NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *59 H 4.7743 8.3033 117.3748 54.2312 28.7927 173.3928 60 I 3.7388 7.9319 128.1926 61.7460 36.9198 176.3165 61 S 4.3026 8.8715 115.2792 60.6325 63.3338 175.0375 62 L 4.7236 7.5822 119.7976 54.1215 43.2094 176.6578 63 N 5.0078 7.9532 117.3018 49.8466 39.2302 172.8027 64 P 4.2591 0.0000 0.0000 65.6291 31.7565 179.4047 65 D 4.4190 8.0544 117.3570 56.4368 40.8672 176.9441 66 L 4.2212 7.9493 117.5738 55.4277 42.2216 176.6550 67 A 4.3422 7.3257 121.4856 50.6893 19.7824 176.6908 68 N 4.5141 8.5668 119.6576 54.1777 40.1555 175.8929 69 E 3.9314 8.8376 127.1529 61.5482 29.6280 176.1264 70 D 4.5395 7.9428 118.1350 56.9898 41.0781 178.1050 71 E 4.0844 7.8848 119.6408 59.3015 29.6164 178.8606 72 V 2.4951 7.2620 116.9466 65.0576 31.5041 176.1472 73 N 4.6958 7.8558 114.1862 53.1051 38.6791 174.4272 74 S 4.7917 7.6145 114.0478 56.5940 63.8303 174.6252 75 C 4.4886 8.7928 123.7867 59.8030 40.0965 174.4374 76 D 4.4399 8.0001 117.7326 54.8328 41.0750 176.2015 77 Y 4.4012 7.9472 122.4824 57.2195 39.2310 176.9655 78 W 4.2140 8.3793 124.2562 59.3848 28.1610 177.0773 79 R 3.4434 5.8400 112.2986 56.7734 29.2023 175.7546 80 H 5.0872 7.7501 116.2376 56.5839 29.2031 173.7853 81 C 4.6407 8.4014 115.2606 56.5463 43.0014 173.2721 82 A 5.1999 7.4693 121.3304 50.2944 18.8208 176.2960 83 V 3.4683 7.7324 121.0022 63.5971 33.0164 174.4650 84 D 4.9563 9.4144 128.2085 52.3799 41.7585 175.5091 85 G 3.6771 7.5444 112.0371 45.4861 0.0000 168.1671 86 F 5.2503 7.9016 117.9024 55.5621 40.5427 175.3828 87 L 4.5478 8.6955 126.3092 54.8783 41.9320 177.7150 88 C 4.3051 8.8840 122.3010 59.8790 40.3405 176.2389 89 S 4.1711 7.9697 112.2197 60.0798 62.6304 175.3479 90 C 4.6823 8.0546 117.1659 57.1789 40.2593 173.1904 91 C 4.7952 8.3893 116.5174 56.5947 40.3593 174.9856 92 G 3.8404 8.6412 107.3896 45.2321 0.0000 174.2001 93 G 4.3453 7.5608 109.8168 44.1588 0.0000 171.4438 94 T 4.7052 7.8856 109.4995 59.8241 70.8068 174.4233 95 T 3.9733 8.7994 116.1476 65.7500 68.3754 175.7798 96 T 4.5993 7.7367 108.4354 60.8973 69.6000 173.5161 97 T 4.6588 7.7071 111.8601 60.1549 71.6894 172.7771 98 C 4.6960 8.6629 122.0626 55.9337 37.4351 171.9148 99 P 4.5983 0.0000 0.0000 61.9912 31.6072 174.1165 100 P 4.3037 0.0000 0.0000 64.5619 31.5465 177.0514 101 G 3.9148 8.9693 110.0804 45.4381 0.0000 172.8680 102 S 4.9802 7.7023 113.6140 56.6535 65.6492 173.5974 103 T 4.6472 8.5897 118.8422 61.0327 70.6399 172.3485 104 P 4.9056 0.0000 0.0000 62.9087 32.1771 176.0619 105 S 4.7269 8.8222 119.0162 57.3156 63.6252 172.8734 106 P 4.5107 0.0000 0.0000 64.0879 31.6977 175.5783 107 I 4.8496 7.2401 111.4006 59.4780 41.6264 175.5840 108 S 3.5198 7.2179 118.1259 57.9340 66.8172 176.3225 *110 I 4.1435 8.4407 119.4893 60.9771 37.9941 174.4692 111 G 4.5369 9.3773 112.6174 44.8097 0.0000 171.6218 112 T 5.2789 8.5923 116.9469 61.9118 70.4649 174.5822 113 C 5.2855 9.3671 124.0380 55.3260 44.1829 172.6277 114 H 5.1465 8.9655 122.1279 54.6383 30.8587 173.8502 115 N 3.6179 8.7437 125.7631 51.1995 38.8832 173.9068 116 P 4.1596 0.0000 0.0000 65.3227 32.0928 177.6951 117 H 4.2713 8.2726 116.8866 58.2508 28.5911 175.9050 118 D 4.6426 7.9237 114.5442 52.3915 39.9923 176.8348 119 G 3.8226 8.2573 108.0830 45.7828 0.0000 173.3392 120 K 4.5681 8.1031 118.8016 54.4893 35.4204 174.6280 121 D 5.4492 8.1286 120.8169 52.9940 43.5149 175.1670 122 Y 5.0329 9.1290 119.9089 56.0147 42.3467 174.7293 123 L 4.6656 9.3626 123.6283 54.7066 43.1440 175.9341 124 I 4.6980 9.0225 125.0471 59.3524 40.3832 174.3486 125 S 4.5626 8.7829 122.0294 56.6889 64.0161 173.4266 126 Y 5.3768 7.9267 127.2563 56.4268 35.8526 174.8818 127 H 4.4472 8.0747 119.3090 55.8658 30.8061 174.9908 128 D 5.3983 9.1807 121.6839 53.5683 43.7012 174.5178 129 C 5.4448 9.2503 117.7269 55.7380 41.2195 172.7167 130 C 5.3329 9.0236 119.2433 55.8985 44.6528 174.8943 131 G 3.9394 9.5228 108.1786 45.6568 0.0000 173.5691 132 K 4.6129 7.4126 116.6816 54.0168 35.9396 176.1814 133 T 4.1052 8.2536 111.1510 60.6765 69.5847 173.9648 134 A 4.0300 8.5458 124.3140 52.9287 18.6275 178.2317 135 C 3.9842 8.2876 123.9005 58.4189 43.6748 175.2078 136 G 3.1896 5.5697 104.5640 44.9571 0.0000 172.9015 137 R 4.5264 6.9706 117.4365 55.4367 33.3455 176.2412 138 C 4.2922 8.7073 116.2776 58.1482 37.6961 173.3958 139 Q 4.7018 8.0139 119.0279 56.2425 30.0240 175.2788 140 C 5.1140 9.1096 122.3906 54.6116 44.2612 173.2659 141 N 5.4065 8.0094 117.7998 52.5948 37.5931 173.8243 142 T 4.4573 8.4396 111.8796 60.8189 71.9020 176.9189 143 Q 4.5082 8.2240 119.7358 55.9425 32.0818 174.6763 144 T 3.9526 8.0462 117.1543 65.0750 68.4938 174.5443 145 R 3.8894 8.8250 123.6062 56.5468 28.0125 175.8590 146 E 4.3789 7.9556 119.4962 56.3803 30.3605 176.0813 147 R 4.7503 8.6035 123.7874 53.5664 35.1953 173.0653 148 P 4.5471 0.0000 0.0000 61.8663 32.5715 177.7201 149 G 3.6695 8.1973 108.8005 48.1092 0.0000 174.1601 150 Y 4.4285 7.3277 116.4382 58.1644 38.9487 175.7612 151 E 4.7785 7.7563 121.3920 54.4693 29.9051 176.0838 152 F 4.2938 8.3560 124.6231 61.0703 40.0981 176.3690 153 F 4.5055 8.3718 115.8482 58.1240 39.1818 175.6745 154 L 4.6895 8.2242 120.8935 54.6141 41.8764 175.0035 155 H 5.7131 8.1648 118.6001 53.7466 31.2428 173.7845 156 N 4.9241 8.9598 122.5959 52.8752 37.4461 174.3049 157 D 4.7045 7.3074 116.1481 54.3696 41.0345 176.2626 158 V 4.0898 6.7461 111.7446 58.9920 34.6794 175.1864 159 N 4.2556 7.9850 120.4830 52.7563 38.1006 175.5384 160 W 4.4318 8.1249 124.2150 58.0751 29.4490 176.6979 161 C 4.8072 8.8107 116.6373 57.5365 39.6531 175.2985 162 M 3.8383 8.0672 118.5317 57.3088 30.7464 176.9360 163 A 4.6666 7.8887 119.7657 51.7367 19.9924 176.1073 164 N 4.6933 8.0592 114.0997 52.6907 39.3433 174.9790 165 E 4.0330 8.8927 121.0474 58.5288 29.8177 176.7569 166 N 4.9577 7.9800 116.3206 51.7606 40.9222 173.6170 167 S 4.7668 8.7157 119.1166 58.7556 63.9185 174.2171 168 T 4.0610 8.1458 120.1264 64.0659 69.2024 173.0466 169 F 4.7320 8.9730 129.2003 58.4851 40.0727 173.4557 170 H 4.6552 8.4086 125.7681 57.0847 31.5166 171.6568 171 C 4.9070 6.8965 109.8817 54.8346 40.4004 171.7031 172 T 5.0630 9.3629 113.9617 60.8623 69.6480 171.4595 173 T 4.7567 8.8384 125.8964 61.3987 71.3167 173.4164 174 S 4.5018 8.1552 116.8310 56.7867 65.7214 173.5804 175 V 3.9545 8.4452 126.2488 61.4035 32.8371 174.6531 176 L 4.3124 8.3935 130.6629 55.3086 41.9355 176.1857 177 V 3.8678 8.9716 127.6758 63.6317 32.4960 176.0949 178 G 4.0471 7.5452 105.7843 45.5022 0.0000 170.9815 179 L 3.9896 8.2691 119.1470 54.3852 42.1091 177.3396 180 A 4.1482 8.5556 125.3381 52.5298 18.2102 177.2468 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 *59 H 8.30 4.77 0.00 2.85 3.07 0.00 7.16 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 60 I 7.93 3.74 1.87 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 1.70 0.25 0.93 0.00 0.00 61 S 8.87 4.30 0.00 3.91 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 62 L 7.58 4.72 0.00 1.64 1.71 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.95 5.01 0.00 2.73 2.70 0.00 0.00 6.65 7.61 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 64 P 0.00 4.26 0.00 2.16 2.35 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 65 D 8.05 4.42 0.00 2.68 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 66 L 7.95 4.22 0.00 1.71 1.72 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.33 4.34 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 68 N 8.57 4.51 0.00 2.80 2.69 0.00 0.00 7.00 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 69 E 8.84 3.93 0.00 2.01 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 2.32 1.98 0.00 70 D 7.94 4.54 0.00 2.63 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 71 E 7.88 4.08 0.00 2.05 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 0.00 2.55 2.52 0.00 72 V 7.26 2.50 1.82 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 0.61 0.00 0.00 0.53 0.00 0.00 73 N 7.86 4.70 0.00 2.79 2.81 0.00 0.00 6.87 7.08 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 74 S 7.61 4.79 0.00 3.95 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 75 C 8.79 4.49 0.00 3.04 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 76 D 8.00 4.44 0.00 2.78 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 77 Y 7.95 4.40 0.00 3.20 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 78 W 8.38 4.21 0.00 3.68 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 79 R 5.84 3.44 0.00 1.12 0.66 0.00 2.91 0.00 0.00 3.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.09 0.00 80 H 7.75 5.09 0.00 3.34 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 C 8.40 4.64 0.00 3.08 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 82 A 7.47 5.20 0.96 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 83 V 7.73 3.47 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 0.95 0.00 0.00 0.99 0.00 0.00 84 D 9.41 4.96 0.00 2.49 2.43 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 85 G 7.54 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 86 F 7.90 5.25 0.00 3.14 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 87 L 8.70 4.55 0.00 1.72 1.57 0.89 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 88 C 8.88 4.31 0.00 3.03 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 89 S 7.97 4.17 0.00 3.98 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 90 C 8.05 4.68 0.00 3.08 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 91 C 8.39 4.80 0.00 3.00 2.94 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 92 G 8.64 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 93 G 7.56 4.35 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 0.00 94 T 7.89 4.71 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 1.19 0.00 0.00 95 T 8.80 3.97 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 96 T 7.74 4.60 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 1.18 0.00 0.00 97 T 7.71 4.66 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 1.20 0.00 0.00 98 C 8.66 4.70 0.00 2.99 3.13 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 99 P 0.00 4.60 0.00 2.21 2.20 0.00 3.66 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 2.16 2.23 0.00 100 P 0.00 4.30 0.00 2.01 2.00 0.00 3.72 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 2.02 2.09 0.00 101 G 8.97 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 0.00 102 S 7.70 4.98 0.00 3.85 3.70 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 0.00 103 T 8.59 4.65 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 1.24 0.00 0.00 104 P 0.00 4.91 0.00 1.95 1.99 0.00 3.68 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 2.03 2.10 0.00 105 S 8.82 4.73 0.00 4.16 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 0.00 106 P 0.00 4.51 0.00 2.28 2.27 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 107 I 7.24 4.85 2.17 0.00 0.00 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 1.72 1.28 1.11 0.00 0.00 108 S 7.22 3.52 0.00 3.62 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 *110 I 8.44 4.14 1.88 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 1.19 0.75 0.93 0.00 0.00 111 G 9.38 4.54 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 0.00 0.00 0.00 112 T 8.59 5.28 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 1.27 0.00 0.00 113 C 9.37 5.29 0.00 3.17 3.39 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 0.00 114 H 8.97 5.15 0.00 3.20 3.26 0.00 5.73 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.74 3.62 0.00 1.44 2.42 0.00 0.00 6.61 7.74 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 0.00 116 P 0.00 4.16 0.00 2.06 2.09 0.00 3.25 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 1.63 1.91 0.00 117 H 8.27 4.27 0.00 3.11 3.32 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 7.92 4.64 0.00 2.73 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 0.00 119 G 8.26 3.82 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 0.00 0.00 0.00 120 K 8.10 4.57 0.00 1.63 1.27 0.00 1.82 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 1.48 7.81 121 D 8.13 5.45 0.00 2.50 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 0.00 122 Y 9.13 5.03 0.00 3.27 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 0.00 123 L 9.36 4.67 0.00 1.72 1.60 0.92 0.71 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 0.00 124 I 9.02 4.70 1.50 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 1.27 0.85 0.26 0.00 0.00 125 S 8.78 4.56 0.00 3.74 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 Y 7.93 5.38 0.00 2.81 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 0.00 127 H 8.07 4.45 0.00 3.10 3.26 0.00 5.60 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 0.00 128 D 9.18 5.40 0.00 2.84 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 0.00 129 C 9.25 5.44 0.00 2.82 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 0.00 130 C 9.02 5.33 0.00 3.03 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 0.00 131 G 9.52 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 0.00 132 K 7.41 4.61 0.00 1.38 1.46 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.24 1.40 7.81 133 T 8.25 4.11 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 1.22 0.00 0.00 134 A 8.55 4.03 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 0.00 135 C 8.29 3.98 0.00 2.48 2.78 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 0.00 0.00 0.00 136 G 5.57 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 0.00 0.00 0.00 137 R 6.97 4.53 0.00 1.69 1.80 0.00 3.25 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 138 C 8.71 4.29 0.00 3.16 3.13 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 0.00 139 Q 8.01 4.70 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.04 0.00 140 C 9.11 5.11 0.00 2.79 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 0.00 141 N 8.01 5.41 0.00 2.57 2.62 0.00 0.00 7.00 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 0.00 142 T 8.44 4.46 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 1.21 0.00 0.00 143 Q 8.22 4.51 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.11 0.00 0.00 0.00 0.00 0.00 2.45 2.27 0.00 144 T 8.05 3.95 4.38 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 1.26 0.00 0.00 145 R 8.82 3.89 0.00 2.01 2.08 0.00 3.25 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 146 E 7.96 4.38 0.00 1.95 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 2.52 2.47 0.00 147 R 8.60 4.75 0.00 1.68 1.71 0.00 3.36 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 148 P 0.00 4.55 0.00 1.21 1.79 0.00 3.06 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 2.00 1.98 0.00 149 G 8.20 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 0.00 150 Y 7.33 4.43 0.00 3.08 3.13 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 0.00 151 E 7.76 4.78 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 2.36 2.26 0.00 152 F 8.36 4.29 0.00 3.04 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 0.00 153 F 8.37 4.51 0.00 3.12 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 0.00 154 L 8.22 4.69 0.00 1.88 1.69 1.01 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 155 H 8.16 5.71 0.00 3.18 3.11 0.00 5.55 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 0.00 156 N 8.96 4.92 0.00 2.66 2.71 0.00 0.00 6.95 7.96 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 0.00 157 D 7.31 4.70 0.00 2.51 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 0.00 158 V 6.75 4.09 1.57 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 0.61 0.00 0.00 -0.24 0.00 0.00 159 N 7.99 4.26 0.00 2.64 2.58 0.00 0.00 6.96 7.95 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 0.00 160 W 8.12 4.43 0.00 3.53 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 0.00 161 C 8.81 4.81 0.00 3.42 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 0.00 162 M 8.07 3.84 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.47 0.00 163 A 7.89 4.67 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 0.00 164 N 8.06 4.69 0.00 3.01 2.90 0.00 0.00 6.84 7.26 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 0.00 165 E 8.89 4.03 0.00 1.95 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 2.31 2.33 0.00 166 N 7.98 4.96 0.00 2.69 2.67 0.00 0.00 6.95 7.63 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 0.00 167 S 8.72 4.77 0.00 4.06 3.99 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 0.00 168 T 8.15 4.06 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 1.27 0.00 0.00 169 F 8.97 4.73 0.00 3.24 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 0.00 170 H 8.41 4.66 0.00 3.32 3.21 0.00 5.87 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 C 6.90 4.91 0.00 3.21 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 0.00 172 T 9.36 5.06 4.72 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 1.43 0.00 0.00 173 T 8.84 4.76 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 1.32 0.00 0.00 174 S 8.16 4.50 0.00 3.87 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 0.00 175 V 8.45 3.95 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 0.91 0.00 0.00 176 L 8.39 4.31 0.00 1.57 1.52 1.09 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 0.00 177 V 8.97 3.87 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 0.78 0.00 0.00 0.88 0.00 0.00 178 G 7.55 4.05 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 0.00 0.00 0.00 179 L 8.27 3.99 0.00 1.57 1.44 0.85 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.56 4.15 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 * Residues marked with a * may have inaccurate shift predictions.