NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *12 F 4.6380 8.3249 119.0062 56.5169 40.0067 175.0299 13 E 4.0226 8.6215 120.1399 59.4970 30.0043 175.8660 14 L 4.6177 8.5573 123.5218 52.8044 41.4770 176.8446 15 R 3.9253 8.2805 122.1096 58.9942 30.3699 176.2426 16 P 4.3162 0.0000 0.0000 65.3167 31.3558 178.6995 17 V 3.6241 7.9323 117.4544 65.8233 31.1154 178.0034 18 I 3.8086 7.6696 119.1999 64.3334 36.9329 178.3174 19 G 3.7183 7.9815 106.0438 47.7278 0.0000 175.7150 20 L 4.0522 7.8346 120.6436 56.9733 41.9276 178.6693 21 T 4.3207 7.7307 107.6131 60.6481 69.4554 174.9013 22 R 4.0351 6.9410 121.2628 58.3414 30.4946 177.1343 23 G 3.9586 8.9094 109.7049 45.3952 0.0000 173.5544 24 L 4.3529 7.6038 119.5143 54.0117 42.8091 177.2539 25 S 4.6066 8.2249 116.0402 57.5401 65.7200 175.3348 26 S 4.1183 8.7044 118.0067 61.7815 62.5599 176.7014 27 A 3.9964 7.9453 123.8109 55.1648 18.1857 179.2096 28 D 4.3180 7.8560 116.9040 57.5011 40.8897 178.9955 29 I 3.6657 7.9078 120.4298 64.3992 36.9963 178.1334 30 E 3.8295 8.5100 120.4021 59.3035 29.4286 178.9917 31 T 3.8503 7.7138 115.6351 66.5992 68.5204 176.5351 32 L 3.9901 8.0382 120.8680 58.1241 41.5719 179.7772 33 T 3.7985 8.0642 115.4724 66.4712 68.3341 176.6581 34 A 3.9516 8.2845 123.0187 55.1980 18.3647 179.3510 35 N 4.2364 8.2186 114.7895 56.4427 38.5483 177.4118 36 A 3.9750 8.1161 122.0574 55.3252 18.5618 179.7866 37 I 3.6696 7.9772 118.3875 64.5927 37.1444 178.9608 38 R 3.9544 8.2073 119.0555 58.9807 29.7713 178.8657 39 L 4.0815 8.1694 120.3945 58.3795 42.1338 178.3281 40 H 4.4365 8.3388 119.7026 58.8796 29.7703 177.3601 41 R 3.8327 7.9049 119.4198 59.4052 29.8472 179.1501 42 Q 4.0312 8.0948 117.8610 58.8676 28.6947 178.7438 43 L 4.0074 8.2536 120.4428 57.4539 41.6054 179.5868 44 L 3.9135 7.9353 119.1475 57.6238 41.5642 178.9378 45 E 3.9088 8.1280 119.2428 59.1174 29.5773 178.5537 46 K 4.3597 8.4317 120.6950 59.1353 32.2740 178.4598 47 A 4.1520 8.0752 120.7327 55.2224 18.3294 179.3940 48 D 4.3651 8.2304 117.3800 57.7531 40.5088 178.8322 49 Q 4.0765 8.2700 118.5146 59.1801 28.5187 179.1914 50 L 3.9438 7.8327 118.6623 57.7214 41.9551 179.0201 51 F 3.7517 8.4134 120.6804 61.1269 39.0712 177.0361 52 Q 3.9780 7.8380 116.2874 59.1437 28.7149 178.9099 53 V 3.8064 6.9898 109.4587 61.2812 32.1357 176.7376 54 L 4.0231 6.7266 119.6454 53.5223 42.2249 175.9275 55 P 4.3514 0.0000 0.0000 62.6236 33.2236 177.6185 56 D 4.2660 8.4809 120.0472 57.4495 40.7413 178.7574 57 D 4.3002 8.0486 119.2336 56.1822 39.0310 178.6015 58 I 4.5795 7.2353 121.8027 63.2047 37.3614 177.8948 59 K 3.7673 7.6943 118.0120 59.6384 31.9127 179.1777 60 I 3.9735 7.7439 119.2622 65.0838 37.2264 176.8004 61 G 3.9473 7.2245 106.6798 46.3834 0.0000 175.2806 62 T 4.1689 7.8791 111.0602 61.7696 69.1890 179.2066 63 A 4.6701 8.2397 122.6553 51.6532 22.3918 175.3915 64 A 4.6158 8.6683 124.4136 50.6044 21.7076 176.0347 65 G 4.2019 10.1062 109.2761 43.2797 0.0000 173.0432 66 G 4.0229 8.6337 108.1779 45.6920 0.0000 175.2480 67 E 4.0373 8.6787 118.3992 60.9807 29.7896 180.1968 68 Q 4.2223 8.0233 119.5347 59.3090 29.1960 177.5238 69 H 4.3948 8.1783 118.9478 59.2940 29.9840 177.1089 70 L 3.9538 8.0950 120.8936 57.6747 41.3981 179.0741 71 E 3.9256 8.2021 119.2070 59.4211 29.5720 178.3232 72 Y 4.1388 8.0673 119.2095 60.7597 38.8093 177.8881 73 I 3.4859 8.0314 120.8760 64.3400 37.0824 178.3151 74 E 3.8921 8.4502 119.4369 59.1651 29.2612 179.1760 75 A 3.9273 7.8697 120.8843 55.4024 18.3449 179.6742 76 M 3.8525 7.6764 117.1029 58.4964 31.9385 179.0218 77 I 3.6886 7.8920 120.2594 64.3702 37.2075 178.1172 78 E 3.8857 8.3881 120.3391 59.2561 29.4683 178.4654 79 M 3.9592 7.9990 118.2116 59.0972 32.1283 177.9137 80 H 4.1528 8.2035 114.8749 58.7668 29.2714 177.3649 81 A 4.1309 8.2306 122.6725 55.3285 18.1630 179.5628 82 Q 3.9875 8.3359 117.8913 59.3157 28.9651 178.2493 83 M 4.1080 7.8808 119.6939 58.0201 32.0205 178.6655 84 S 4.4383 8.2853 115.3098 60.4522 63.0219 176.6019 85 A 3.9007 7.8036 124.5558 54.9995 18.1477 179.4437 86 V 3.4825 7.7578 116.2704 66.4921 31.6059 177.7704 87 N 4.2817 8.3529 116.1642 56.6674 38.3735 177.6338 88 T 3.8868 7.8163 116.7626 66.5333 68.4420 176.9169 89 L 3.9527 8.1919 121.2865 57.6071 41.6065 179.5305 90 V 3.5334 8.0286 118.6104 66.1125 31.2216 178.4074 91 G 3.5942 7.7588 103.7535 47.6093 0.0000 175.2330 92 L 4.1980 7.4217 119.8859 57.0832 41.7911 178.7480 93 L 4.0429 7.8171 120.3729 56.4897 42.1253 177.7847 94 G 4.1224 8.7587 105.3270 44.4466 0.0000 172.6190 95 F 4.5569 6.6673 111.8375 56.2876 39.5775 173.3777 96 I 4.0046 8.5420 123.4081 59.8839 37.2334 174.5050 97 P 4.7569 0.0000 0.0000 62.4100 32.3897 176.7968 98 K 4.3262 8.3839 120.8283 54.4436 32.5369 176.4381 99 V 4.3538 8.0240 116.9443 62.5339 33.3447 175.6707 100 S 4.3177 8.4258 119.0168 58.7223 63.4818 174.0552 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 *12 F 8.32 4.64 0.00 2.32 2.15 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 13 E 8.62 4.02 0.00 2.09 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 0.00 2.38 2.38 0.00 14 L 8.56 4.62 0.00 1.69 1.60 0.91 0.79 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 15 R 8.28 3.93 0.00 1.81 2.00 0.00 3.30 0.00 0.00 3.46 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.68 0.00 16 P 0.00 4.32 0.00 2.14 2.10 0.00 3.53 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 2.11 2.14 0.00 17 V 7.93 3.62 2.19 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 1.01 0.00 0.00 0.92 0.00 0.00 18 I 7.67 3.81 1.96 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 1.44 0.71 0.90 0.00 0.00 19 G 7.98 3.72 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 0.00 0.00 0.00 20 L 7.83 4.05 0.00 1.80 1.74 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.73 4.32 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 1.19 0.00 0.00 22 R 6.94 4.04 0.00 1.95 1.93 0.00 3.19 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 23 G 8.91 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 0.00 0.00 0.00 24 L 7.60 4.35 0.00 1.75 1.60 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.22 4.61 0.00 4.05 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 26 S 8.70 4.12 0.00 4.15 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 0.00 27 A 7.95 4.00 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 28 D 7.86 4.32 0.00 2.85 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 29 I 7.91 3.67 1.98 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 1.39 0.75 0.85 0.00 0.00 30 E 8.51 3.83 0.00 1.99 2.15 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 2.31 2.30 0.00 31 T 7.71 3.85 4.44 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 1.21 0.00 0.00 32 L 8.04 3.99 0.00 1.84 1.69 0.90 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.06 3.80 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 1.09 0.00 0.00 34 A 8.28 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.22 4.24 0.00 2.91 2.87 0.00 0.00 6.94 6.68 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 36 A 8.12 3.98 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 37 I 7.98 3.67 2.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.29 0.92 0.00 0.00 38 R 8.21 3.95 0.00 2.00 1.98 0.00 3.13 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 39 L 8.17 4.08 0.00 1.81 1.85 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.34 4.44 0.00 3.40 3.49 0.00 5.88 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 41 R 7.90 3.83 0.00 2.09 1.94 0.00 3.19 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 42 Q 8.09 4.03 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.71 0.00 43 L 8.25 4.01 0.00 1.78 1.67 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.94 3.91 0.00 1.75 1.64 0.85 0.55 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 45 E 8.13 3.91 0.00 2.08 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 2.31 2.52 0.00 46 K 8.43 4.36 0.00 2.04 1.94 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.48 7.81 47 A 8.08 4.15 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 48 D 8.23 4.37 0.00 3.03 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 49 Q 8.27 4.08 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.70 0.00 50 L 7.83 3.94 0.00 2.03 2.00 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.41 3.75 0.00 3.14 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 52 Q 7.84 3.98 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.80 2.61 0.00 53 V 6.99 3.81 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 0.72 0.00 0.00 1.02 0.00 0.00 54 L 6.73 4.02 0.00 1.16 1.26 0.28 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.35 0.00 2.08 1.95 0.00 3.48 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 2.05 2.11 0.00 56 D 8.48 4.27 0.00 2.63 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 57 D 8.05 4.30 0.00 2.83 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 58 I 7.24 4.58 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.16 0.60 0.00 0.00 59 K 7.69 3.77 0.00 1.72 1.84 0.00 1.48 0.00 0.00 1.41 0.00 0.00 2.43 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.49 1.32 7.81 60 I 7.74 3.97 1.90 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 0.62 0.91 0.00 0.00 61 G 7.22 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 0.00 0.00 0.00 62 T 7.88 4.17 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 63 A 8.24 4.67 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 64 A 8.67 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 65 G 10.11 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 0.00 0.00 0.00 0.00 66 G 8.63 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 67 E 8.68 4.04 0.00 1.99 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 2.31 1.94 0.00 68 Q 8.02 4.22 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 69 H 8.18 4.39 0.00 3.31 3.47 0.00 5.92 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 70 L 8.09 3.95 0.00 1.76 1.70 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 71 E 8.20 3.93 0.00 2.17 2.23 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 2.36 2.35 0.00 72 Y 8.07 4.14 0.00 3.24 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 73 I 8.03 3.49 1.97 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 1.54 0.72 0.86 0.00 0.00 74 E 8.45 3.89 0.00 2.12 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 2.30 2.56 0.00 75 A 7.87 3.93 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 76 M 7.68 3.85 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.79 0.00 77 I 7.89 3.69 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 0.89 0.00 0.00 78 E 8.39 3.89 0.00 2.05 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 2.29 2.30 0.00 79 M 8.00 3.96 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.67 0.00 80 H 8.20 4.15 0.00 3.26 3.32 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.23 4.13 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 82 Q 8.34 3.99 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 83 M 7.88 4.11 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.38 0.00 84 S 8.29 4.44 0.00 4.07 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 0.00 85 A 7.80 3.90 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 86 V 7.76 3.48 2.15 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 1.08 0.00 0.00 0.90 0.00 0.00 87 N 8.35 4.28 0.00 2.73 2.83 0.00 0.00 7.12 7.77 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 88 T 7.82 3.89 4.34 0.00 0.00 0.00 0.00 0.00 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 89 L 8.19 3.95 0.00 1.76 1.65 0.93 1.01 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 90 V 8.03 3.53 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 0.91 0.00 0.00 91 G 7.76 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 92 L 7.42 4.20 0.00 1.75 1.71 0.90 1.15 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 93 L 7.82 4.04 0.00 1.43 1.63 0.69 0.86 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 94 G 8.76 4.12 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 0.00 95 F 6.67 4.56 0.00 3.13 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 96 I 8.54 4.00 1.93 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 1.50 0.84 0.92 0.00 0.00 97 P 0.00 4.76 0.00 2.20 1.96 0.00 3.67 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.83 0.00 98 K 8.38 4.33 0.00 1.80 1.63 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 0.99 7.81 99 V 8.02 4.35 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 1.00 0.00 0.00 0.94 0.00 0.00 100 S 8.43 4.32 0.00 3.85 3.69 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 * Residues marked with a * may have inaccurate shift predictions.