NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0932 8.2127 108.0350 45.5751 0.0000 174.5556 2 L 2.6926 7.4960 128.7753 54.5849 41.4811 174.4701 3 D 4.7581 8.6812 126.8614 55.8952 42.9439 175.8425 4 N 4.5629 7.5318 112.7476 52.5089 39.9186 173.3112 5 E 5.2692 8.6723 116.8007 55.3840 33.2405 173.8458 6 L 4.7789 8.8999 121.0359 53.8967 45.8829 174.7657 7 S 5.4195 8.7011 120.3280 56.9373 66.3122 173.1696 8 L 4.6476 8.8252 123.2813 53.6819 45.7806 174.9902 9 V 4.3877 8.5201 126.7179 62.2928 32.2646 175.3544 10 D 4.7939 9.5385 130.1653 51.6207 41.2982 177.3190 11 G 3.7956 8.7911 107.9924 47.9111 0.0000 174.0617 12 Q 4.5545 9.1002 119.4677 55.9991 28.9000 176.2220 13 D 4.5525 8.3684 114.9824 56.1946 39.2855 173.9648 14 R 4.3962 7.6492 118.2565 56.2647 31.5893 175.8750 15 T 4.7178 8.5697 121.0099 62.9188 69.7429 173.6548 16 L 5.0041 9.3317 128.5576 53.4391 43.8482 175.9327 17 T 5.2688 9.4160 121.2253 61.6249 71.9317 173.5865 18 V 5.0578 9.0459 124.7414 60.1870 34.9443 174.5486 19 Q 5.2402 9.6868 121.0597 54.3681 33.8303 173.9217 20 Q 5.0826 9.0490 121.8181 54.4621 31.9803 173.9569 21 W 4.9998 9.7290 126.8414 55.5467 32.4388 176.0079 22 D 4.7329 9.1707 122.2843 55.6501 38.2962 174.1295 23 T 4.4509 8.2125 116.3897 63.6699 69.1327 174.0326 24 F 4.7396 9.5466 128.4498 56.3143 42.8563 173.3142 25 L 4.3571 6.2490 125.5329 52.8036 43.3510 175.4395 26 N 4.2821 8.6162 125.0461 51.4024 39.9264 174.2401 27 G 4.1536 8.5242 114.0918 46.3955 0.0000 171.8120 28 V 4.5504 8.1738 114.9698 58.8942 36.5310 175.3108 29 F 4.4577 8.2678 120.7767 57.0333 39.1391 173.9445 30 P 4.4421 0.0000 0.0000 63.1705 31.8021 177.0383 31 L 4.1724 8.1193 122.3632 57.5099 42.2973 177.6111 32 D 4.4495 8.0576 115.4561 53.7583 39.5059 176.3747 33 R 3.8683 7.5954 117.3002 57.1553 28.3706 174.8531 34 N 4.8609 8.3270 117.3237 51.9033 39.9706 175.6806 35 R 4.2989 8.5420 121.0519 57.3482 30.1806 177.1139 36 L 4.2284 9.2900 119.8599 56.5003 42.0890 176.0434 37 T 5.0243 7.7572 116.0682 61.8633 70.2135 174.2609 38 R 4.8731 9.1705 125.2508 54.7867 33.3973 174.9254 39 E 4.5401 8.6012 122.1042 54.6142 33.5444 173.6561 40 W 5.6946 7.8307 122.6808 55.4108 32.6350 173.0654 41 F 5.2891 9.2737 118.5548 55.9265 41.8721 173.9876 42 H 5.2943 9.5675 123.3931 54.7882 31.7415 173.6480 43 S 5.1325 9.5773 121.3319 56.4029 67.4574 173.4963 44 G 4.3008 7.7438 109.4883 46.7049 0.0000 171.5943 45 R 5.3616 8.7304 117.9682 54.4258 34.7492 174.4574 46 A 5.3989 9.2907 125.0057 50.3627 21.8672 175.7528 47 K 5.2088 9.1780 120.1084 54.7825 36.7326 174.9939 48 Y 5.4615 8.5353 119.6523 55.6541 41.8341 174.3127 49 I 5.0377 8.6570 120.3736 59.8382 42.1213 174.4273 50 V 4.9437 8.5985 124.5816 59.9114 34.1509 174.6226 51 A 4.6902 8.9565 124.4867 50.6216 23.1056 174.6971 52 G 3.9743 8.8207 103.9713 43.2529 0.0000 170.7951 53 P 4.2485 0.0000 0.0000 65.1966 31.1071 176.1790 54 G 4.4067 9.0703 111.2786 44.8231 0.0000 174.3521 55 A 4.0700 7.6862 124.6131 55.1094 18.3581 179.8035 56 D 4.5683 8.1351 113.5466 56.4706 41.2397 176.6685 57 E 4.5610 8.3063 118.9195 55.9923 29.8232 174.4304 58 F 4.8614 8.1077 122.6280 57.2495 41.1370 174.1568 59 E 4.7870 7.8237 124.7489 54.8045 32.9338 175.3542 60 G 4.0389 8.0771 109.7834 46.1498 0.0000 171.3804 61 T 5.1844 9.0363 116.7831 61.5786 72.3922 173.0143 62 L 5.3497 9.2784 127.5286 53.4804 44.6996 175.0165 63 E 5.3116 9.1756 124.5967 54.8051 34.2428 174.3867 64 L 4.4899 7.4061 121.9182 52.5791 45.7628 175.9561 65 G 3.7797 6.9181 112.5316 45.4391 0.0000 171.7093 66 Y 4.9474 6.8033 119.5016 56.3894 41.5902 173.8817 67 Q 4.9004 9.1532 120.5697 55.8118 30.9751 174.7747 68 I 4.7173 9.1907 123.1997 59.6235 39.7834 175.0529 69 G 3.4722 8.7898 113.8862 46.1455 0.0000 173.4645 *122 G 4.1372 8.9903 117.5280 44.4774 0.0000 171.0367 123 P 4.4790 0.0000 0.0000 62.7517 32.1603 177.0962 124 G 4.1364 6.5668 108.1908 45.1200 0.0000 171.7786 125 I 5.0027 7.6120 120.6128 59.4535 38.0550 175.8886 126 Q 4.6403 8.5778 125.4667 53.9704 32.9887 173.7182 127 E 4.9059 8.8426 123.9294 54.7908 31.4701 174.8525 128 V 4.2542 8.4465 126.8283 61.0642 33.8575 174.1505 129 A 4.3423 8.4464 130.0919 51.0205 19.0200 176.7405 130 T 4.1445 8.5822 120.1462 66.8186 69.5376 175.0520 131 F 5.0897 7.3522 114.3849 55.2494 42.0729 173.9148 132 S 5.0966 8.7351 114.2182 57.4710 65.0733 173.5086 133 V 4.6550 9.3195 120.5065 59.5998 36.1682 174.5235 134 D 4.9883 8.8300 124.6704 54.7096 41.5406 176.1102 135 V 4.8407 8.9329 115.5421 59.6913 36.2733 174.6946 136 S 5.9665 8.4801 116.2048 56.8499 65.9818 172.7805 137 G 4.0229 9.3303 107.6454 44.2516 0.0000 173.7269 138 A 4.2785 8.6885 121.0087 53.9335 18.9390 177.0918 139 E 4.5667 7.6281 113.3268 54.4989 34.0013 174.9068 140 G 3.7004 6.6158 107.1764 45.9596 0.0000 172.1387 141 G 4.6588 7.8641 105.5823 45.6708 0.0000 173.3019 142 V 4.6130 8.1790 121.8561 59.4590 34.8099 174.3203 143 A 5.4739 8.4731 123.5421 50.2234 22.5210 175.7127 144 V 4.5128 8.8760 118.4792 60.0453 34.9525 174.1662 145 S 4.8360 8.7217 118.8361 57.0945 64.3824 173.1707 146 N 4.4768 8.7550 123.1037 54.0014 36.4988 174.2887 147 A 4.2702 7.9638 120.0898 52.9299 19.6682 176.7496 148 H 4.7319 8.8354 120.2812 54.3460 31.7646 174.1188 149 G 3.6850 7.2354 111.2570 44.7985 0.0000 171.1140 150 T 4.1089 7.2921 114.4046 60.5515 70.3736 172.8425 151 V 4.6599 8.7925 126.2740 60.7234 35.2790 173.2284 152 T 4.8669 8.2048 115.8613 60.9888 71.0580 173.4091 153 G 3.8345 8.9230 109.3873 46.0221 0.0000 174.9747 154 A 4.1896 8.0232 124.0033 52.2862 16.4304 178.6725 155 A 4.1384 7.9849 129.6899 50.6686 17.3762 177.3364 156 G 3.5933 7.7900 111.4723 45.4979 0.0000 170.9786 157 G 4.0167 8.8521 116.9407 44.6131 0.0000 171.9429 158 V 4.4655 7.8077 118.3813 61.7749 35.5229 172.4244 159 L 5.0698 8.3838 127.8775 53.0407 44.4121 175.4251 160 L 5.0032 8.8981 122.8180 52.9685 45.0805 175.5065 161 R 4.9137 8.8544 125.8123 54.1536 31.2729 173.1767 162 P 5.2151 0.0000 0.0000 62.2945 33.2116 175.0688 163 F 5.3461 8.2127 115.9135 55.1932 41.8971 173.0733 164 A 5.0389 8.9032 121.1147 50.2114 22.5236 175.0392 165 R 4.9601 9.2600 121.4538 54.3728 33.7929 173.6377 166 L 5.1295 9.1844 128.4832 53.4561 44.6687 174.7873 167 I 4.9473 8.9947 127.7203 59.4604 40.0600 174.6694 168 A 4.6233 9.7507 130.6430 50.5643 19.6895 178.4259 169 S 4.2372 8.3195 117.3909 61.3156 62.9131 175.7078 170 T 4.0826 7.6420 108.8491 61.7809 69.0196 174.1755 171 G 4.1471 8.3403 111.4891 46.1051 0.0000 174.5443 172 D 4.7934 7.9608 118.8125 54.4532 42.1395 175.7918 173 S 5.0734 8.3913 114.8587 57.0441 66.2628 173.5313 174 V 4.6391 9.0017 121.1058 60.3665 34.8916 174.2969 175 T 4.9816 8.3824 116.5757 60.9070 70.3027 172.5125 176 T 4.5970 8.8421 123.9504 61.1186 69.2243 172.8029 177 Y 5.1986 8.7630 125.2157 56.3711 40.9732 175.6180 178 G 4.1920 9.0144 110.9772 44.7536 0.0000 172.8645 179 E 4.4455 8.6441 119.5871 54.8359 30.2413 175.4186 180 P 4.8645 0.0000 0.0000 63.1599 32.3707 175.4501 181 W 4.5646 9.2939 121.9932 55.5076 30.8935 174.8285 182 N 5.0215 8.5209 122.8417 52.3135 39.6545 174.7791 183 M 4.4716 9.9537 124.8641 55.5640 32.4151 176.3910 184 N 4.3639 7.7824 123.1136 54.2286 39.4837 173.9824 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 1 G 8.21 4.09 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 0.00 0.00 0.00 2 L 7.50 2.69 0.00 0.27 0.93 0.51 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.68 4.76 0.00 2.64 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 N 7.53 4.56 0.00 2.81 2.87 0.00 0.00 5.78 7.66 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 5 E 8.67 5.27 0.00 2.15 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 2.19 2.34 0.00 6 L 8.90 4.78 0.00 1.81 1.53 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.70 5.42 0.00 3.78 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 8 L 8.83 4.65 0.00 1.72 1.47 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.52 4.39 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 0.87 0.00 0.00 0.95 0.00 0.00 10 D 9.54 4.79 0.00 3.08 2.85 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 11 G 8.79 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 0.00 0.00 0.00 12 Q 9.10 4.55 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.07 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 13 D 8.37 4.55 0.00 2.88 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 14 R 7.65 4.40 0.00 2.22 1.88 0.00 3.26 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 15 T 8.57 4.72 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 1.23 0.00 0.00 16 L 9.33 5.00 0.00 1.69 1.59 1.07 -0.19 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 17 T 9.42 5.27 4.36 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 1.33 0.00 0.00 18 V 9.05 5.06 2.17 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 0.96 0.00 0.00 1.08 0.00 0.00 19 Q 9.69 5.24 0.00 2.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 20 Q 9.05 5.08 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 21 W 9.73 5.00 0.00 3.37 3.17 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 0.00 22 D 9.17 4.73 0.00 2.98 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 23 T 8.21 4.45 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 1.10 0.00 0.00 24 F 9.55 4.74 0.00 2.92 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 25 L 6.25 4.36 0.00 0.27 0.95 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.62 4.28 0.00 1.61 2.49 0.00 0.00 6.86 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 27 G 8.52 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 0.00 0.00 0.00 28 V 8.17 4.55 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 0.88 0.00 0.00 1.09 0.00 0.00 29 F 8.27 4.46 0.00 3.13 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 30 P 0.00 4.44 0.00 2.25 2.04 0.00 4.12 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 31 L 8.12 4.17 0.00 1.85 1.69 0.96 1.22 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 32 D 8.06 4.45 0.00 2.83 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 33 R 7.60 3.87 0.00 1.98 2.07 0.00 3.44 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 34 N 8.33 4.86 0.00 2.74 2.91 0.00 0.00 7.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.54 4.30 0.00 2.00 2.06 0.00 3.10 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 36 L 9.29 4.23 0.00 1.94 1.77 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.76 5.02 4.52 0.00 0.00 0.00 0.00 0.00 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 38 R 9.17 4.87 0.00 2.05 2.17 0.00 3.61 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 39 E 8.60 4.54 0.00 1.80 1.63 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 1.86 1.93 0.00 40 W 7.83 5.69 0.00 3.25 3.17 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 0.00 41 F 9.27 5.29 0.00 2.89 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 42 H 9.57 5.29 0.00 3.20 3.27 0.00 5.54 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 43 S 9.58 5.13 0.00 3.87 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 44 G 7.74 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 0.00 0.00 0.00 0.00 45 R 8.73 5.36 0.00 1.86 1.80 0.00 3.28 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 46 A 9.29 5.40 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.18 5.21 0.00 1.67 1.53 0.00 1.02 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.07 7.81 48 Y 8.54 5.46 0.00 3.02 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 49 I 8.66 5.04 1.88 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 1.16 0.80 0.88 0.00 0.00 50 V 8.60 4.94 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 0.40 0.00 0.00 0.88 0.00 0.00 51 A 8.96 4.69 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 52 G 8.82 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 0.00 0.00 0.00 53 P 0.00 4.25 0.00 2.21 2.13 0.00 3.79 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 2.01 1.99 0.00 54 G 9.07 4.41 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 0.00 55 A 7.69 4.07 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 56 D 8.14 4.57 0.00 2.72 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 57 E 8.31 4.56 0.00 2.38 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 2.28 2.30 0.00 58 F 8.11 4.86 0.00 3.18 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 59 E 7.82 4.79 0.00 1.62 1.60 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 2.15 2.11 0.00 60 G 8.08 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 61 T 9.04 5.18 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 1.30 0.00 0.00 62 L 9.28 5.35 0.00 1.79 1.65 1.21 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.18 5.31 0.00 2.05 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 2.29 2.30 0.00 64 L 7.41 4.49 0.00 1.01 0.13 0.87 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 65 G 6.92 3.78 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 0.00 0.00 0.00 66 Y 6.80 4.95 0.00 3.08 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 67 Q 9.15 4.90 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 68 I 9.19 4.72 1.98 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.45 1.00 0.00 0.00 69 G 8.79 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 0.00 0.00 0.00 0.00 *122 G 8.99 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 0.00 0.00 0.00 0.00 123 P 0.00 4.48 0.00 2.22 2.20 0.00 3.94 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 2.03 2.01 0.00 124 G 6.57 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 0.00 0.00 0.00 0.00 125 I 7.61 5.00 1.88 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 1.37 1.61 0.92 0.00 0.00 126 Q 8.58 4.64 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.90 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 127 E 8.84 4.91 0.00 1.97 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 2.38 2.41 0.00 128 V 8.45 4.25 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 0.70 0.00 0.00 0.90 0.00 0.00 129 A 8.45 4.34 1.26 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 0.00 130 T 8.58 4.14 4.11 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 1.31 0.00 0.00 131 F 7.35 5.09 0.00 2.95 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 0.00 132 S 8.74 5.10 0.00 3.91 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 0.00 133 V 9.32 4.66 2.09 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 0.67 0.00 0.00 0.92 0.00 0.00 134 D 8.83 4.99 0.00 2.56 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 0.00 135 V 8.93 4.84 2.30 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 1.00 0.00 0.00 0.84 0.00 0.00 136 S 8.48 5.97 0.00 3.87 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 0.00 137 G 9.33 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 0.00 0.00 0.00 138 A 8.69 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 0.00 139 E 7.63 4.57 0.00 1.63 1.53 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 2.02 2.18 0.00 140 G 6.62 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 0.00 0.00 0.00 141 G 7.86 4.66 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 0.00 142 V 8.18 4.61 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 0.47 0.00 0.00 -0.12 0.00 0.00 143 A 8.47 5.47 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 0.00 144 V 8.88 4.51 2.33 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 0.81 0.00 0.00 1.03 0.00 0.00 145 S 8.72 4.84 0.00 3.90 3.79 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 0.00 146 N 8.76 4.48 0.00 2.92 3.02 0.00 0.00 6.99 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 0.00 147 A 7.96 4.27 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 0.00 148 H 8.84 4.73 0.00 3.01 3.12 0.00 5.87 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 G 7.24 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 0.00 150 T 7.29 4.11 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 1.00 0.00 0.00 151 V 8.79 4.66 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 0.98 0.00 0.00 1.03 0.00 0.00 152 T 8.20 4.87 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 0.00 153 G 8.92 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 0.00 154 A 8.02 4.19 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 0.00 155 A 7.98 4.14 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 0.00 156 G 7.79 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 0.00 157 G 8.85 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 0.00 0.00 0.00 158 V 7.81 4.47 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 0.69 0.00 0.00 0.97 0.00 0.00 159 L 8.38 5.07 0.00 1.64 1.52 0.94 0.28 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 0.00 160 L 8.90 5.00 0.00 1.41 1.19 0.55 -1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 161 R 8.85 4.91 0.00 1.99 2.16 0.00 3.29 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.67 0.00 162 P 0.00 5.22 0.00 2.35 2.01 0.00 3.88 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.05 0.00 163 F 8.21 5.35 0.00 2.21 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 A 8.90 5.04 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 0.00 165 R 9.26 4.96 0.00 1.94 1.85 0.00 2.99 0.00 0.00 2.98 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 166 L 9.18 5.13 0.00 1.81 1.54 0.74 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 167 I 8.99 4.95 1.88 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 1.17 0.88 0.90 0.00 0.00 168 A 9.75 4.62 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 0.00 169 S 8.32 4.24 0.00 3.90 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 0.00 170 T 7.64 4.08 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 1.19 0.00 0.00 171 G 8.34 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 0.00 0.00 0.00 172 D 7.96 4.79 0.00 2.75 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 0.00 173 S 8.39 5.07 0.00 3.89 3.78 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 0.00 174 V 9.00 4.64 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 0.92 0.00 0.00 0.97 0.00 0.00 175 T 8.38 4.98 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 1.26 0.00 0.00 176 T 8.84 4.60 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 1.38 0.00 0.00 177 Y 8.76 5.20 0.00 2.88 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 0.00 178 G 9.01 4.19 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 0.00 179 E 8.64 4.45 0.00 1.93 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 2.31 2.30 0.00 180 P 0.00 4.86 0.00 2.09 2.10 0.00 3.76 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 2.01 0.00 181 W 9.29 4.56 0.00 3.00 3.04 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 0.00 182 N 8.52 5.02 0.00 2.81 2.66 0.00 0.00 7.22 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 0.00 183 M 9.95 4.47 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.14 0.00 184 N 7.78 4.36 0.00 2.67 2.63 0.00 0.00 6.92 7.44 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 * Residues marked with a * may have inaccurate shift predictions.