NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 N 4.0622 8.4249 119.1944 53.0606 41.0268 175.0979 9 R 4.9694 8.0174 115.7460 54.6884 31.9442 174.2750 10 T 5.4060 8.3307 107.9364 59.8027 72.4222 173.1449 11 V 4.3052 9.2009 124.3034 61.0736 34.0561 174.3199 12 V 4.6113 8.3176 126.7924 61.0045 33.9373 174.5830 13 V 4.5889 8.2231 126.0619 61.2226 34.7809 173.7620 14 E 4.9937 8.8605 125.6840 54.9179 33.3880 175.2916 15 R 4.5934 8.6363 120.2324 55.0030 35.3285 174.3031 16 Q 4.6832 8.6301 121.9775 54.8120 29.9732 174.9396 17 I 4.4024 8.4467 126.6899 58.5481 39.2831 177.3288 18 S 4.6964 8.0905 124.7650 57.0424 62.4710 173.7123 19 H 4.9301 7.4341 115.3969 53.8884 33.4756 172.4072 20 P 4.4317 0.0000 0.0000 61.9672 32.0597 175.2918 21 P 4.2757 0.0000 0.0000 66.6211 30.6443 178.3618 22 E 4.0386 8.2164 117.5233 59.0161 29.1455 179.2401 23 K 3.9404 7.7723 118.1533 59.3825 32.7885 178.2593 24 L 4.0046 7.9180 120.1529 58.0260 41.8856 178.3425 25 W 4.1875 8.8371 128.5170 60.7407 30.6515 177.8893 26 R 3.8927 7.9901 118.1726 59.2455 29.3295 178.2057 27 A 4.1834 7.7305 119.0323 54.0426 18.5038 178.5462 28 L 4.4190 7.1895 116.0072 55.1618 42.2840 177.0981 29 T 4.1447 7.2587 106.2960 60.7640 70.6260 174.2214 30 Q 4.4235 7.7367 122.7598 53.8541 30.2632 173.9856 31 P 4.1537 0.0000 0.0000 66.3775 31.2782 178.4273 32 H 4.3035 7.9749 112.5291 58.6239 29.0028 177.3433 33 L 4.2827 7.7317 120.4306 57.4492 41.7571 179.0346 34 I 3.3317 8.2936 120.1707 64.2857 36.7773 178.0246 35 E 3.8953 7.8452 118.8286 59.1739 29.3928 178.4768 36 E 4.1501 7.8464 118.2064 58.2181 29.6252 177.6500 37 W 4.7815 7.8039 113.6975 56.2894 30.0069 175.5606 38 L 3.3046 6.8206 119.7620 55.0082 42.4832 175.9374 *40 K 3.9482 8.1201 115.4641 56.2662 33.8390 174.1184 41 N 5.3037 8.1991 120.1284 53.4171 39.5104 173.2932 42 D 4.9481 8.3520 116.5103 52.6410 39.8269 176.1682 43 F 3.2219 7.8185 120.5273 58.8976 40.2352 174.0590 44 K 4.0532 6.0610 124.4499 53.9372 36.0290 176.2142 45 P 4.4747 0.0000 0.0000 62.0589 29.9797 176.7587 46 A 4.6070 7.0367 120.7230 49.8703 22.2848 176.2396 47 V 4.0043 8.4658 123.0577 64.6440 31.9853 176.3168 48 G 4.0279 9.1471 115.6849 45.4019 0.0000 173.2088 49 H 4.3512 8.1724 121.1297 56.3315 30.8918 174.0738 50 R 5.1422 8.3459 124.6919 54.6700 32.1614 175.2830 51 F 5.0543 8.2936 117.5224 55.9883 42.1162 172.4817 52 N 5.3876 10.2657 114.9876 51.5661 42.9595 173.9418 53 I 4.9562 8.0667 121.1821 59.5629 40.4800 174.8872 54 S 4.8092 8.6710 120.3122 56.6135 66.2607 173.3734 55 A 4.3939 8.1787 123.5630 50.3251 20.7686 178.1426 56 D 4.2197 8.5297 118.7372 56.7074 41.0075 177.8817 57 W 4.5288 7.4753 113.8434 56.0413 28.7839 175.8961 58 G 3.7758 7.2680 109.9467 45.8885 0.0000 175.2548 59 G 3.2230 5.8425 107.1898 46.5041 0.0000 173.0364 60 V 4.8775 7.8660 121.0418 59.9177 34.7221 173.8201 61 L 4.7902 9.1611 123.4698 53.0278 45.3110 174.9050 62 D 5.0087 8.6836 121.9999 52.9056 43.1800 175.4374 63 C 5.1387 8.2513 119.9131 58.1472 33.4317 172.7193 64 E 5.1007 8.8092 119.8857 55.0284 33.2250 174.3148 65 V 4.4750 9.4074 128.5277 63.7893 32.0713 176.0110 66 L 4.5513 9.6265 128.1555 56.2496 43.1530 176.9858 67 A 4.8738 7.9479 118.5105 50.3805 23.0749 175.5732 68 V 4.9284 8.4869 120.1477 61.7957 34.5159 174.3862 69 E 4.5305 9.6850 130.2340 53.6897 31.5595 171.9689 70 P 2.9700 0.0000 0.0000 62.0412 31.2897 176.1870 71 N 3.8814 5.7700 118.4661 53.7037 36.9432 173.7970 72 K 4.5234 7.8561 115.7012 57.6413 34.8253 176.1093 73 T 5.4275 7.7280 115.0788 61.9601 73.4421 172.4339 74 L 5.4507 9.0556 126.2098 53.9897 45.9244 174.7135 75 S 5.2680 9.4669 120.2908 57.2236 66.3553 171.9709 76 Y 5.6513 8.4248 122.3023 56.2039 41.4582 173.9672 77 T 4.6640 8.8351 111.6883 62.1993 70.2095 174.8817 78 W 5.0983 9.0872 132.2280 56.5792 32.6814 172.5906 79 N 5.4863 9.2952 122.5949 50.8850 42.6889 173.2128 80 L 4.8959 8.9936 122.6375 53.5126 45.4062 174.9341 81 A 5.0222 8.7052 128.8498 51.7888 18.1462 175.7794 82 H 4.7149 9.2409 121.1114 54.9462 33.3280 174.6616 83 Q 4.2404 8.7875 123.8545 58.7598 29.0769 176.5851 84 D 4.6942 8.1547 118.3310 52.6042 41.7091 175.0575 85 P 4.2920 0.0000 0.0000 65.7161 31.3974 178.3661 86 A 4.2169 8.5517 121.0821 53.7520 18.2955 177.8277 87 F 4.8141 7.8520 112.5738 58.1425 40.5887 176.9436 88 D 4.8796 7.7618 118.2835 54.0786 39.5380 174.0897 89 L 4.5958 8.9458 126.3940 53.7660 44.2208 175.3684 90 R 5.6797 8.7447 123.8298 53.9103 33.9529 174.0157 91 S 4.7708 8.9967 118.2868 56.6661 67.5919 172.8082 92 V 4.8194 8.5612 119.3955 61.0389 34.4615 174.0349 93 V 4.3525 8.6706 127.9141 61.3488 33.5422 174.4014 94 T 4.9032 8.3887 124.3182 61.7858 71.8706 173.2067 95 F 4.9164 9.3912 125.7514 56.2158 41.4554 174.9564 96 T 4.9117 9.0553 120.5594 61.8637 71.2687 172.8851 97 L 5.0777 8.9510 127.7651 53.5179 43.4485 176.3993 98 T 4.5323 8.8365 121.2675 60.8446 71.0888 171.9638 99 P 4.8604 0.0000 0.0000 63.1099 32.1205 175.9980 100 T 4.7421 8.7478 112.3244 58.9985 72.2381 173.0666 101 P 4.2061 0.0000 0.0000 65.5758 31.2936 177.7808 102 T 4.4672 7.6535 106.3495 60.9211 70.9872 176.1817 103 G 4.4316 6.5611 114.7622 46.6476 0.0000 175.5836 104 T 5.0699 8.0853 121.3166 61.9843 73.3145 170.8072 105 H 4.9913 9.3318 126.1810 54.7420 31.7663 173.2204 106 L 5.0077 8.7155 128.1840 53.4348 44.5559 175.1636 107 R 5.2385 8.3502 126.3203 53.3748 34.2078 172.9145 *109 E 4.2534 8.4837 118.4281 56.1185 31.2357 174.6783 110 Q 5.5300 9.1968 128.2952 53.3975 31.7303 174.1327 111 S 5.1626 8.5027 120.4521 56.9021 66.7274 174.1832 112 G 4.0101 8.5000 107.0651 45.8446 0.0000 174.4477 113 F 4.4430 8.1816 120.4723 57.3795 39.7192 175.1290 114 R 4.6170 9.1803 125.0343 54.2521 31.2088 175.9588 115 P 4.1715 0.0000 0.0000 65.2739 31.4300 176.5219 116 D 4.6575 8.0448 117.7211 54.2718 41.8766 175.8121 117 Q 4.8315 7.9607 116.3683 55.1284 29.3674 177.2589 118 R 3.9493 7.8005 117.2619 59.3690 29.9636 178.2865 119 R 3.8674 7.9289 118.7936 59.0427 30.1231 178.2921 120 A 4.1242 7.9429 120.2059 55.2384 18.6329 178.7169 121 Y 2.6546 7.8974 118.1667 60.4945 38.6158 178.7173 122 G 3.6756 8.3280 105.7260 47.6190 0.0000 175.5832 123 G 3.7431 8.0157 107.0591 47.4384 0.0000 175.4339 124 A 4.2584 8.0146 123.3120 54.6585 18.1963 180.1907 125 K 3.7938 7.1693 111.5984 58.0848 32.4738 178.0011 *127 G 3.6604 7.9523 110.0115 45.8673 0.0000 175.4914 128 W 4.2693 7.9094 120.7716 59.1390 28.7343 176.7085 129 P 4.4060 0.0000 0.0000 65.6374 31.1670 178.1575 130 Q 4.0782 7.7189 117.7451 59.2265 29.1011 177.8864 131 F 4.7134 7.7884 118.7979 61.0466 38.9670 177.7937 132 F 4.7173 8.7796 117.4967 60.3580 38.6438 177.7111 133 E 4.0768 8.2422 118.3291 59.5106 29.2513 179.5027 134 K 4.1991 8.2649 118.0018 59.0881 32.1745 179.1383 135 L 3.8854 8.2771 120.9943 58.2701 42.0075 178.9583 136 E 3.9994 8.6433 118.9619 59.1202 29.2454 179.1590 137 Q 3.9450 8.1549 119.8066 59.1474 28.9787 177.9250 138 L 4.0037 7.9328 120.0646 58.1854 42.3664 178.7980 139 L 4.0164 7.9174 118.7025 58.0493 41.7985 179.1947 140 D 4.7291 8.6183 119.2682 57.1249 40.4935 178.3294 141 R 4.3067 7.6509 114.0085 57.3125 29.6924 177.5578 142 T 4.3006 7.8115 109.9328 61.8009 69.8528 174.6149 143 D 4.6725 7.2370 121.5391 53.4269 41.8853 176.3678 144 L 4.1771 8.4002 120.6922 55.2747 41.5765 177.2076 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 8 N 8.42 4.06 0.00 2.58 2.84 0.00 0.00 6.97 6.77 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 9 R 8.02 4.97 0.00 1.96 2.03 0.00 3.42 0.00 0.00 3.36 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.56 0.00 10 T 8.33 5.41 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 1.27 0.00 0.00 11 V 9.20 4.31 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 0.11 0.00 0.00 12 V 8.32 4.61 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 0.80 0.00 0.00 0.90 0.00 0.00 13 V 8.22 4.59 2.24 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 1.29 0.00 0.00 0.97 0.00 0.00 14 E 8.86 4.99 0.00 1.84 1.71 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 2.19 2.30 0.00 15 R 8.64 4.59 0.00 1.35 1.61 0.00 3.45 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 16 Q 8.63 4.68 0.00 1.91 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 17 I 8.45 4.40 1.90 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.46 0.91 0.00 0.00 18 S 8.09 4.70 0.00 3.89 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 19 H 7.43 4.93 0.00 3.09 3.16 0.00 5.71 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.43 0.00 2.44 2.19 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 21 P 0.00 4.28 0.00 2.27 2.38 0.00 3.71 0.00 0.00 3.77 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 22 E 8.22 4.04 0.00 2.10 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 0.00 2.40 2.60 0.00 23 K 7.77 3.94 0.00 1.81 1.97 0.00 1.66 0.00 0.00 1.48 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.43 7.81 24 L 7.92 4.00 0.00 1.76 1.82 0.69 0.85 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 25 W 8.84 4.19 0.00 3.50 3.29 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 0.00 26 R 7.99 3.89 0.00 2.07 2.11 0.00 3.19 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 27 A 7.73 4.18 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 28 L 7.19 4.42 0.00 1.17 1.18 0.61 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 29 T 7.26 4.14 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 0.13 0.00 0.00 30 Q 7.74 4.42 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 31 P 0.00 4.15 0.00 2.05 2.07 0.00 3.49 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.40 0.00 32 H 7.97 4.30 0.00 3.09 3.33 0.00 5.71 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.73 4.28 0.00 1.89 1.82 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.29 3.33 1.90 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.59 0.41 0.00 0.00 35 E 7.85 3.90 0.00 1.96 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 2.25 2.35 0.00 36 E 7.85 4.15 0.00 2.28 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 0.00 2.37 2.58 0.00 37 W 7.80 4.78 0.00 3.90 3.27 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 38 L 6.82 3.30 0.00 0.27 0.56 -0.40 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 *40 K 8.12 3.95 0.00 1.79 1.77 0.00 1.63 0.00 0.00 1.92 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.41 7.81 41 N 8.20 5.30 0.00 2.80 2.60 0.00 0.00 6.18 8.06 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 42 D 8.35 4.95 0.00 2.76 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 43 F 7.82 3.22 0.00 2.14 2.58 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 44 K 6.06 4.05 0.00 0.79 1.15 0.00 1.54 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.07 1.09 7.81 45 P 0.00 4.47 0.00 2.10 2.21 0.00 3.46 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.45 0.00 46 A 7.04 4.61 1.13 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 47 V 8.47 4.00 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 0.93 0.00 0.00 1.02 0.00 0.00 48 G 9.15 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 49 H 8.17 4.35 0.00 3.21 3.22 0.00 5.56 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.35 5.14 0.00 1.64 1.74 0.00 3.23 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.76 0.00 51 F 8.29 5.05 0.00 3.40 3.07 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 0.00 0.00 0.00 0.00 52 N 10.27 5.39 0.00 2.58 2.56 0.00 0.00 7.22 7.42 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 53 I 8.07 4.96 1.42 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.56 0.00 0.00 54 S 8.67 4.81 0.00 3.65 3.57 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 55 A 8.18 4.39 0.41 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 56 D 8.53 4.22 0.00 2.74 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 57 W 7.48 4.53 0.00 3.54 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 58 G 7.27 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 59 G 5.84 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 0.00 0.00 0.00 60 V 7.87 4.88 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 0.60 0.00 0.00 0.83 0.00 0.00 61 L 9.16 4.79 0.00 1.02 1.06 -0.28 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.68 5.01 0.00 2.47 2.44 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 0.00 63 C 8.25 5.14 0.00 1.23 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 64 E 8.81 5.10 0.00 2.00 1.78 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 2.30 2.48 0.00 65 V 9.41 4.48 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 1.24 0.00 0.00 1.03 0.00 0.00 66 L 9.63 4.55 0.00 1.66 1.79 0.99 1.05 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 67 A 7.95 4.87 1.29 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 0.00 0.00 0.00 68 V 8.49 4.93 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 1.16 0.00 0.00 1.14 0.00 0.00 69 E 9.68 4.53 0.00 2.03 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 2.08 2.20 0.00 70 P 0.00 2.97 0.00 1.81 1.62 0.00 3.77 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 1.95 2.14 0.00 71 N 5.77 3.88 0.00 2.54 2.73 0.00 0.00 6.94 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 72 K 7.86 4.52 0.00 1.70 1.84 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.27 1.24 7.81 73 T 7.73 5.43 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 1.33 0.00 0.00 74 L 9.06 5.45 0.00 1.90 1.72 1.38 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 75 S 9.47 5.27 0.00 3.95 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 76 Y 8.42 5.65 0.00 3.35 3.38 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 77 T 8.84 4.66 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 1.29 0.00 0.00 78 W 9.09 5.10 0.00 3.67 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 79 N 9.30 5.49 0.00 2.64 2.79 0.00 0.00 6.28 6.34 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 80 L 8.99 4.90 0.00 1.68 1.58 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.71 5.02 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 82 H 9.24 4.71 0.00 3.30 3.23 0.00 5.60 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.79 4.24 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 84 D 8.15 4.69 0.00 3.01 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 85 P 0.00 4.29 0.00 2.27 2.34 0.00 3.80 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 86 A 8.55 4.22 1.04 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 87 F 7.85 4.81 0.00 2.98 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 88 D 7.76 4.88 0.00 3.23 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 89 L 8.95 4.60 0.00 2.02 1.67 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.74 5.68 0.00 1.76 1.79 0.00 3.43 0.00 0.00 3.37 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.51 0.00 91 S 9.00 4.77 0.00 3.52 3.44 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 0.00 92 V 8.56 4.82 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 0.98 0.00 0.00 0.94 0.00 0.00 93 V 8.67 4.35 1.76 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 0.05 0.00 0.00 0.61 0.00 0.00 94 T 8.39 4.90 4.07 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 0.00 0.00 0.00 1.18 0.00 0.00 95 F 9.39 4.92 0.00 2.96 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 96 T 9.06 4.91 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 1.24 0.00 0.00 97 L 8.95 5.08 0.00 1.69 1.65 1.17 1.12 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 T 8.84 4.53 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 1.19 0.00 0.00 99 P 0.00 4.86 0.00 1.92 1.98 0.00 3.61 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 100 T 8.75 4.74 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 0.00 101 P 0.00 4.21 0.00 2.05 2.16 0.00 3.65 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 2.02 2.07 0.00 102 T 7.65 4.47 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 1.20 0.00 0.00 103 G 6.56 4.43 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 0.00 104 T 8.09 5.07 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 1.23 0.00 0.00 105 H 9.33 4.99 0.00 3.13 3.25 0.00 5.54 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.72 5.01 0.00 1.53 1.13 0.91 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.35 5.24 0.00 1.94 1.76 0.00 3.20 0.00 0.00 3.19 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.34 0.00 *109 E 8.48 4.25 0.00 1.98 1.68 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 2.18 2.24 0.00 110 Q 9.20 5.53 0.00 1.76 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.43 0.00 0.00 0.00 0.00 0.00 2.00 1.79 0.00 111 S 8.50 5.16 0.00 3.88 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 0.00 112 G 8.50 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 113 F 8.18 4.44 0.00 3.54 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 0.00 114 R 9.18 4.62 0.00 2.07 1.86 0.00 3.17 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 115 P 0.00 4.17 0.00 2.14 2.15 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 116 D 8.04 4.66 0.00 2.72 2.65 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 0.00 117 Q 7.96 4.83 0.00 2.37 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 118 R 7.80 3.95 0.00 2.00 2.13 0.00 2.94 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 119 R 7.93 3.87 0.00 1.82 1.94 0.00 3.59 0.00 0.00 3.47 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 120 A 7.94 4.12 1.70 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 0.00 121 Y 7.90 2.65 0.00 2.65 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 0.00 122 G 8.33 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 0.00 123 G 8.02 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 0.00 0.00 0.00 124 A 8.01 4.26 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.17 3.79 0.00 1.81 1.63 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.41 7.81 *127 G 7.95 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 0.00 0.00 0.00 128 W 7.91 4.27 0.00 3.43 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 0.00 129 P 0.00 4.41 0.00 2.03 2.19 0.00 3.66 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 130 Q 7.72 4.08 0.00 1.96 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 131 F 7.79 4.71 0.00 3.36 3.56 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 0.00 132 F 8.78 4.72 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 0.00 133 E 8.24 4.08 0.00 2.34 2.08 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 2.62 2.55 0.00 134 K 8.26 4.20 0.00 2.29 2.10 0.00 2.08 0.00 0.00 1.91 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.66 1.80 7.81 135 L 8.28 3.89 0.00 1.27 1.71 0.22 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.64 4.00 0.00 2.20 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 2.29 2.55 0.00 137 Q 8.15 3.95 0.00 2.28 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 138 L 7.93 4.00 0.00 1.77 2.02 1.04 1.29 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 0.00 139 L 7.92 4.02 0.00 1.83 1.30 0.83 1.01 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 0.00 140 D 8.62 4.73 0.00 2.70 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 0.00 141 R 7.65 4.31 0.00 1.96 2.07 0.00 3.09 0.00 0.00 3.30 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.63 0.00 142 T 7.81 4.30 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 0.00 143 D 7.24 4.67 0.00 2.76 2.65 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 0.00 144 L 8.40 4.18 0.00 1.64 1.60 0.93 0.84 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 * Residues marked with a * may have inaccurate shift predictions.