NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 S 4.3924 8.3349 115.4096 57.6651 64.6157 173.6107 14 L 3.7858 8.0096 121.8340 54.0926 41.6425 176.0993 15 S 4.3789 8.7041 120.6408 56.7555 65.4642 172.8312 16 A 4.0453 7.9718 123.9183 51.2511 18.9786 176.6298 17 Y 4.6231 7.9170 117.4121 58.4952 38.6686 176.3998 18 K 4.3845 10.2265 124.4594 57.8732 34.4893 176.3426 19 T 4.9975 8.3228 117.1585 61.7947 71.5902 173.3999 20 V 4.7860 8.9158 127.7123 60.9200 34.3013 174.2871 21 V 4.9555 8.4607 128.1185 61.1013 33.7754 174.6458 22 V 4.9162 9.0513 127.2819 59.9165 34.4454 174.7464 23 G 4.4630 8.5670 110.8563 45.3441 0.0000 172.8056 24 T 5.3060 8.9599 115.8781 61.1204 70.6619 173.0464 25 D 4.7387 8.9689 126.3142 52.9044 39.8797 176.7568 26 G 4.0746 8.3310 110.3013 45.7051 0.0000 174.8390 27 S 4.2208 7.7423 113.3798 58.4825 63.3881 174.1558 28 D 4.5470 8.9258 122.8169 57.7715 40.8486 178.3708 29 S 4.2569 8.1812 111.8242 61.5030 63.1241 177.2720 30 S 4.1488 7.7686 116.8162 57.5682 61.7253 175.8402 *32 R 4.2036 8.1897 120.2673 55.8361 31.8177 177.0607 33 A 4.0467 8.3518 120.0868 54.7807 18.2118 179.7701 34 V 3.4957 7.7016 116.4236 66.2972 31.6148 177.6759 35 D 4.3650 8.0958 118.0690 57.3938 40.7074 178.7341 36 R 3.8314 7.8532 118.2028 59.4659 30.1520 178.1720 37 A 3.9870 8.4227 120.7444 55.1981 18.3170 179.4122 38 A 3.9108 8.4265 119.4241 55.4228 18.2946 179.3633 39 Q 3.9377 8.0465 116.8496 59.7934 29.1063 178.7468 40 I 3.9322 7.7723 119.1816 64.0483 37.0584 178.0541 41 A 4.1570 8.2833 122.0208 53.5870 18.6905 178.7131 42 G 3.8144 9.3516 106.0181 47.1853 0.0000 174.9126 43 A 4.7498 8.8312 125.9971 51.4804 19.7414 176.1634 44 D 4.9209 8.2264 113.7255 53.8904 42.1698 175.1935 45 A 4.9191 7.4813 119.8068 49.8382 22.6593 176.1310 46 K 4.3453 9.2515 122.0625 55.8545 33.7489 175.3187 47 L 5.1220 9.2380 129.9370 53.3529 44.6606 174.8104 48 I 4.9243 8.8552 127.4778 59.7077 40.1084 174.5659 49 I 4.7834 8.5059 128.6774 60.1804 38.8112 175.0810 50 A 5.7649 9.4431 127.8075 49.1898 22.7280 174.7951 51 S 4.9326 8.3481 113.8428 56.3635 66.1928 172.7832 52 A 4.6243 8.6729 128.7454 51.9662 19.2738 176.2273 53 Y 4.3714 8.8990 124.9178 56.6413 38.5912 175.4351 54 L 4.1268 8.3052 127.7114 56.9989 43.8743 177.5282 55 P 3.9808 0.0000 0.0000 63.8728 30.0010 178.3208 *76 T 4.0291 8.9456 114.6014 61.8940 69.0000 172.0656 77 A 4.1571 8.7889 130.4214 52.3919 19.1632 176.6341 78 P 4.3518 0.0000 0.0000 65.6360 31.2605 178.7096 79 I 3.6565 7.8475 117.0709 64.3709 37.7218 177.3227 80 Y 4.0766 7.8419 117.6252 60.7616 37.5714 178.0278 81 E 3.9987 8.2413 119.9336 59.2725 29.7498 178.7040 82 I 3.6989 7.8145 119.3409 64.5545 37.1664 178.0705 83 L 3.9646 8.0880 119.6408 58.0553 41.4646 178.9552 84 H 4.1343 8.7148 118.4275 59.5964 29.7828 176.8968 85 D 4.2843 8.5394 120.6443 57.2168 40.5478 178.5456 86 A 3.9762 8.1555 121.2810 55.3550 18.3232 179.8225 87 K 3.8009 8.1966 116.8773 59.6363 31.9807 179.1757 88 E 3.9177 7.9835 118.8547 59.4271 29.3985 179.2541 89 R 3.8957 8.1915 117.5256 59.5045 30.1892 178.9075 90 A 3.9942 8.1937 120.3623 55.5311 18.3945 179.4041 91 H 4.8529 8.3166 116.0920 58.8921 28.6483 177.9545 92 N 4.4832 8.2475 116.3194 55.5739 38.3930 176.3896 93 A 4.4011 7.7785 120.3910 52.1463 18.8018 178.0212 94 G 3.8258 7.9608 106.5972 45.0634 0.0000 173.9418 95 A 4.3910 8.3593 124.6232 51.8464 18.1552 177.9790 96 K 4.1012 8.3300 124.3654 59.1337 32.9871 178.2574 97 N 4.7456 7.7628 123.6512 52.4301 38.4067 172.7697 98 V 5.0630 8.1487 122.3331 60.7322 34.6255 174.1075 99 E 4.9063 9.2670 124.8178 54.6792 33.2905 174.5917 100 E 4.8317 8.5370 119.6271 55.5737 32.5322 175.2801 101 R 4.2970 8.0657 114.8853 55.1066 33.8512 172.0373 102 P 4.8374 0.0000 0.0000 62.5467 32.5835 175.7670 103 I 4.5219 8.7378 124.2037 59.5597 39.5742 174.8373 104 V 4.5269 8.2743 126.0853 62.1005 34.0388 177.2706 105 G 3.6602 8.8902 113.4743 45.6355 0.0000 173.8366 106 A 3.9809 8.5198 124.3664 51.7900 18.8652 175.9563 107 P 4.1542 0.0000 0.0000 67.2333 31.0681 178.4012 108 V 3.5857 7.7199 117.2966 65.7771 31.5433 177.2909 109 D 4.4252 8.1870 117.7657 57.3991 40.6735 178.8415 110 A 3.9409 8.2323 121.1564 55.0810 18.4254 179.2150 111 L 3.8517 8.3564 119.2897 58.5055 42.1309 179.3567 112 V 3.5808 8.3016 118.3095 65.8813 31.3440 177.4359 113 N 4.2311 8.2524 116.8638 56.6994 38.8562 176.5573 114 L 3.9075 8.4250 121.8446 58.1064 42.1588 178.7300 115 A 3.9827 8.4144 121.1422 55.3588 17.7858 179.3746 116 D 4.4692 8.1158 117.3283 57.2117 40.6915 178.6337 117 E 4.0080 8.2451 119.4640 58.4618 29.7740 177.6860 118 E 4.3969 8.1764 115.4711 54.6574 31.1851 175.6158 119 K 3.7718 7.5371 116.5997 57.2980 30.0836 175.3940 120 A 4.3176 8.3501 120.8447 52.4227 19.2091 177.5934 121 D 4.9915 8.4463 118.3404 53.0760 41.2222 175.9665 122 L 4.3124 7.4562 121.2623 53.6580 45.6203 173.7888 123 L 5.2216 8.3835 125.2988 52.8592 44.6035 175.8400 124 V 4.4777 9.0038 123.1885 61.2249 34.4020 174.7099 125 V 4.7964 8.2938 119.2362 59.6397 35.9456 174.9161 126 G 3.9190 8.5160 111.4640 44.2025 0.0000 173.5660 127 N 4.4482 8.4998 122.0562 53.6574 39.6112 174.1012 128 V 4.3358 7.1699 122.1205 60.5803 33.9830 172.4452 129 G 3.9164 7.4551 108.5292 45.9563 0.0000 171.7412 130 L 4.7355 8.2210 118.8690 52.8945 43.7095 177.1529 131 S 4.4073 8.5872 116.5041 58.9957 63.7997 174.7623 132 T 4.2376 7.4828 112.9454 61.1126 70.8112 175.2700 133 I 3.6364 8.1927 121.1745 64.4950 37.0438 178.4368 134 A 4.0679 8.0299 121.0317 55.3130 18.1005 179.6908 135 G 3.5902 8.1558 102.9877 47.8235 0.0000 175.3582 136 R 4.2652 7.9610 119.5565 58.1005 30.2881 178.5710 137 L 4.0820 8.1918 119.9648 57.2569 42.2050 177.8710 138 L 4.5445 7.9414 116.6320 55.1766 42.2888 177.1769 139 G 3.9388 7.5643 108.2225 44.7702 0.0000 173.4576 140 S 4.8330 8.1259 112.9378 56.0785 66.7319 174.9009 141 V 3.5503 8.2297 123.3340 65.7390 31.3891 176.4322 142 P 4.2219 0.0000 0.0000 66.2031 31.0088 178.1503 143 A 4.0326 7.7331 119.1502 54.4258 18.1501 179.2601 144 N 4.2273 8.0134 115.8136 56.9308 39.1183 177.3412 145 V 3.5239 8.3603 120.0214 66.0561 31.4964 177.8907 146 S 4.3549 8.0590 114.3099 60.7031 61.7627 176.1806 147 R 3.9285 7.8114 120.9799 59.2342 29.6849 178.6525 148 R 3.9338 8.5341 116.9753 58.9704 30.2348 178.0900 149 A 4.3905 8.2332 117.2849 50.5746 19.3284 176.6280 150 K 3.8138 7.4877 117.6635 57.7607 31.0209 174.4060 151 V 4.5518 7.3999 114.0206 59.4905 34.6002 174.0953 152 D 4.7230 8.3482 119.6684 53.2180 42.0086 176.3830 153 V 4.4176 8.1109 120.8910 60.8150 34.1997 174.5171 154 L 4.6931 8.4798 127.5028 53.1822 44.2818 175.2057 155 I 4.3687 8.3917 126.6514 59.5160 38.7685 174.8999 156 V 4.3187 8.2311 125.5073 61.1358 32.7526 175.1463 157 H 4.5924 8.7875 122.8620 55.3826 29.4938 174.3152 158 T 4.4211 8.2515 110.5134 61.3789 70.6260 174.6277 159 T 3.8170 8.5738 120.1846 64.2417 68.7440 171.9463 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 13 S 8.33 4.39 0.00 3.98 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 14 L 8.01 3.79 0.00 1.69 1.60 0.89 0.62 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 15 S 8.70 4.38 0.00 3.94 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 16 A 7.97 4.05 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 17 Y 7.92 4.62 0.00 3.04 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 18 K 10.23 4.38 0.00 1.71 1.87 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.45 7.81 19 T 8.32 5.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 20 V 8.92 4.79 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 0.94 0.00 0.00 0.92 0.00 0.00 21 V 8.46 4.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.90 0.00 0.00 22 V 9.05 4.92 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 0.77 0.00 0.00 0.97 0.00 0.00 23 G 8.57 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.96 5.31 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 25 D 8.97 4.74 0.00 2.79 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 26 G 8.33 4.07 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 0.00 0.00 0.00 27 S 7.74 4.22 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 28 D 8.93 4.55 0.00 2.68 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 29 S 8.18 4.26 0.00 3.97 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 30 S 7.77 4.15 0.00 3.99 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 *32 R 8.19 4.20 0.00 1.88 2.17 0.00 3.23 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 33 A 8.35 4.05 1.33 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 0.00 0.00 34 V 7.70 3.50 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.92 0.00 0.00 35 D 8.10 4.37 0.00 2.88 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 36 R 7.85 3.83 0.00 1.93 2.08 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 37 A 8.42 3.99 1.38 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 0.00 0.00 38 A 8.43 3.91 1.41 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 39 Q 8.05 3.94 0.00 2.18 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 40 I 7.77 3.93 2.06 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 1.52 0.88 1.11 0.00 0.00 41 A 8.28 4.16 1.41 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 42 G 9.35 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 43 A 8.83 4.75 1.24 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 44 D 8.23 4.92 0.00 2.64 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 45 A 7.48 4.92 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 46 K 9.25 4.35 0.00 1.81 1.70 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.39 7.81 47 L 9.24 5.12 0.00 1.74 1.62 0.99 0.76 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 48 I 8.86 4.92 1.86 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 1.23 0.54 0.91 0.00 0.00 49 I 8.51 4.78 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.96 0.90 0.00 0.00 50 A 9.44 5.76 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 51 S 8.35 4.93 0.00 3.86 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 52 A 8.67 4.62 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 8.90 4.37 0.00 2.78 2.99 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 54 L 8.31 4.13 0.00 1.50 1.58 0.86 1.05 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 55 P 0.00 3.98 0.00 1.28 1.47 0.00 2.70 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.85 0.00 *76 T 8.95 4.03 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 1.24 0.00 0.00 77 A 8.79 4.16 1.38 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 0.00 0.00 78 P 0.00 4.35 0.00 2.20 2.16 0.00 3.71 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 2.15 2.20 0.00 79 I 7.85 3.66 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.31 0.00 0.00 80 Y 7.84 4.08 0.00 3.31 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 81 E 8.24 4.00 0.00 2.13 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 0.00 2.48 2.40 0.00 82 I 7.81 3.70 2.06 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 1.64 0.42 0.93 0.00 0.00 83 L 8.09 3.96 0.00 1.92 1.91 0.85 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.71 4.13 0.00 3.33 3.57 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.54 4.28 0.00 2.85 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 86 A 8.16 3.98 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 87 K 8.20 3.80 0.00 1.92 1.75 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.60 7.81 88 E 7.98 3.92 0.00 1.99 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 2.25 2.43 0.00 89 R 8.19 3.90 0.00 1.94 2.16 0.00 3.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 90 A 8.19 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 8.32 4.85 0.00 3.44 3.33 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.25 4.48 0.00 2.70 2.89 0.00 0.00 7.08 6.86 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 93 A 7.78 4.40 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 7.96 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 0.00 0.00 0.00 95 A 8.36 4.39 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.33 4.10 0.00 1.79 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.55 7.81 97 N 7.76 4.75 0.00 2.81 2.80 0.00 0.00 6.31 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.15 5.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.98 0.00 0.00 99 E 9.27 4.91 0.00 2.01 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 2.18 2.24 0.00 100 E 8.54 4.83 0.00 2.02 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 2.26 2.36 0.00 101 R 8.07 4.30 0.00 1.93 1.90 0.00 3.14 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 102 P 0.00 4.84 0.00 1.91 1.77 0.00 3.70 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 2.07 2.03 0.00 103 I 8.74 4.52 1.92 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 1.11 0.95 0.92 0.00 0.00 104 V 8.27 4.53 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 0.83 0.00 0.00 0.97 0.00 0.00 105 G 8.89 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 0.00 106 A 8.52 3.98 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 0.00 107 P 0.00 4.15 0.00 2.26 2.35 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 108 V 7.72 3.59 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.92 0.00 0.00 109 D 8.19 4.43 0.00 2.72 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 0.00 110 A 8.23 3.94 1.39 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 0.00 111 L 8.36 3.85 0.00 1.87 1.87 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.30 3.58 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 0.93 0.00 0.00 0.95 0.00 0.00 113 N 8.25 4.23 0.00 2.96 3.02 0.00 0.00 6.85 6.31 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 0.00 114 L 8.42 3.91 0.00 1.74 1.82 0.92 1.00 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 0.00 115 A 8.41 3.98 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 0.00 116 D 8.12 4.47 0.00 2.89 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 0.00 117 E 8.25 4.01 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 118 E 8.18 4.40 0.00 2.08 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 2.26 2.46 0.00 119 K 7.54 3.77 0.00 1.92 1.85 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.50 7.81 120 A 8.35 4.32 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 0.00 121 D 8.45 4.99 0.00 2.86 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 0.00 122 L 7.46 4.31 0.00 0.27 0.92 0.57 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.38 5.22 0.00 1.46 1.48 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 124 V 9.00 4.48 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 0.96 0.00 0.00 0.87 0.00 0.00 125 V 8.29 4.80 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 126 G 8.52 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 0.00 127 N 8.50 4.45 0.00 2.69 2.73 0.00 0.00 6.88 7.71 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 0.00 128 V 7.17 4.34 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.92 0.00 0.00 129 G 7.46 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 0.00 130 L 8.22 4.74 0.00 1.61 1.56 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.59 4.41 0.00 3.97 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 0.00 132 T 7.48 4.24 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 0.00 133 I 8.19 3.64 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.67 0.91 0.00 0.00 134 A 8.03 4.07 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 0.00 135 G 8.16 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 R 7.96 4.27 0.00 1.85 1.97 0.00 3.29 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.76 0.00 137 L 8.19 4.08 0.00 1.78 1.71 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 138 L 7.94 4.54 0.00 1.70 1.68 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 139 G 7.56 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 0.00 140 S 8.13 4.83 0.00 4.02 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 0.00 141 V 8.23 3.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.93 0.00 0.00 142 P 0.00 4.22 0.00 2.30 2.31 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 143 A 7.73 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 N 8.01 4.23 0.00 3.07 2.92 0.00 0.00 6.74 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 0.00 145 V 8.36 3.52 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 0.90 0.00 0.00 0.96 0.00 0.00 146 S 8.06 4.35 0.00 4.01 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 0.00 147 R 7.81 3.93 0.00 2.05 2.03 0.00 3.15 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 148 R 8.53 3.93 0.00 1.82 1.98 0.00 3.20 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 149 A 8.23 4.39 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 0.00 150 K 7.49 3.81 0.00 1.84 1.83 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.35 7.81 151 V 7.40 4.55 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.94 0.00 0.00 152 D 8.35 4.72 0.00 2.67 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 0.00 153 V 8.11 4.42 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 0.81 0.00 0.00 0.93 0.00 0.00 154 L 8.48 4.69 0.00 1.61 1.53 0.97 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.39 4.37 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 0.92 0.00 0.00 156 V 8.23 4.32 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 0.84 0.00 0.00 0.99 0.00 0.00 157 H 8.79 4.59 0.00 3.32 3.28 0.00 5.55 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 T 8.25 4.42 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 0.00 159 T 8.57 3.82 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 * Residues marked with a * may have inaccurate shift predictions.