NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.9074 8.2827 119.7218 52.8585 40.0421 172.4057 4 E 4.8288 8.8019 120.8998 54.0085 32.1225 173.3973 5 L 4.8119 8.7830 126.5850 51.9041 45.3670 174.3710 6 P 4.3867 0.0000 0.0000 62.0666 32.1843 175.9392 7 P 4.1483 0.0000 0.0000 65.5331 31.0532 178.2713 8 E 4.2097 8.0857 116.9916 58.3538 29.6193 177.5195 9 N 4.6254 8.3293 116.2250 53.6078 38.7034 176.3707 10 A 3.9644 8.0855 124.4180 55.5481 18.4251 179.3043 11 Y 4.1246 8.3346 115.4873 60.4066 37.6828 178.5791 12 R 3.7756 7.4040 118.3905 57.6295 30.1223 177.7779 13 I 4.3685 7.5740 118.8000 62.5234 38.7513 176.9375 14 L 4.5967 7.6456 117.7653 55.3909 42.5815 178.1512 15 E 4.0091 8.1681 119.6262 59.1391 29.6015 177.7987 16 S 4.3154 8.0966 110.6896 58.5956 63.4534 173.6420 17 G 3.8445 8.1421 109.3915 46.1027 0.0000 172.5518 18 P 4.4176 0.0000 0.0000 61.8896 32.1932 175.7768 19 I 4.0854 8.3494 121.3203 61.6705 38.1737 175.3930 20 V 4.6766 8.3914 119.8281 59.6511 36.3503 174.1570 21 L 4.5977 8.8635 122.5414 53.4498 44.2517 175.9180 22 V 4.6845 8.2148 122.2694 61.3315 33.7763 173.9694 23 S 5.3278 9.2164 124.4676 57.4068 64.0298 172.9918 24 T 5.0919 8.8548 116.1352 59.9254 72.7896 172.6101 25 R 4.9640 8.3192 121.3454 54.4500 32.8463 175.1213 26 G 3.7729 8.9954 115.2743 44.8514 0.0000 173.9954 27 A 3.9492 8.5062 122.5035 54.9591 18.2601 178.4848 28 D 4.4731 8.0321 112.8107 53.8978 39.8581 177.3827 29 G 3.9246 8.4023 109.1509 45.3580 0.0000 173.5213 30 R 4.4706 8.3971 119.9666 55.1482 31.4291 176.1893 31 A 4.9129 8.5844 125.4778 52.1370 19.7980 175.5157 32 N 5.1711 9.1785 117.2251 52.8081 43.4409 172.6587 33 L 5.7693 7.9930 120.3137 52.2514 46.2800 175.3655 *35 T 4.4105 7.7538 115.4263 63.8999 69.3037 174.3963 *37 G 4.0582 8.3558 109.3032 45.4600 0.0000 173.5418 38 F 4.8128 8.0853 119.6571 56.3051 37.7978 174.1272 39 H 5.7800 7.8388 118.0384 54.8363 31.3981 173.4297 *43 Q 4.0153 8.2993 120.2505 56.3225 29.6609 175.6670 44 H 4.0541 8.6824 122.0847 58.3099 29.1072 175.3082 45 E 4.8124 7.7781 117.1470 53.5925 32.7045 173.8107 46 P 4.3189 0.0000 0.0000 62.0218 32.1528 174.3666 47 P 4.9281 0.0000 0.0000 61.9365 32.0117 174.5916 48 L 5.3514 8.4387 124.9988 52.7457 44.3954 176.4712 49 V 4.4400 8.9853 122.6375 61.0511 35.0952 174.2187 50 G 4.5789 8.7586 114.0433 44.7481 0.0000 172.1619 51 A 5.2397 8.9624 125.5082 50.1834 22.6553 174.7769 52 I 5.0653 8.7547 123.9922 60.2462 38.4311 175.8453 53 I 4.4464 9.1245 128.3312 59.8819 40.5234 175.3444 54 G 2.8170 7.4236 115.4830 42.1453 0.0000 171.5979 55 P 4.0414 0.0000 0.0000 63.6241 31.3961 177.4474 56 W 4.3700 7.5113 115.6978 58.1496 28.7475 175.4849 57 D 4.8836 7.4551 120.8666 52.7230 41.9381 176.5162 58 Y 4.2157 8.8889 124.6902 61.2544 38.6873 178.5970 59 S 4.0222 8.1890 115.1282 61.5324 62.7479 175.8749 60 H 3.8698 7.9761 121.1794 58.9093 29.3416 177.0903 61 Q 3.7747 7.8272 121.2684 59.0778 28.9262 178.0000 62 A 3.8256 7.5142 121.2910 54.8632 18.4448 179.1116 63 L 3.5434 7.5977 118.7601 58.1837 41.8208 179.3091 64 S 4.1495 7.5119 113.7948 61.8957 62.9152 176.3943 65 E 4.1327 8.2445 120.1995 58.7682 29.3440 178.4906 66 T 4.3989 8.2207 108.4116 60.6315 70.1958 175.4877 67 G 3.9392 8.0824 108.9960 46.0510 0.0000 172.3820 68 E 5.2675 7.5407 116.5647 54.7360 33.6033 174.4427 69 C 4.7750 8.5727 115.7699 57.7795 33.9672 172.4250 70 V 4.7536 8.6236 119.0250 61.0627 34.1858 174.2239 71 L 4.9161 8.9773 128.3497 53.8964 42.8507 175.4078 72 A 5.0205 9.0627 127.7228 50.2279 20.8048 175.4798 73 V 4.5766 9.0368 124.5177 60.9605 32.8403 173.9213 74 P 4.7443 0.0000 0.0000 62.3852 33.2365 174.6503 75 T 4.7385 8.0690 109.5066 59.0523 71.7712 175.1699 76 V 3.5227 8.3404 120.8166 64.7192 31.1705 178.2908 77 D 4.3716 8.0084 118.5697 55.4308 39.4711 177.2159 78 L 4.4240 8.0294 119.1577 54.4179 41.6610 177.7639 79 A 3.6236 7.6773 123.8526 55.3538 18.1516 180.0146 80 E 3.8238 7.9957 117.0523 59.6168 29.6821 178.8954 81 T 3.6204 7.7574 115.3581 66.4764 68.2982 176.5519 82 V 3.3608 7.6089 119.3027 65.8780 31.9720 177.9426 83 V 3.7649 7.7475 117.9954 66.1931 31.4206 177.7429 84 D 4.4178 8.3605 119.0169 57.4359 40.4183 178.7537 85 I 3.6753 7.4374 119.8451 63.9512 37.0886 177.7351 86 G 4.0231 7.5360 103.3578 45.0833 0.0000 173.5396 87 N 5.1252 7.9612 116.2200 52.4488 40.2496 173.5148 88 C 4.8616 7.8871 111.7310 56.7424 31.6105 172.8358 89 S 4.8008 8.4043 114.2317 56.4882 64.3024 174.6899 90 G 4.2385 8.9483 113.7483 45.0670 0.0000 174.1992 91 D 3.3700 7.4547 119.6850 55.3996 39.2451 177.4294 92 A 4.5905 7.5478 118.1414 51.1276 20.5161 174.7210 93 L 4.6011 7.3095 117.5355 53.6107 45.0754 175.5352 94 D 4.9035 8.4355 124.6393 53.2184 41.0671 177.0051 95 K 4.2103 8.5220 127.4955 59.1934 32.3212 178.9326 96 F 4.1471 8.5741 117.8782 60.5952 38.7576 177.8647 97 G 3.6057 8.6431 105.0304 48.1222 0.0000 175.1714 98 H 3.9447 8.3132 120.2836 58.5051 29.9523 176.4570 99 F 4.6131 8.1265 116.0831 56.4317 39.1377 175.8685 100 G 3.9202 7.6898 106.4386 46.6739 0.0000 173.7185 101 L 4.9216 8.0019 118.3790 53.2641 44.0326 176.5352 102 T 4.7519 9.2120 119.3106 61.1924 70.6257 172.0523 103 P 4.7651 0.0000 0.0000 62.4236 32.4420 175.8450 104 V 4.4181 8.4449 122.4584 60.0877 34.8030 172.9177 105 P 4.5278 0.0000 0.0000 62.7956 31.7224 176.2437 106 A 4.3706 8.4220 126.6714 51.3421 20.0317 177.0137 107 Q 4.2457 9.6640 121.2634 58.0147 29.3545 176.7787 108 T 4.5912 8.6927 105.0423 61.2313 70.1705 173.9201 109 V 4.7322 7.3904 113.8377 59.9982 35.5664 174.9060 110 D 4.5382 9.1644 120.6530 55.1244 41.3152 177.5057 111 A 4.1421 7.7338 122.8478 51.2827 19.0005 175.2759 112 P 4.7173 0.0000 0.0000 62.2184 32.7515 176.2102 113 L 4.3941 8.7489 121.4922 54.9531 43.4203 176.2872 114 V 4.7226 8.9500 122.0727 61.3474 32.3599 176.4704 115 R 3.9215 8.9650 129.9933 59.6286 30.0134 177.5042 116 Q 4.2667 8.0135 113.7171 57.0239 29.2035 175.4790 117 C 4.5771 7.7973 116.9189 58.2683 29.4407 173.4065 118 W 4.5349 8.8064 133.7555 59.9221 31.5236 175.5291 119 A 4.9520 8.1228 119.6907 49.9229 22.2420 174.7222 120 N 5.3686 9.0945 117.5231 51.5050 42.7597 173.4603 121 L 5.0295 9.0118 124.5100 52.7809 44.3430 175.7382 122 E 4.4915 9.0180 125.2032 56.4151 30.7410 176.1342 123 C 5.4304 9.2577 121.4340 58.0189 32.6894 173.1787 124 R 5.0923 8.4391 120.3927 54.0984 33.2774 175.4026 125 V 4.1269 8.6984 123.8886 63.5219 31.2384 175.8946 126 V 4.2747 8.9073 121.9626 62.1197 33.7229 175.9546 127 D 4.5779 7.9991 120.2310 52.6776 44.1807 174.9261 128 D 4.5210 8.7379 125.1052 52.9573 39.8630 178.4890 129 G 3.6808 8.4926 111.6091 48.3155 0.0000 175.0339 130 W 4.8601 7.9561 117.2972 56.3439 30.0615 177.4570 131 A 3.5979 7.7572 124.0319 54.7329 17.8523 181.1207 132 R 3.8277 7.8081 113.2387 59.4264 30.4726 178.1990 133 R 3.6488 7.9442 116.2788 59.0461 28.8522 176.5255 134 Y 4.8057 7.6962 111.3917 56.6333 39.9577 175.6357 135 N 4.4654 8.3462 116.5878 54.0509 36.5688 172.7029 136 L 5.1969 7.2608 120.5795 53.6742 44.0531 175.0527 137 W 4.9736 9.4431 126.3328 54.8656 32.3935 174.6249 138 V 4.5974 8.6239 125.1179 61.8725 32.4023 174.4926 139 L 5.2950 9.1387 128.4834 52.9594 44.9013 174.9252 140 E 5.0606 8.8769 123.7910 54.2317 32.0016 175.0653 141 V 4.0991 8.4210 127.8278 63.4303 31.5385 175.4720 142 Q 4.4113 9.4241 127.5397 57.8811 29.9838 176.3824 143 R 4.4636 7.4994 115.2743 54.7320 35.2129 174.3033 144 I 4.7091 7.4376 121.4065 59.2317 41.0941 174.1728 145 W 5.2679 8.9395 126.8898 54.8335 32.0620 174.5739 146 I 4.3243 8.7553 125.5491 59.4425 39.5500 176.1035 147 D 4.6128 8.7429 127.7907 53.2914 39.5020 176.5972 148 T 4.1238 8.1328 114.2661 63.3699 69.3776 176.0906 149 A 4.2823 7.6299 122.3791 52.8521 19.0196 177.6100 150 R 4.1252 7.7487 117.1050 56.1080 30.8093 176.7024 151 K 4.0609 8.8055 125.0145 59.0971 32.4412 176.9561 152 E 4.3615 8.0061 119.2738 55.2322 30.1055 175.2965 153 T 4.1940 8.1318 114.0122 60.8287 69.9957 173.7350 154 R 3.9900 8.2155 122.9824 56.4101 31.1723 176.3566 155 L 4.7382 8.3579 123.6006 54.1102 43.7341 175.5569 156 I 5.2705 8.1023 113.0469 59.5999 41.6195 173.7582 157 H 5.2568 9.2224 119.8157 54.2769 32.5098 172.2365 158 H 4.3151 9.1593 123.4274 55.8951 30.2060 174.7519 159 Q 4.2534 8.8588 124.3839 55.4039 29.2619 176.6108 160 G 3.6450 6.7238 105.0355 46.8743 0.0000 173.4869 161 D 4.2082 9.2850 118.4600 55.1271 38.2428 175.0560 162 G 3.9812 8.6209 104.9987 45.5393 0.0000 173.9327 163 R 4.5249 7.6645 119.3707 55.1300 31.6713 175.6195 164 F 5.4494 8.7094 121.2885 55.6787 42.8694 174.4531 165 S 4.6351 9.0569 118.1155 57.6863 64.8292 173.0007 166 V 4.7175 8.2065 122.7397 61.0422 32.8960 175.0453 167 D 4.4405 8.7849 128.3248 54.7613 41.4017 174.5172 168 G 3.9142 8.7013 108.7842 45.4624 0.0000 176.7376 169 D 4.4917 9.0958 119.5980 54.3128 41.4987 175.2121 170 T 4.4569 8.2102 118.7100 61.7761 70.1386 174.1129 171 L 4.4600 8.3664 126.9867 53.2994 43.9041 175.2522 172 D 4.7527 8.7010 126.7935 53.0839 41.0934 175.3742 173 L 4.9359 8.1807 128.1252 54.2095 42.4568 179.3501 174 G 3.7464 8.4377 111.3341 48.6527 0.0000 175.8060 175 E 4.0729 8.1955 116.5049 58.4488 29.6966 177.6932 176 R 4.2578 7.7473 120.4251 54.8504 28.5981 175.6338 *178 T 4.3041 7.8729 111.3629 60.9435 70.8244 175.7807 179 K 3.8715 7.8267 120.6679 56.7314 32.4538 176.3524 180 W 5.1667 7.4647 117.6141 56.8175 30.2581 175.3758 181 R 4.1668 8.2579 122.7725 56.6897 29.4650 176.7967 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 3 N 8.28 4.91 0.00 2.43 2.77 0.00 0.00 6.19 6.77 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 4 E 8.80 4.83 0.00 2.14 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.48 0.00 5 L 8.78 4.81 0.00 1.34 1.39 0.79 0.86 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 6 P 0.00 4.39 0.00 2.04 1.97 0.00 3.54 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 2.08 2.04 0.00 7 P 0.00 4.15 0.00 2.29 2.21 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 8 E 8.09 4.21 0.00 1.98 2.25 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 2.33 2.48 0.00 9 N 8.33 4.63 0.00 2.86 2.73 0.00 0.00 6.71 8.32 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 10 A 8.09 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.33 4.12 0.00 3.14 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 12 R 7.40 3.78 0.00 1.65 1.84 0.00 2.88 0.00 0.00 3.05 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 13 I 7.57 4.37 1.95 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 1.45 0.71 1.01 0.00 0.00 14 L 7.65 4.60 0.00 1.72 1.76 0.93 0.85 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 15 E 8.17 4.01 0.00 2.08 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 2.36 2.28 0.00 16 S 8.10 4.32 0.00 4.10 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 17 G 8.14 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 18 P 0.00 4.42 0.00 2.23 2.06 0.00 4.04 0.00 0.00 3.66 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 19 I 8.35 4.09 2.16 0.00 0.00 1.00 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 0.80 0.97 0.00 0.00 20 V 8.39 4.68 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 0.90 0.00 0.00 21 L 8.86 4.60 0.00 1.61 1.49 0.80 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.21 4.68 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 0.91 0.00 0.00 0.93 0.00 0.00 23 S 9.22 5.33 0.00 4.02 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 24 T 8.85 5.09 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 1.11 0.00 0.00 25 R 8.32 4.96 0.00 1.76 1.77 0.00 3.21 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 26 G 9.00 3.77 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 0.00 0.00 0.00 27 A 8.51 3.95 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 28 D 8.03 4.47 0.00 2.82 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 29 G 8.40 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 30 R 8.40 4.47 0.00 1.96 1.93 0.00 3.16 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 31 A 8.58 4.91 1.16 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 0.00 0.00 32 N 9.18 5.17 0.00 2.99 2.73 0.00 0.00 7.18 6.21 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 33 L 7.99 5.77 0.00 1.34 1.37 0.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 *35 T 7.75 4.41 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 1.24 0.00 0.00 *37 G 8.36 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 38 F 8.09 4.81 0.00 3.17 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 39 H 7.84 5.78 0.00 3.36 3.36 0.00 5.36 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *43 Q 8.30 4.02 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 44 H 8.68 4.05 0.00 3.13 3.09 0.00 5.81 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 45 E 7.78 4.81 0.00 1.88 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 2.22 2.26 0.00 46 P 0.00 4.32 0.00 2.27 2.05 0.00 3.75 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 1.98 1.95 0.00 47 P 0.00 4.93 0.00 2.15 2.43 0.00 3.80 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 2.18 1.83 0.00 48 L 8.44 5.35 0.00 1.53 1.59 0.90 0.98 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 49 V 8.99 4.44 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 1.04 0.00 0.00 0.95 0.00 0.00 50 G 8.76 4.58 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 0.00 0.00 0.00 51 A 8.96 5.24 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 52 I 8.75 5.07 2.23 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.30 1.27 0.00 0.00 53 I 9.12 4.45 1.74 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.66 0.75 0.00 0.00 54 G 7.42 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 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 W 7.96 4.86 0.00 3.38 3.24 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 0.00 131 A 7.76 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.81 3.83 0.00 1.99 1.93 0.00 3.34 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.19 0.00 133 R 7.94 3.65 0.00 1.34 1.55 0.00 2.21 0.00 0.00 2.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.80 0.00 134 Y 7.70 4.81 0.00 3.12 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 0.00 135 N 8.35 4.47 0.00 3.12 3.14 0.00 0.00 6.53 6.26 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 0.00 136 L 7.26 5.20 0.00 2.11 1.88 1.11 1.27 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 0.00 137 W 9.44 4.97 0.00 3.32 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 0.00 138 V 8.62 4.60 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 1.05 0.00 0.00 0.92 0.00 0.00 139 L 9.14 5.29 0.00 1.62 1.55 0.95 0.54 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 0.00 140 E 8.88 5.06 0.00 2.02 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.42 0.00 141 V 8.42 4.10 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 0.78 0.00 0.00 0.93 0.00 0.00 142 Q 9.42 4.41 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.39 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 143 R 7.50 4.46 0.00 1.53 1.04 0.00 3.16 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 144 I 7.44 4.71 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.63 0.68 0.00 0.00 145 W 8.94 5.27 0.00 3.17 2.96 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 0.00 146 I 8.76 4.32 1.70 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.61 0.43 0.00 0.00 147 D 8.74 4.61 0.00 2.67 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 0.00 148 T 8.13 4.12 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 1.28 0.00 0.00 149 A 7.63 4.28 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 0.00 150 R 7.75 4.13 0.00 2.25 2.05 0.00 3.49 0.00 0.00 3.54 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 151 K 8.81 4.06 0.00 1.80 1.85 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.38 7.81 152 E 8.01 4.36 0.00 1.88 1.83 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 2.31 2.28 0.00 153 T 8.13 4.19 3.47 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 154 R 8.22 3.99 0.00 1.81 1.82 0.00 3.19 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 155 L 8.36 4.74 0.00 1.70 1.49 0.93 0.68 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 0.00 156 I 8.10 5.27 1.95 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 1.27 0.96 0.87 0.00 0.00 157 H 9.22 5.26 0.00 3.10 3.26 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 H 9.16 4.32 0.00 3.10 3.20 0.00 5.73 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 0.00 159 Q 8.86 4.25 0.00 1.89 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.11 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 160 G 6.72 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 0.00 0.00 0.00 161 D 9.28 4.21 0.00 2.79 2.75 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 0.00 162 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 0.00 163 R 7.66 4.52 0.00 1.79 1.81 0.00 3.05 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 164 F 8.71 5.45 0.00 2.86 2.97 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 0.00 165 S 9.06 4.64 0.00 3.94 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 8.21 4.72 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 0.81 0.00 0.00 0.96 0.00 0.00 167 D 8.78 4.44 0.00 2.59 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 G 8.70 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 0.00 169 D 9.10 4.49 0.00 2.67 2.61 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 0.00 170 T 8.21 4.46 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 1.21 0.00 0.00 171 L 8.37 4.46 0.00 1.53 1.53 0.93 1.18 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 0.00 172 D 8.70 4.75 0.00 2.67 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 L 8.18 4.94 0.00 1.75 1.64 0.94 0.89 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 0.00 174 G 8.44 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 0.00 175 E 8.20 4.07 0.00 2.10 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 0.00 2.30 2.30 0.00 176 R 7.75 4.26 0.00 1.94 1.97 0.00 3.21 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 *178 T 7.87 4.30 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 1.21 0.00 0.00 179 K 7.83 3.87 0.00 1.38 1.17 0.00 1.47 0.00 0.00 1.52 0.00 0.00 2.76 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.70 7.81 180 W 7.46 5.17 0.00 3.32 3.09 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 0.00 0.00 0.00 0.00 181 R 8.26 4.17 0.00 1.80 1.87 0.00 3.44 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 * Residues marked with a * may have inaccurate shift predictions.