.9293 8.5640 120.6034 63.8251 68.9401 174.6567 60 D 5.0512 7.8454 118.5405 52.2360 40.6120 175.3589 61 A 4.6939 7.7870 118.7936 51.3937 23.2071 176.0790 62 V 4.5118 8.3370 119.0848 61.9909 33.8354 174.3478 63 E 5.2147 9.1686 127.3328 54.4645 32.7964 174.2608 64 V 4.7843 8.9556 127.5600 61.2021 33.6466 174.4001 65 W 4.9559 9.2308 128.6610 56.0326 31.0977 175.0945 66 H 5.3617 9.0797 121.0314 54.0177 31.7182 172.2700 67 Y 4.4138 9.0258 125.6490 58.0159 38.6073 173.8144 68 Y 4.9285 7.9542 122.1012 59.2955 41.0633 175.3498 69 A 4.1866 7.2833 117.8605 52.0308 22.8704 177.1046 70 G 2.8653 8.7112 106.3101 43.8516 0.0000 173.0952 71 A 4.3016 7.1767 120.3383 51.2239 19.3460 176.1673 72 P 4.7507 0.0000 0.0000 62.7019 33.5437 174.8711 73 I 5.0038 8.7400 119.4329 59.4447 41.2904 175.1155 74 A 4.8476 8.6625 126.9779 50.5829 20.6109 175.6808 75 L 4.5223 8.9710 125.5526 54.2341 44.2554 174.7936 76 H 5.4329 8.7132 124.2027 54.2383 31.2188 173.9886 77 L 5.4847 9.2488 122.7101 53.1741 45.7149 175.8502 78 S 5.0120 9.4100 117.3263 55.8891 64.3488 174.1780 79 Q 4.0956 9.1477 129.6914 58.3072 29.0992 176.4010 80 D 4.7705 8.2445 114.1067 52.5524 40.5403 176.8241 81 G 4.0404 8.5198 108.7467 46.2799 0.0000 174.1608 82 R 4.2313 8.6980 115.6046 56.7815 32.3675 175.4703 83 E 4.6195 7.9756 115.9689 55.5531 31.7361 174.8747 84 V 4.8768 8.1982 120.1160 60.2564 34.9769 174.3346 85 Q 4.7655 9.4646 121.6335 54.5260 31.7497 174.4848 86 T 4.9838 8.5558 119.9016 61.8445 70.5929 173.4453 87 F 4.7151 9.3754 129.0614 56.6462 42.9698 174.4048 88 T 4.8614 8.6886 121.3868 62.0652 70.2001 173.7803 89 L 4.4566 9.2356 131.6356 54.5937 42.5089 175.5247 90 G 4.6979 8.6240 112.6470 45.7053 0.0000 169.5981 91 P 4.4327 0.0000 0.0000 63.5812 32.7001 176.9037 92 A 4.3363 7.7261 123.9941 51.4564 16.1805 177.8193 93 I 3.9415 7.4720 123.4108 63.6823 37.8334 177.5329 94 L 4.5983 7.8177 116.8007 54.5490 41.6125 176.2317 95 E 4.5333 8.5326 117.5260 56.1036 30.0556 176.8790 96 G 3.8532 8.4184 105.1476 45.8811 0.0000 173.6889 97 E 4.9005 7.7216 118.5080 54.7342 32.0185 174.9357 98 R 5.1395 8.4652 118.5775 54.3102 34.5557 174.0783 99 P 4.6919 0.0000 0.0000 63.4901 32.8594 175.1394 100 Q 4.9903 7.7213 121.8625 54.7406 31.9851 174.1517 101 V 4.2328 8.5078 125.5410 59.9409 34.8702 174.3473 102 I 4.4023 8.3991 125.6840 60.4253 38.2770 175.1895 103 V 4.2790 8.9717 128.4136 60.5326 33.0503 173.6080 104 P 4.7730 0.0000 0.0000 62.0372 32.6948 176.0210 105 A 4.8240 8.5120 124.0357 53.3807 18.6857 177.0429 106 N 4.0239 8.9890 119.0476 54.3318 38.1566 172.8920 107 C 4.5757 7.6419 116.3997 57.2816 32.6212 173.5977 108 W 4.9227 8.7831 126.7109 57.7215 30.2516 175.0700 109 Q 5.8762 10.0471 119.6949 56.1156 31.7814 173.3336 110 S 4.7831 7.9816 113.8708 57.7433 66.3605 172.4533 111 A 5.4520 8.6141 121.1027 52.2969 23.1099 175.0231 112 E 4.9141 8.2629 115.7260 54.8387 33.0194 174.5437 113 S 4.5036 8.7391 117.2591 58.4520 63.1943 173.3513 114 L 4.5048 8.6393 125.9934 54.7868 41.9124 177.1027 115 G 3.9358 7.6001 107.8436 45.0779 0.0000 172.4256 116 D 4.7711 8.9703 118.5447 57.2798 41.8949 176.5915 117 F 5.4436 7.5115 110.5975 56.5192 41.5707 172.8819 118 T 4.9306 9.1021 115.5882 62.0350 73.0951 172.6539 119 L 5.1322 9.2365 129.0005 53.6775 44.3877 175.6215 120 V 4.5331 9.7449 119.6750 59.4441 36.5229 174.3186 121 G 4.3935 8.3664 107.5761 43.6069 0.0000 171.8243 122 C 5.2672 8.8132 120.0338 57.6658 31.9077 172.9778 123 T 4.9106 8.8034 114.2409 59.8227 71.1544 173.3490 124 V 4.8516 8.3007 125.1202 60.9444 33.9334 174.6966 125 S 4.3557 9.2030 125.2784 59.6735 62.4764 171.4048 126 P 4.3878 0.0000 0.0000 64.1212 32.3978 176.4387 127 G 4.0431 8.4545 110.9567 45.7165 0.0000 173.2502 128 F 4.1322 8.6495 127.6034 58.2040 40.1807 174.4500 129 A 4.3988 6.6696 128.3121 50.4253 22.0173 177.3205 130 F 4.0840 8.7258 121.8935 60.0262 39.2061 176.8563 131 S 4.4851 7.9683 113.2270 59.0393 63.0789 174.2307 132 S 4.6414 8.3039 115.7662 58.1427 65.2930 172.5556 133 F 5.2345 8.0955 122.8194 56.8036 41.0689 174.9985 134 V 4.0848 7.1798 124.0392 61.4758 35.4520 173.3176 *136 A 4.2110 8.4090 122.7138 51.4564 19.5235 176.3819 137 E 4.1188 8.0536 118.9919 55.5414 30.1798 175.4969 138 P 4.6581 0.0000 0.0000 64.3001 31.9006 177.0275 139 G 4.1024 9.0082 108.7512 45.5467 0.0000 174.0789 140 W 4.2589 7.9071 129.0136 57.4771 31.4782 175.0665 141 S 3.4065 6.6973 115.7573 55.2704 65.0550 171.6920 142 P 3.2138 0.0000 0.0000 63.5363 31.3624 175.0426 143 G 3.9339 8.0191 114.0918 46.3917 0.0000 173.5932 144 D 4.3881 7.3777 123.5656 54.3101 40.6668 176.0388 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 6 S 8.19 4.33 0.00 3.98 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 7 A 8.34 3.03 1.10 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 0.00 0.00 8 Q 8.39 3.76 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 9 A 7.67 3.92 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 10 I 7.82 3.60 1.72 0.00 0.00 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 1.33 0.75 0.72 0.00 0.00 11 I 7.36 3.61 1.74 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.51 0.60 0.00 0.00 12 R 7.53 3.80 0.00 1.75 1.93 0.00 3.02 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 13 E 8.00 3.92 0.00 1.95 1.86 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 2.21 2.21 0.00 14 L 7.61 4.27 0.00 1.63 1.53 0.24 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.35 3.71 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 16 L 8.06 4.51 0.00 1.59 1.74 0.95 0.65 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 17 E 9.56 5.04 0.00 1.85 1.91 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 2.28 2.28 0.00 18 P 0.00 4.50 0.00 1.99 1.97 0.00 3.81 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.40 0.00 19 H 9.12 4.79 0.00 3.21 3.46 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.20 0.00 2.01 2.12 0.00 2.80 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 21 E 8.38 4.38 0.00 2.29 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 0.00 2.16 2.36 0.00 22 G 8.21 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 23 G 8.44 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 0.00 0.00 0.00 24 F 8.35 5.62 0.00 3.06 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 25 Y 9.96 5.68 0.00 3.36 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 H 8.60 4.25 0.00 3.29 3.22 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 8.22 4.67 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.61 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 28 T 8.11 4.47 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 1.20 0.00 0.00 29 F 7.50 4.72 0.00 2.99 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 30 R 7.80 4.29 0.00 1.62 1.55 0.00 3.23 0.00 0.00 3.23 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.54 0.00 31 D 7.74 4.04 0.00 2.69 2.53 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 32 K 8.88 3.96 0.00 1.78 1.83 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.37 7.81 33 A 8.98 4.48 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.24 3.48 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 0.00 35 G 7.94 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.85 3.91 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 2.30 2.40 0.00 37 R 7.91 3.85 0.00 1.82 1.92 0.00 3.08 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 38 G 7.84 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 0.00 0.00 0.00 0.00 39 H 8.56 4.45 0.00 3.22 3.40 0.00 5.71 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 7.80 5.68 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.89 5.19 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 1.16 0.00 0.00 42 A 8.97 5.26 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 43 I 8.12 4.88 1.74 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.44 1.11 0.00 0.00 44 Y 8.74 5.23 0.00 3.06 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 45 Y 9.39 5.45 0.00 2.76 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 46 L 8.63 5.23 0.00 1.73 1.47 0.79 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.73 5.18 0.00 1.66 1.53 1.12 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.42 5.30 0.00 1.89 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 2.34 2.36 0.00 49 K 8.70 3.33 0.00 1.78 1.81 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.50 7.81 50 G 9.78 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 51 V 8.61 3.53 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 1.04 0.00 0.00 0.89 0.00 0.00 52 R 8.25 4.98 0.00 2.15 2.08 0.00 2.83 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 1.54 1.81 0.00 53 S 8.84 5.06 0.00 4.32 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 H 9.14 4.79 0.00 3.20 3.43 0.00 5.92 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 W 8.83 4.95 0.00 3.43 3.41 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 56 H 9.70 5.33 0.00 3.26 3.59 0.00 5.30 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 57 R 8.47 4.75 0.00 1.49 1.42 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.98 0.00 58 V 8.30 4.50 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 0.85 0.00 0.00 1.20 0.00 0.00 59 T 8.56 3.93 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 60 D 7.85 5.05 0.00 2.60 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 61 A 7.79 4.69 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 8.34 4.51 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 0.99 0.00 0.00 0.95 0.00 0.00 63 E 9.17 5.21 0.00 2.12 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 2.21 2.29 0.00 64 V 8.96 4.78 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 0.76 0.00 0.00 0.96 0.00 0.00 65 W 9.23 4.96 0.00 3.13 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 66 H 9.08 5.36 0.00 2.61 3.10 0.00 5.81 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 9.03 4.41 0.00 3.02 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 68 Y 7.95 4.93 0.00 2.97 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.28 4.19 1.27 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 0.00 0.00 0.00 70 G 8.71 2.87 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 71 A 7.18 4.30 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.75 0.00 2.09 2.11 0.00 3.61 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 2.05 1.95 0.00 73 I 8.74 5.00 1.95 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.02 0.84 0.00 0.00 74 A 8.66 4.85 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 75 L 8.97 4.52 0.00 1.35 1.28 0.09 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 76 H 8.71 5.43 0.00 2.86 3.38 0.00 5.61 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 77 L 9.25 5.48 0.00 1.65 1.65 0.97 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 78 S 9.41 5.01 0.00 3.92 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 79 Q 9.15 4.10 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.61 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 80 D 8.24 4.77 0.00 2.87 2.80 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 0.00 0.00 0.00 81 G 8.52 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 82 R 8.70 4.23 0.00 1.84 1.85 0.00 3.27 0.00 0.00 3.27 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 83 E 7.98 4.62 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.26 0.00 84 V 8.20 4.88 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 0.78 0.00 0.00 1.26 0.00 0.00 85 Q 9.46 4.77 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 86 T 8.56 4.98 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 1.17 0.00 0.00 87 F 9.38 4.72 0.00 3.00 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 88 T 8.69 4.86 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 1.21 0.00 0.00 89 L 9.24 4.46 0.00 1.62 1.58 0.96 1.22 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 90 G 8.62 4.70 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 0.00 0.00 0.00 91 P 0.00 4.43 0.00 2.12 2.01 0.00 3.26 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 1.72 1.63 0.00 92 A 7.73 4.34 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.47 3.94 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 1.67 0.86 0.93 0.00 0.00 94 L 7.82 4.60 0.00 1.62 1.67 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.53 4.53 0.00 1.91 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 2.20 2.33 0.00 96 G 8.42 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 97 E 7.72 4.90 0.00 2.09 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 2.30 2.28 0.00 98 R 8.47 5.14 0.00 2.05 1.80 0.00 3.36 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.03 0.00 99 P 0.00 4.69 0.00 2.25 2.39 0.00 3.68 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 2.11 2.01 0.00 100 Q 7.72 4.99 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.73 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 101 V 8.51 4.23 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 0.00 0.00 0.40 0.00 0.00 0.64 0.00 0.00 102 I 8.40 4.40 1.89 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 1.25 0.56 0.94 0.00 0.00 103 V 8.97 4.28 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 1.13 0.00 0.00 0.98 0.00 0.00 104 P 0.00 4.77 0.00 2.40 1.98 0.00 3.72 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 105 A 8.51 4.82 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 0.00 106 N 8.99 4.02 0.00 2.91 2.81 0.00 0.00 7.08 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 0.00 107 C 7.64 4.58 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 0.00 108 W 8.78 4.92 0.00 3.80 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 0.00 109 Q 10.05 5.88 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.62 0.00 0.00 0.00 0.00 0.00 2.51 2.05 0.00 110 S 7.98 4.78 0.00 3.29 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 0.00 111 A 8.61 5.45 0.99 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 0.00 0.00 112 E 8.26 4.91 0.00 1.98 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 2.27 2.26 0.00 113 S 8.74 4.50 0.00 3.96 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 0.00 114 L 8.64 4.50 0.00 1.76 1.66 0.97 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.60 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 0.00 0.00 0.00 116 D 8.97 4.77 0.00 2.77 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 0.00 117 F 7.51 5.44 0.00 3.18 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 9.10 4.93 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 119 L 9.24 5.13 0.00 1.92 1.63 0.94 0.93 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 0.00 120 V 9.74 4.53 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 0.85 0.00 0.00 1.07 0.00 0.00 121 G 8.37 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 0.00 122 C 8.81 5.27 0.00 2.47 2.54 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 0.00 0.00 0.00 0.00 123 T 8.80 4.91 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 1.23 0.00 0.00 124 V 8.30 4.85 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 1.48 0.00 0.00 0.96 0.00 0.00 125 S 9.20 4.36 0.00 3.98 3.65 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 0.00 126 P 0.00 4.39 0.00 1.95 2.01 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 127 G 8.45 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 0.00 128 F 8.65 4.13 0.00 2.93 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 0.00 129 A 6.67 4.40 1.04 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 0.00 130 F 8.73 4.08 0.00 3.23 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 7.97 4.49 0.00 3.97 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 0.00 132 S 8.30 4.64 0.00 3.57 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 0.00 133 F 8.10 5.23 0.00 2.84 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 0.00 134 V 7.18 4.08 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 0.76 0.00 0.00 0.79 0.00 0.00 *136 A 8.41 4.21 0.70 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 0.00 0.00 137 E 8.05 4.12 0.00 2.04 1.91 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 2.28 2.25 0.00 138 P 0.00 4.66 0.00 2.10 2.09 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 139 G 9.01 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 0.00 0.00 0.00 0.00 140 W 7.91 4.26 0.00 3.18 3.11 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 0.00 141 S 6.70 3.41 0.00 3.60 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 3.21 0.00 1.55 1.46 0.00 2.82 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 1.01 0.60 0.00 143 G 8.02 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 0.00 144 D 7.38 4.39 0.00 2.16 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.