NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2475 8.1744 110.9426 61.1917 70.2263 173.0373 8 D 4.2872 8.5128 125.5744 51.5039 41.3601 174.4585 9 P 4.4193 0.0000 0.0000 65.3990 32.5037 177.0703 10 R 4.1505 8.7859 116.8232 57.1505 30.4520 176.7473 11 A 4.2371 7.6133 120.5562 51.0222 19.0128 177.1784 12 K 3.9341 8.5471 120.9080 56.3229 32.6159 176.6072 13 W 4.2404 8.9108 135.0000 57.3506 31.1958 175.1342 14 V 4.0995 7.6328 125.1657 60.0445 32.3164 173.2410 15 P 4.0202 0.0000 0.0000 62.2184 32.1786 175.3922 16 Q 4.6750 8.5548 117.0734 54.6790 31.8563 174.1987 17 D 5.4859 8.5139 115.7428 54.2363 41.5190 175.3838 18 N 5.0008 9.5153 113.4815 52.0446 38.7894 174.0867 19 D 4.3724 8.0923 119.7473 53.2675 42.7116 175.2416 20 I 3.0133 7.9733 120.6664 62.4066 37.9283 176.5761 21 Q 4.2769 8.3981 119.2726 55.9241 29.2572 175.1769 22 A 4.7933 7.4607 121.6626 50.5024 20.6885 177.8229 23 C 4.7067 8.9150 118.3455 59.0816 41.6232 174.2842 24 D 5.0042 8.1259 118.8475 52.9308 39.5429 175.2983 25 Y 4.7530 8.1383 122.3249 57.4449 39.6530 176.6495 26 W 4.5568 8.7188 124.9339 59.9527 28.0231 178.2540 27 R 3.4421 5.8400 115.1924 57.7388 29.9096 176.3135 28 H 5.1780 8.3566 116.0204 55.8215 28.9462 174.7309 29 C 3.1546 7.8954 116.2441 57.6725 41.4090 174.2047 30 S 4.8906 7.6797 115.1202 56.7906 62.5597 173.6908 31 I 3.4580 7.3801 117.8897 60.1040 39.1198 174.2458 32 D 4.7383 8.8474 126.7636 54.6426 44.3224 172.2625 33 G 4.1305 7.8868 117.5446 44.2849 0.0000 175.6006 34 N 5.3968 9.0948 122.0952 50.9492 42.5862 173.4168 35 I 4.2729 8.2231 122.7887 60.9486 37.6085 176.6323 36 C 4.2122 8.6358 124.2782 59.9592 34.9597 175.8316 37 D 4.1820 8.0914 118.3587 56.8179 40.8943 177.6534 38 C 4.7917 8.0834 114.8567 57.3588 40.3489 173.7626 39 S 4.6196 8.3080 114.0126 58.2494 63.1435 175.0619 40 G 4.0304 8.8025 108.7120 45.9985 0.0000 175.2443 41 G 4.0793 7.5185 110.6997 44.8337 0.0000 171.2903 42 S 4.9887 8.1465 115.0207 56.1820 66.3076 173.2346 43 L 4.0377 8.6860 120.7801 58.0829 41.6645 178.5199 44 T 4.7131 7.8086 104.1357 60.9805 69.6425 172.9307 45 N 5.0717 7.9218 118.9150 51.7197 41.9460 173.3065 46 C 4.7489 8.4057 117.9820 55.7146 36.3683 172.2075 47 P 4.6517 0.0000 0.0000 61.4292 31.7074 174.4378 48 P 4.2294 0.0000 0.0000 64.2129 31.6614 177.0467 49 G 4.0354 8.8670 110.3778 45.4352 0.0000 173.6160 50 T 4.3444 6.7663 109.1829 60.7047 70.8173 174.2188 51 K 4.5865 8.8535 121.3324 54.4086 35.0083 175.4446 52 L 4.5195 8.4208 126.8246 54.2515 43.1127 175.9524 53 A 4.6357 8.5459 128.6213 52.4365 18.9760 176.7970 54 T 4.4212 8.8658 109.0267 62.4133 71.1779 174.8571 55 A 4.9091 7.9575 123.4338 51.1091 21.5722 176.5144 56 S 3.5397 7.1960 118.5139 58.0583 67.7159 177.4100 *58 V 4.4533 8.6220 113.5736 61.6777 32.6338 172.9976 59 A 4.7710 8.2198 120.1752 51.3085 22.5259 175.4860 60 S 5.0520 8.7962 115.9977 57.6191 63.2398 173.8490 61 C 5.2801 9.4643 125.9546 55.3578 42.8061 172.6789 62 Y 4.6574 9.0419 124.9577 57.3858 39.5915 173.9629 63 N 3.5211 8.4711 126.8278 50.7977 39.2380 173.8722 64 P 3.9697 0.0000 0.0000 65.4695 31.8779 178.2331 65 T 3.8522 7.8862 116.2652 66.2488 68.2608 175.0923 66 D 4.5783 7.5936 116.3902 52.2234 40.0196 176.5699 67 G 3.7590 7.7043 107.2400 46.4503 0.0000 173.4912 68 Q 4.5804 8.0950 118.5717 54.0979 31.8275 174.5474 69 S 5.3163 8.1873 116.6707 57.2303 65.4501 172.9091 70 Y 5.1302 9.2825 122.0481 56.0031 41.6727 174.4881 71 L 4.8852 9.3522 125.0502 54.5948 43.6671 175.2733 72 I 4.6488 8.8812 127.7161 59.5531 39.5083 174.6590 73 A 4.3185 8.1054 129.3314 50.5265 19.5073 176.9825 74 Y 4.6957 8.0572 121.3566 57.5631 36.3537 174.8317 75 R 4.3911 7.9509 121.2417 55.7639 32.3490 175.6984 76 D 5.2099 8.7664 123.2700 53.7685 43.5715 174.5657 77 C 5.1866 8.9236 118.9499 55.8189 38.3456 172.5740 78 C 5.7868 8.9439 120.6394 54.3415 44.3643 174.8382 79 G 4.0833 9.2133 105.2475 46.0430 0.0000 172.8607 80 Y 4.7322 7.4052 114.5589 55.6433 42.0000 174.5795 81 N 4.6145 8.4877 120.2723 52.8029 39.8251 175.1569 82 V 4.0075 8.6392 121.6839 61.2516 31.7560 176.3997 83 S 4.1419 8.3660 118.6548 60.2374 62.7702 175.9205 84 G 3.9764 7.7983 107.2987 44.9824 0.0000 172.9961 85 R 4.5375 7.7142 118.0236 55.5556 33.3454 175.2671 86 C 4.3045 8.7001 117.3268 57.5643 37.6039 171.1349 87 P 5.1047 0.0000 0.0000 63.2469 32.5614 178.2340 88 C 4.9848 9.2000 118.4753 55.9599 45.4648 173.4226 89 L 4.7965 8.3444 123.7032 54.4177 43.5552 174.3718 90 N 5.0719 9.0216 124.1154 50.9057 42.8677 174.7260 91 T 4.7012 7.5218 109.5059 60.9565 68.9942 173.9899 92 E 3.8749 8.2344 122.7125 58.6527 29.5315 177.8819 93 G 3.7498 8.8170 111.8314 45.4140 0.0000 172.2513 94 E 4.2945 7.8349 121.5258 56.1255 29.8951 176.3321 95 L 4.7225 8.1022 126.6438 52.1574 44.6751 174.2597 96 P 4.5076 0.0000 0.0000 62.2595 32.0995 178.1101 97 V 3.6608 8.5027 120.4419 64.9018 31.1326 176.7410 98 Y 4.4819 7.8030 115.9379 57.7783 38.8427 175.6252 99 R 4.7178 7.7234 119.2417 53.8172 30.8220 174.1250 100 P 4.4713 0.0000 0.0000 65.8517 31.7310 179.0172 101 E 3.7192 8.2003 115.6190 58.3663 29.3004 177.4848 102 F 5.1212 8.3553 115.9485 56.8659 39.9872 173.8487 103 A 4.9586 8.1874 124.9889 51.2381 19.5516 177.5508 104 N 5.0900 9.2896 119.7492 52.8085 37.5905 175.4614 105 D 4.7393 7.8451 118.1758 55.1937 41.5933 177.0575 106 I 3.4676 7.2419 120.0358 60.8118 37.4673 175.9079 107 I 3.8407 7.6554 125.5910 60.5840 36.7688 176.8874 108 W 4.7796 8.7252 130.6096 55.7627 27.5578 176.7096 109 C 4.9279 7.3212 114.6667 56.1685 41.2732 174.4321 110 F 4.5540 7.5997 119.9307 59.3862 38.8949 176.2516 111 G 4.5825 9.4142 112.4934 46.4305 0.0000 173.7231 112 A 4.6261 7.7146 122.4843 51.1158 19.2748 176.8226 113 E 4.0712 8.6059 121.4279 57.5934 30.2617 176.7235 114 D 4.5391 9.1254 121.5786 54.8717 38.3600 173.3550 115 D 4.4047 7.8464 114.2875 54.8703 39.0427 173.9597 116 A 4.1063 7.7452 121.1491 53.0129 18.5779 178.3290 117 M 4.6819 8.4710 120.2056 54.6595 34.4052 175.7195 118 T 4.3238 7.6315 110.1423 61.3923 70.9406 172.8898 119 Y 4.4928 8.5497 124.9381 57.5221 40.1293 173.7297 120 H 4.7946 7.9131 124.9318 57.0731 32.3478 171.1731 121 C 4.9799 6.6667 109.6363 55.0770 39.5313 171.7628 122 T 5.3677 9.0756 115.4014 61.8145 72.1589 173.9204 123 I 4.5511 8.4258 118.3680 58.9923 40.5433 175.2992 124 S 4.7446 8.2633 117.3300 56.5708 63.0856 172.7178 125 P 4.4548 0.0000 0.0000 62.0683 32.8324 176.1567 126 I 4.4940 8.0079 121.2571 60.9894 37.8661 176.2885 127 V 4.2409 9.5543 117.4608 60.2205 32.7342 175.7246 128 G 4.1803 7.3716 109.6749 44.9697 0.0000 171.3421 129 K 4.4013 8.0947 118.6552 55.9121 32.7253 177.7148 130 A 4.9318 8.4484 126.1971 51.6866 22.0681 176.9000 131 S 4.4059 8.6509 110.3877 59.2811 62.9380 174.6964 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 7 T 8.17 4.25 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 1.22 0.00 0.00 8 D 8.51 4.29 0.00 2.83 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.42 0.00 2.24 2.20 0.00 3.83 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 2.01 2.01 0.00 10 R 8.79 4.15 0.00 1.99 2.04 0.00 3.17 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 11 A 7.61 4.24 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 12 K 8.55 3.93 0.00 1.76 1.79 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.51 7.81 13 W 8.91 4.24 0.00 3.29 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.63 4.10 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 0.83 0.00 0.00 0.95 0.00 0.00 15 P 0.00 4.02 0.00 2.22 1.75 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.17 0.00 16 Q 8.55 4.67 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.99 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 17 D 8.51 5.49 0.00 2.58 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 18 N 9.52 5.00 0.00 2.77 2.89 0.00 0.00 6.51 8.09 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 19 D 8.09 4.37 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.97 3.01 1.34 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.54 0.11 0.00 0.00 21 Q 8.40 4.28 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 22 A 7.46 4.79 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 23 C 8.92 4.71 0.00 3.14 3.35 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 24 D 8.13 5.00 0.00 2.61 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 25 Y 8.14 4.75 0.00 3.31 2.89 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 26 W 8.72 4.56 0.00 3.72 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 27 R 5.84 3.44 0.00 1.39 1.55 0.00 2.99 0.00 0.00 2.82 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 28 H 8.36 5.18 0.00 3.55 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 7.90 3.15 0.00 2.76 3.58 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 30 S 7.68 4.89 0.00 3.79 3.58 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 31 I 7.38 3.46 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 1.09 1.22 0.90 0.00 0.00 32 D 8.85 4.74 0.00 2.79 2.39 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 33 G 7.89 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 0.00 0.00 0.00 0.00 34 N 9.09 5.40 0.00 2.70 2.83 0.00 0.00 7.38 7.51 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 35 I 8.22 4.27 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.88 0.93 0.00 0.00 36 C 8.64 4.21 0.00 2.92 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 37 D 8.09 4.18 0.00 2.71 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 38 C 8.08 4.79 0.00 3.11 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 39 S 8.31 4.62 0.00 3.98 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 40 G 8.80 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 7.52 4.08 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 0.00 42 S 8.15 4.99 0.00 3.90 3.80 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 43 L 8.69 4.04 0.00 1.66 1.67 0.91 0.59 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 44 T 7.81 4.71 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 45 N 7.92 5.07 0.00 2.75 2.67 0.00 0.00 7.01 7.41 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 46 C 8.41 4.75 0.00 2.90 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 47 P 0.00 4.65 0.00 1.94 2.07 0.00 3.46 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 2.11 0.00 48 P 0.00 4.23 0.00 2.00 1.96 0.00 3.62 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 2.00 2.05 0.00 49 G 8.87 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 6.77 4.34 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 0.32 0.00 0.00 51 K 8.85 4.59 0.00 1.61 1.73 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.65 7.81 52 L 8.42 4.52 0.00 1.75 1.53 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.55 4.64 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.87 4.42 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 1.30 0.00 0.00 55 A 7.96 4.91 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.20 3.54 0.00 3.97 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 *58 V 8.62 4.45 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 0.91 0.00 0.00 0.98 0.00 0.00 59 A 8.22 4.77 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.80 5.05 0.00 3.96 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 61 C 9.46 5.28 0.00 3.28 3.55 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 62 Y 9.04 4.66 0.00 3.01 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.47 3.52 0.00 1.44 2.28 0.00 0.00 6.55 7.75 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 64 P 0.00 3.97 0.00 2.12 2.13 0.00 3.10 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.88 0.00 65 T 7.89 3.85 4.14 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 1.12 0.00 0.00 66 D 7.59 4.58 0.00 2.69 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 67 G 7.70 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 0.00 0.00 0.00 68 Q 8.10 4.58 0.00 1.85 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.34 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 69 S 8.19 5.32 0.00 3.76 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 70 Y 9.28 5.13 0.00 3.28 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 71 L 9.35 4.89 0.00 1.80 1.60 1.08 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.88 4.65 1.43 0.00 0.00 0.62 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 1.08 0.15 0.00 0.00 73 A 8.11 4.32 1.12 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 74 Y 8.06 4.70 0.00 2.96 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 75 R 7.95 4.39 0.00 1.79 1.88 0.00 3.08 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 76 D 8.77 5.21 0.00 2.81 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 77 C 8.92 5.19 0.00 2.71 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 78 C 8.94 5.79 0.00 2.78 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 79 G 9.21 4.08 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 0.00 80 Y 7.41 4.73 0.00 2.63 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 81 N 8.49 4.61 0.00 2.64 2.74 0.00 0.00 7.01 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 82 V 8.64 4.01 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 1.01 0.00 0.00 1.11 0.00 0.00 83 S 8.37 4.14 0.00 3.98 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 84 G 7.80 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 85 R 7.71 4.54 0.00 1.79 1.83 0.00 3.33 0.00 0.00 3.46 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 86 C 8.70 4.30 0.00 3.10 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 87 P 0.00 5.10 0.00 2.08 2.06 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 88 C 9.20 4.98 0.00 2.84 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 89 L 8.34 4.80 0.00 1.52 1.48 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 90 N 9.02 5.07 0.00 2.39 1.99 0.00 0.00 6.19 6.58 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 91 T 7.52 4.70 4.16 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 1.16 0.00 0.00 92 E 8.23 3.87 0.00 1.91 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 1.94 2.25 0.00 93 G 8.82 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 94 E 7.83 4.29 0.00 1.95 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 2.60 2.59 0.00 95 L 8.10 4.72 0.00 1.56 1.47 0.89 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.51 0.00 1.42 2.01 0.00 3.26 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 2.07 2.06 0.00 97 V 8.50 3.66 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 0.95 0.00 0.00 98 Y 7.80 4.48 0.00 3.11 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.72 4.72 0.00 1.81 1.91 0.00 3.40 0.00 0.00 3.34 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.55 0.00 100 P 0.00 4.47 0.00 2.50 2.49 0.00 3.82 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 101 E 8.20 3.72 0.00 1.52 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 1.47 1.47 0.00 102 F 8.36 5.12 0.00 3.10 2.95 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 0.00 103 A 8.19 4.96 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 9.29 5.09 0.00 2.79 2.91 0.00 0.00 7.02 8.79 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 0.00 105 D 7.85 4.74 0.00 2.61 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 0.00 106 I 7.24 3.47 0.92 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.29 -0.32 0.00 0.00 107 I 7.66 3.84 1.63 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.65 0.95 0.00 0.00 108 W 8.73 4.78 0.00 3.60 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 0.00 109 C 7.32 4.93 0.00 2.75 3.18 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 0.00 0.00 0.00 0.00 110 F 7.60 4.55 0.00 3.30 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 0.00 111 G 9.41 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 0.00 112 A 7.71 4.63 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 0.00 113 E 8.61 4.07 0.00 2.02 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 2.39 2.35 0.00 114 D 9.13 4.54 0.00 2.89 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 0.00 115 D 7.85 4.40 0.00 2.87 2.76 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 0.00 116 A 7.75 4.11 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 0.00 117 M 8.47 4.68 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 118 T 7.63 4.32 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 1.22 0.00 0.00 119 Y 8.55 4.49 0.00 3.14 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 0.00 120 H 7.91 4.79 0.00 3.24 3.22 0.00 5.87 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 0.00 121 C 6.67 4.98 0.00 3.12 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 9.08 5.37 4.40 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 1.55 0.00 0.00 123 I 8.43 4.55 1.97 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 1.43 0.91 0.87 0.00 0.00 124 S 8.26 4.74 0.00 3.85 3.74 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 0.00 125 P 0.00 4.45 0.00 2.15 2.11 0.00 3.77 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 2.03 1.91 0.00 126 I 8.01 4.49 1.85 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 1.40 0.43 1.07 0.00 0.00 127 V 9.55 4.24 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 0.63 0.00 0.00 1.00 0.00 0.00 128 G 7.37 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.09 4.40 0.00 1.62 1.65 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.93 1.31 7.81 130 A 8.45 4.93 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.65 4.41 0.00 3.75 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 * Residues marked with a * may have inaccurate shift predictions.