NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3521 8.0276 120.6284 54.8347 44.0044 178.7224 32 E 3.8797 8.1002 116.9004 58.4798 28.9021 175.5797 33 E 3.9402 8.3664 120.4807 58.8218 29.9872 178.9107 34 Q 4.1829 8.4260 118.1111 57.4366 29.1878 176.9644 35 L 4.2433 7.6767 119.3110 57.2075 41.4939 178.2667 36 N 4.4696 8.0600 115.6829 55.3609 38.7991 176.6206 37 K 4.3326 7.3321 115.5667 57.2053 32.2644 178.0864 38 S 4.5516 7.6211 115.4364 60.5855 63.4711 175.7209 39 L 4.0675 7.8215 121.7444 56.8550 41.4277 178.9191 40 K 3.8516 8.0014 117.2723 60.4154 31.9621 179.3021 41 T 3.8953 8.0506 114.9303 66.7208 68.2445 176.3195 42 I 4.1795 7.4935 122.0345 63.2104 37.3550 177.7268 43 A 4.2151 8.4110 118.6419 53.5531 18.2624 178.2734 44 S 4.4361 7.7733 112.0638 60.3929 62.7010 176.1055 45 Q 3.9852 7.6387 119.2423 58.3936 28.3836 178.8210 46 K 3.9933 8.2095 119.8186 59.2710 32.0081 179.2420 47 A 3.9226 7.9473 120.2178 55.2378 18.5611 179.0113 48 A 3.8065 8.4328 119.7754 55.6818 17.8472 179.5612 49 I 4.1251 7.6531 116.8176 63.1258 37.5245 178.1109 50 E 4.0211 8.0858 120.8161 59.1017 29.4726 178.5506 51 N 4.3115 9.0962 117.7181 56.6475 38.8117 176.9434 52 Y 4.0538 7.7455 119.2110 60.2415 38.9045 177.2523 53 N 4.6206 8.0150 115.6251 54.2452 39.0797 176.4591 54 Q 4.4457 7.8716 117.3946 57.1382 29.3935 177.0674 55 L 4.2351 7.5808 122.7984 57.4162 42.4402 178.0445 56 K 3.8721 7.5048 118.9505 58.7895 31.5336 178.0737 57 E 4.0519 7.7601 118.4287 59.0754 29.8024 177.4503 58 D 4.5531 8.5992 117.7578 55.2623 41.1934 178.1106 59 Y 4.1163 7.6638 120.5869 60.9324 38.9421 177.1750 60 N 4.2595 8.0415 115.9893 56.2578 38.3081 177.3476 61 T 3.8476 7.3453 117.8075 66.7473 68.4767 176.3156 62 L 3.8057 7.4463 119.1654 57.8004 41.8047 179.4427 63 K 3.6907 7.3953 118.0911 59.5649 31.6340 179.4662 64 R 3.9245 7.4186 117.8586 59.2014 30.3564 178.6240 65 E 4.9133 7.5570 118.4859 58.5181 29.5491 178.7152 66 L 3.9777 8.0614 122.0072 57.7708 41.9657 178.0928 67 S 4.2951 7.8838 112.0048 59.8913 62.4937 174.6915 68 D 4.4286 7.7755 120.4680 55.8884 41.0201 177.8844 69 R 4.3580 7.7644 118.3540 57.7119 30.8829 177.8986 70 D 4.6359 7.9187 117.6112 56.2686 40.9229 177.9957 71 D 4.3089 7.5967 119.0505 57.0959 41.1666 178.0028 72 E 3.8980 7.6738 117.7125 59.5781 29.7074 179.2770 73 V 3.3247 8.1630 118.5981 66.0077 31.2577 177.6946 74 K 4.2335 7.9198 116.0981 57.8922 32.1220 178.6850 75 R 4.2225 8.0299 118.7588 58.4080 30.3659 178.5283 76 L 4.2861 8.7004 119.6865 57.1858 41.6988 178.6615 77 R 4.1044 7.7329 115.8792 57.7469 30.0879 177.3698 78 E 4.3252 7.7144 117.3293 59.4463 30.4004 177.3145 79 D 4.4079 7.5762 118.3503 58.4921 40.9320 178.5766 80 I 3.6335 7.9185 119.4733 64.0303 36.7215 177.7760 81 A 3.9877 7.9441 123.5856 56.4387 18.6315 178.6804 82 K 3.9712 8.6174 118.6349 58.3511 31.9861 178.3797 83 E 3.9226 8.6044 118.0926 59.9888 29.5070 179.4048 84 N 4.2953 8.5840 116.4698 56.2560 38.4762 176.7978 85 E 4.7475 8.3055 120.4493 57.3845 29.5457 178.4647 86 L 4.0852 7.7525 118.6387 56.6246 41.8161 178.1626 87 R 4.3372 8.0213 116.1263 57.1989 30.5712 178.3389 88 T 4.0621 7.4785 116.2864 66.4973 68.4149 176.8429 89 K 4.4954 7.9584 121.1508 58.5828 31.8980 178.6485 90 A 5.0266 7.3680 118.4385 52.3496 18.1580 177.7397 91 E 4.5132 7.7216 118.1739 56.4295 31.0117 177.0008 92 E 4.3395 7.8704 117.8195 58.4440 30.3644 177.9612 93 E 4.2336 8.5994 118.0380 59.1410 29.4650 179.1838 94 A 3.9980 7.8640 121.3917 54.8941 18.4072 178.1080 95 D 4.6344 7.3640 113.4018 54.8798 41.5492 176.4953 96 K 4.4172 7.4985 115.8359 58.9178 34.0983 178.2294 97 L 4.0756 8.1764 119.2418 57.5496 40.0624 178.5579 98 N 4.7154 7.9780 114.5084 53.8919 38.5118 176.1310 99 K 4.1226 7.5573 118.2382 56.0390 32.9880 176.3059 100 E 4.4137 7.7243 120.4210 57.6174 30.7044 177.7617 101 V 3.6412 7.8052 118.4428 65.6660 31.5351 177.5143 102 E 3.9409 7.7313 118.3503 58.7558 29.2175 178.3305 103 D 4.4380 7.6177 118.1880 56.9316 41.3934 178.6807 104 L 3.7901 7.7811 118.9716 57.8954 41.6833 179.5241 105 T 3.8987 8.3364 116.0881 66.6124 68.2184 176.6204 106 A 4.0559 7.7733 122.6005 54.9394 18.4329 179.1618 107 S 4.6312 8.8094 112.6341 59.3023 62.3983 175.7638 108 L 4.1571 7.9868 123.1130 58.3608 41.9560 178.0541 109 F 4.0637 8.0782 119.8354 61.0516 38.9893 176.5185 110 D 4.4729 7.7474 116.8351 56.9083 41.2373 178.5195 111 E 3.9809 7.9082 117.2773 58.9996 29.4025 179.1671 112 A 4.0191 8.2300 121.2969 54.6945 18.2829 179.5346 113 N 4.1143 7.3645 115.1683 56.6777 38.7234 177.2550 114 N 4.2704 7.8411 117.6421 56.3513 38.5621 177.0679 115 L 3.8959 7.8074 121.3942 58.0784 42.1980 178.9701 116 V 3.5707 8.0243 117.9474 66.2208 31.1064 177.7259 117 A 4.0205 7.9551 120.1187 54.9971 18.4365 178.8319 118 D 4.3925 8.0765 115.5865 56.9891 41.7395 177.6994 119 A 4.1057 8.1366 122.4089 54.6221 18.7728 180.1426 120 R 4.4758 8.1195 114.8773 55.2896 28.6002 178.4588 *122 E 4.3226 8.1810 119.7264 57.1493 31.6188 177.3235 123 K 3.8060 8.0037 117.1520 58.8284 32.1835 177.2961 124 Y 4.3526 8.2418 113.8223 57.7884 38.2764 176.9089 125 A 4.3982 7.8921 123.2209 53.7577 19.3459 178.7538 126 I 4.1316 7.0553 115.2213 61.8742 37.7764 177.1458 127 E 4.1934 7.6803 120.8236 58.6197 30.0348 177.9158 128 I 3.9852 7.2154 111.6679 62.5002 37.2935 177.5936 129 L 4.0505 7.3228 119.9127 57.6024 41.5230 177.3559 130 N 4.7060 7.9287 114.9079 53.8443 38.9374 177.1758 131 K 4.0723 7.7746 121.1567 59.3250 31.7662 179.1397 132 R 4.1239 7.8808 117.2281 58.1823 29.9782 178.3541 133 L 4.2621 7.2309 118.9183 58.3361 42.2371 178.9168 134 T 4.0579 7.4833 114.4360 66.5641 68.4127 176.8772 135 E 4.0542 7.9152 119.9176 59.5877 29.4453 179.3396 136 Q 4.1063 9.1828 116.4304 57.5599 28.7949 176.7888 137 L 4.6522 7.3074 117.8497 54.4505 43.1567 176.4950 138 R 4.2753 8.1783 118.5982 58.4189 30.5874 177.6648 139 E 4.1201 8.1102 114.1925 57.5362 30.1370 176.9564 140 K 4.3270 7.8993 118.8022 56.7970 33.2378 175.9453 141 D 4.8522 7.4198 118.6012 54.4351 41.6319 178.0389 *143 L 4.1507 7.9483 122.8215 55.0565 43.7065 178.0894 144 L 4.2035 7.8634 118.2386 57.0475 42.2724 176.9686 145 D 4.6071 7.3512 114.7925 56.1817 41.3109 177.4901 146 T 4.2610 7.5862 114.3618 64.9840 69.4428 174.6385 147 L 4.1714 8.3153 125.5828 54.9684 41.5376 176.6534 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 31 L 8.03 4.35 0.00 1.72 1.78 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.10 3.88 0.00 2.27 2.22 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 2.36 2.42 0.00 33 E 8.37 3.94 0.00 2.10 1.98 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 2.37 2.42 0.00 34 Q 8.43 4.18 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 35 L 7.68 4.24 0.00 1.73 1.69 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.06 4.47 0.00 2.75 2.86 0.00 0.00 6.89 8.26 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 37 K 7.33 4.33 0.00 1.77 1.84 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.40 7.81 38 S 7.62 4.55 0.00 4.04 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 39 L 7.82 4.07 0.00 1.82 1.64 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.00 3.85 0.00 1.81 1.89 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.51 7.81 41 T 8.05 3.90 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 42 I 7.49 4.18 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.45 0.91 0.00 0.00 43 A 8.41 4.22 1.32 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 0.00 0.00 0.00 44 S 7.77 4.44 0.00 3.97 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 45 Q 7.64 3.99 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 46 K 8.21 3.99 0.00 1.81 1.86 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.66 7.81 47 A 7.95 3.92 1.32 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 0.00 0.00 0.00 48 A 8.43 3.81 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 49 I 7.65 4.13 1.98 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.23 0.94 0.00 0.00 50 E 8.09 4.02 0.00 2.35 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 2.31 2.40 0.00 51 N 9.10 4.31 0.00 2.73 2.87 0.00 0.00 6.66 7.36 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 52 Y 7.75 4.05 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 53 N 8.01 4.62 0.00 2.98 2.87 0.00 0.00 6.59 7.62 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 54 Q 7.87 4.45 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 55 L 7.58 4.24 0.00 1.74 1.61 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.50 3.87 0.00 1.48 1.59 0.00 1.37 0.00 0.00 1.18 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.45 7.81 57 E 7.76 4.05 0.00 2.34 2.03 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 2.30 2.34 0.00 58 D 8.60 4.55 0.00 2.77 2.68 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 59 Y 7.66 4.12 0.00 2.96 3.06 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 60 N 8.04 4.26 0.00 2.84 2.85 0.00 0.00 7.12 6.93 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 61 T 7.35 3.85 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 1.18 0.00 0.00 62 L 7.45 3.81 0.00 1.80 1.58 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.40 3.69 0.00 1.44 1.76 0.00 1.43 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.08 7.81 64 R 7.42 3.92 0.00 1.82 1.95 0.00 3.15 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 65 E 7.56 4.91 0.00 2.22 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 0.00 2.31 2.12 0.00 66 L 8.06 3.98 0.00 1.72 1.63 0.89 0.63 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 67 S 7.88 4.30 0.00 3.96 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 68 D 7.78 4.43 0.00 2.82 2.66 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 69 R 7.76 4.36 0.00 1.92 1.94 0.00 3.27 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 70 D 7.92 4.64 0.00 2.67 2.70 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 71 D 7.60 4.31 0.00 3.06 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 72 E 7.67 3.90 0.00 2.25 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 2.51 2.45 0.00 73 V 8.16 3.32 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 1.03 0.00 0.00 0.95 0.00 0.00 74 K 7.92 4.23 0.00 1.83 1.84 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.58 7.81 75 R 8.03 4.22 0.00 2.03 1.95 0.00 3.11 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 76 L 8.70 4.29 0.00 1.68 1.70 0.92 0.78 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 77 R 7.73 4.10 0.00 1.99 1.95 0.00 3.29 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 78 E 7.71 4.33 0.00 2.28 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 2.33 2.55 0.00 79 D 7.58 4.41 0.00 2.68 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 80 I 7.92 3.63 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.95 0.91 0.00 0.00 81 A 7.94 3.99 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 82 K 8.62 3.97 0.00 1.91 1.92 0.00 1.55 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.52 7.81 83 E 8.60 3.92 0.00 2.14 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 2.34 2.47 0.00 84 N 8.58 4.30 0.00 2.99 2.87 0.00 0.00 7.02 7.23 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 85 E 8.31 4.75 0.00 2.13 1.98 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 2.30 2.29 0.00 86 L 7.75 4.09 0.00 1.84 1.70 0.92 0.96 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 87 R 8.02 4.34 0.00 1.77 1.97 0.00 3.32 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 88 T 7.48 4.06 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 1.21 0.00 0.00 89 K 7.96 4.50 0.00 2.07 1.85 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.48 7.81 90 A 7.37 5.03 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 91 E 7.72 4.51 0.00 2.17 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 2.20 2.29 0.00 92 E 7.87 4.34 0.00 2.15 1.96 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 2.34 2.69 0.00 93 E 8.60 4.23 0.00 2.16 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 0.00 2.46 2.32 0.00 94 A 7.86 4.00 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 95 D 7.36 4.63 0.00 2.87 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 96 K 7.50 4.42 0.00 1.94 1.78 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.66 7.81 97 L 8.18 4.08 0.00 1.76 1.71 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 98 N 7.98 4.72 0.00 3.11 2.83 0.00 0.00 6.74 7.53 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 99 K 7.56 4.12 0.00 1.77 1.79 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.57 7.81 100 E 7.72 4.41 0.00 2.11 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 0.00 2.29 2.33 0.00 101 V 7.81 3.64 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 1.02 0.00 0.00 1.00 0.00 0.00 102 E 7.73 3.94 0.00 2.25 1.93 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 2.29 2.33 0.00 103 D 7.62 4.44 0.00 2.92 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 0.00 104 L 7.78 3.79 0.00 1.70 1.73 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.34 3.90 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 1.19 0.00 0.00 106 A 7.77 4.06 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 0.00 107 S 8.81 4.63 0.00 3.91 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 0.00 108 L 7.99 4.16 0.00 2.00 1.86 0.94 0.63 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 0.00 109 F 8.08 4.06 0.00 3.25 3.23 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 0.00 110 D 7.75 4.47 0.00 2.82 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 0.00 111 E 7.91 3.98 0.00 2.16 1.99 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 2.51 2.47 0.00 112 A 8.23 4.02 1.24 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 0.00 0.00 113 N 7.36 4.11 0.00 2.73 2.78 0.00 0.00 6.89 6.80 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 0.00 114 N 7.84 4.27 0.00 2.80 2.86 0.00 0.00 6.74 7.98 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 0.00 115 L 7.81 3.90 0.00 1.87 1.77 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.02 3.57 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 0.91 0.00 0.00 0.89 0.00 0.00 117 A 7.96 4.02 1.32 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 0.00 0.00 0.00 118 D 8.08 4.39 0.00 2.81 2.71 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 0.00 0.00 0.00 0.00 119 A 8.14 4.11 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 0.00 120 R 8.12 4.48 0.00 1.93 2.17 0.00 2.49 0.00 0.00 2.96 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.48 0.00 *122 E 8.18 4.32 0.00 2.07 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 0.00 2.28 2.35 0.00 123 K 8.00 3.81 0.00 2.18 1.93 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.66 7.81 124 Y 8.24 4.35 0.00 3.15 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 0.00 125 A 7.89 4.40 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 0.00 126 I 7.06 4.13 1.84 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.88 0.89 0.00 0.00 127 E 7.68 4.19 0.00 1.82 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 2.11 2.30 0.00 128 I 7.22 3.99 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.61 1.02 0.00 0.00 129 L 7.32 4.05 0.00 1.84 1.84 0.92 0.57 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 0.00 130 N 7.93 4.71 0.00 2.99 2.80 0.00 0.00 6.87 7.64 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 0.00 131 K 7.77 4.07 0.00 2.09 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 132 R 7.88 4.12 0.00 1.82 1.97 0.00 3.30 0.00 0.00 3.26 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.62 0.00 133 L 7.23 4.26 0.00 1.76 1.77 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.48 4.06 4.45 0.00 0.00 0.00 0.00 0.00 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 0.00 135 E 7.92 4.05 0.00 2.01 1.99 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 2.57 2.49 0.00 136 Q 9.18 4.11 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 137 L 7.31 4.65 0.00 1.76 1.60 0.92 0.89 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 0.00 138 R 8.18 4.28 0.00 2.10 1.89 0.00 3.14 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 139 E 8.11 4.12 0.00 2.11 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 0.00 2.38 2.29 0.00 140 K 7.90 4.33 0.00 1.73 1.99 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.44 7.81 141 D 7.42 4.85 0.00 2.91 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 *143 L 7.95 4.15 0.00 1.84 1.75 0.92 0.50 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 0.00 144 L 7.86 4.20 0.00 1.62 1.67 0.92 1.18 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 0.00 145 D 7.35 4.61 0.00 2.77 2.70 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 0.00 146 T 7.59 4.26 4.37 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 1.21 0.00 0.00 147 L 8.32 4.17 0.00 1.59 1.58 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.