NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 E 4.5148 8.3448 119.6353 55.5952 30.9615 174.2849 30 N 4.8635 7.3337 116.4709 50.6796 44.0648 173.2610 31 P 4.7904 0.0000 0.0000 62.5499 32.3574 176.0173 32 A 3.9809 8.4333 126.7628 51.8287 18.7614 175.7709 33 P 4.2300 0.0000 0.0000 62.4356 32.1267 175.7546 34 D 4.5536 8.4379 121.6975 53.7746 42.2992 175.0051 35 F 5.1371 7.5590 118.6110 56.0382 42.1899 173.4445 36 T 4.7276 8.7097 114.8062 62.2537 71.2958 173.3742 37 L 4.9883 8.7434 125.8576 52.4258 46.1598 176.5226 38 N 5.0217 8.7653 118.4608 53.9574 38.9351 173.9114 39 T 5.1784 8.1274 115.1335 59.4201 70.1051 175.2890 40 L 4.3095 8.7380 123.1641 56.6093 41.8504 177.4880 41 N 4.9902 7.7261 114.1993 52.4163 37.4246 175.5449 42 G 3.9570 8.6608 107.8685 46.2480 0.0000 173.9554 43 E 4.4784 7.8380 119.1913 55.6589 31.6970 175.1944 44 V 4.9276 8.1191 118.9201 61.4985 35.4328 174.9864 45 V 4.3657 8.4751 124.2812 61.3153 34.4036 173.9189 46 K 4.8126 8.5304 129.0801 54.5770 33.8655 176.8285 47 L 3.6308 8.0141 128.0335 58.1049 42.3073 179.1153 48 S 4.0499 8.0232 114.3607 61.8722 62.8002 175.7883 49 D 4.5872 7.4920 116.6526 55.4506 40.6429 176.6118 50 L 4.5010 7.9619 119.6013 54.0238 42.3329 176.7141 51 K 4.2613 7.3288 119.0653 57.7886 32.4240 177.1780 52 G 3.9985 9.5271 111.2414 45.0579 0.0000 173.5672 53 Q 4.8668 7.7649 118.1655 53.8772 32.3055 175.1750 54 V 4.4537 7.8608 120.4595 61.0681 33.6547 175.1678 55 V 5.1626 8.3098 122.5134 60.1891 34.8872 173.9051 56 I 4.7859 7.9239 127.9896 59.8675 38.7232 174.9764 57 V 4.3612 8.7229 127.3486 61.0364 33.8818 173.6684 58 N 5.4394 8.6584 126.7653 51.8515 41.8005 172.8123 59 F 5.3034 9.8411 126.4311 56.2964 40.9651 175.2177 60 W 5.6603 8.9925 119.4644 55.3187 32.4480 173.1937 61 A 3.9754 7.9501 119.5890 50.1729 21.5750 177.5189 62 T 2.9777 8.1847 117.1729 65.8446 68.4527 175.9759 63 W 4.4361 6.6644 115.0617 56.7926 29.0400 176.9801 64 C 4.7067 7.3033 120.5187 55.3230 43.3600 171.7416 65 P 4.2961 0.0000 0.0000 65.3960 31.2340 176.6740 66 P 4.4764 0.0000 0.0000 65.3465 31.1575 178.9125 67 C 4.3542 8.3456 115.3844 60.3900 38.4374 175.9049 68 R 4.1197 8.3172 119.3498 59.7338 29.5326 178.7207 69 E 4.2089 7.8376 118.5936 58.5121 29.7314 177.6699 70 E 4.3297 8.0480 115.8778 57.2224 29.9255 178.5182 71 I 3.3413 6.9940 119.8273 63.9278 37.4426 175.5758 72 P 4.1147 0.0000 0.0000 65.4579 31.4482 177.8007 73 S 4.3521 7.2828 114.5704 58.5450 60.4747 174.3154 *76 R 4.2056 8.0290 127.5817 56.8462 32.2707 177.8349 77 L 3.9406 8.0352 118.4429 57.9685 42.0385 178.2596 78 N 4.4137 8.0306 115.3735 56.6222 39.0823 175.9938 79 A 4.1347 7.9586 120.0224 54.9818 18.7242 180.8967 80 A 4.0674 7.7229 119.0784 50.6540 18.6195 177.3588 *82 A 3.9457 7.6747 123.5815 54.6500 19.9039 176.6998 83 G 4.1726 9.0286 110.5655 45.4888 0.0000 174.4092 84 K 4.1560 7.4792 117.2499 55.2540 33.0342 175.3901 85 P 4.6039 0.0000 0.0000 62.9449 31.3953 174.3591 86 F 4.9479 8.1516 124.8923 57.9086 42.5720 172.9014 87 R 4.3338 7.5704 123.3519 54.6121 35.0963 173.4251 *89 L 4.2380 8.3597 118.6314 55.6226 43.4054 176.4624 90 C 4.8338 8.6016 123.7609 58.2635 29.3449 173.2306 91 V 4.3905 8.6101 126.2005 61.8176 32.4237 174.7839 92 S 3.9297 9.0381 124.5915 57.4203 63.1657 174.2287 93 I 4.8011 7.5566 119.4977 59.8765 38.6819 175.5926 94 D 4.2783 7.0628 122.3829 54.8627 41.0738 177.1156 95 E 3.8540 9.3306 125.4114 59.5311 29.7560 177.8532 96 G 3.8719 8.2122 104.7858 44.8601 0.0000 174.2173 97 G 3.6631 7.7907 110.4036 46.0426 0.0000 176.5065 98 K 3.8821 8.6668 121.3666 59.4089 32.0073 178.6534 99 V 3.5726 7.7326 117.8254 65.8579 31.4338 177.6146 100 A 3.9897 7.9172 120.5771 55.1493 18.0902 179.8825 101 V 3.4450 7.5007 116.7069 66.1549 31.6387 178.1269 102 E 4.0475 8.3088 118.3758 59.5676 29.3212 179.2996 103 E 4.0613 8.3038 118.7436 59.1302 29.5289 179.1797 104 F 4.3234 7.9600 121.0031 61.2814 39.5383 177.3373 105 F 4.4494 8.4944 117.8124 60.6815 38.5013 177.7152 106 R 3.9334 7.8054 116.4056 59.5119 30.0232 179.1186 107 K 4.0762 7.7263 116.2824 58.8460 32.1106 178.7820 108 T 3.8174 7.3520 108.4600 60.7781 69.0721 175.4192 109 G 3.7648 7.5035 109.0630 46.4317 0.0000 173.6881 110 F 4.8538 7.0514 117.5509 56.4791 40.2666 175.5954 111 T 3.5819 7.5777 115.8830 60.5528 69.9660 172.9228 112 L 4.5921 7.4065 126.9289 52.3010 46.0021 174.6489 113 P 4.5383 0.0000 0.0000 62.4656 31.5167 175.6385 114 V 4.8838 8.3572 124.8379 61.6948 33.9474 174.4333 115 L 5.2160 8.7416 124.4419 52.9875 45.9332 175.2651 116 L 4.7199 8.2860 121.9139 52.6925 43.3130 176.9216 117 D 4.7269 8.7298 123.1309 52.5673 41.1770 175.6881 118 A 4.0758 7.9684 125.4883 55.2004 19.0893 178.4723 119 D 4.5928 8.0219 112.0200 52.8373 39.7426 177.1045 120 K 3.9566 7.9876 117.3239 57.3266 30.4863 176.9435 121 R 3.8684 8.3488 120.3407 59.8873 29.8644 178.5725 122 V 3.8211 8.1511 117.3169 65.5871 31.5861 177.6496 123 G 3.3310 8.7786 106.1837 47.9014 0.0000 175.6055 124 K 3.9159 8.1952 121.5982 58.8668 31.8882 179.1145 125 L 3.9785 7.7741 119.3302 58.2015 41.9649 177.6860 126 Y 4.0400 7.9361 114.0926 56.5513 37.8839 175.3278 127 G 4.0950 8.5246 108.0489 46.3263 0.0000 174.4545 128 T 5.1031 7.3485 107.0007 61.3908 69.2618 173.9977 129 T 4.4903 8.6850 117.8351 63.0264 70.9460 174.3796 130 G 4.0596 7.4518 106.0793 46.2294 0.0000 172.1978 131 V 4.5825 8.1276 111.0929 59.1721 35.7431 172.8990 132 P 5.2632 0.0000 0.0000 61.9211 33.6076 174.4137 133 E 5.1265 8.6585 120.7175 55.2662 33.3402 173.8747 134 T 5.2145 9.1731 123.0668 61.9197 73.0428 172.7388 135 F 5.3533 10.0876 125.4867 55.7331 42.4808 174.2521 136 V 4.7326 9.4161 123.6566 61.4538 33.6051 174.5008 137 I 5.2945 8.6827 128.0541 59.5963 40.9357 174.8938 138 D 4.9869 9.0592 126.0300 51.9163 41.4383 177.5779 139 R 4.5848 8.5770 116.9112 58.8299 30.0483 178.1540 140 H 4.3676 8.1750 112.1610 56.1497 29.3300 175.7793 141 G 3.9734 8.9439 109.4734 45.1390 0.0000 172.7868 142 V 4.5602 8.5238 119.6382 60.4096 33.0363 174.8721 143 I 4.4093 8.2658 127.7699 61.9592 37.3367 176.5542 144 L 4.3514 9.4887 128.5273 56.7269 42.5005 177.4483 145 K 4.7178 8.0828 118.6850 54.4897 35.9937 174.2948 146 K 4.7318 8.7432 127.3509 54.4768 34.7249 175.0372 147 V 4.4113 8.9552 126.9360 61.2096 34.4866 174.2583 148 V 4.5656 8.5977 121.1763 60.9098 33.2572 177.0460 149 G 3.8680 9.1200 112.5414 44.4833 0.0000 172.5795 150 A 4.8949 8.0549 120.7784 51.6577 19.0470 177.4672 *152 E 3.9577 8.2971 119.1044 56.0924 29.1458 176.0775 153 W 4.3697 8.5083 122.8652 57.6122 29.6129 176.5888 154 D 4.7780 7.8388 116.6176 54.0517 41.3877 175.8841 155 H 4.4857 7.8818 116.0753 55.8012 29.5254 174.4338 156 P 4.2357 0.0000 0.0000 66.1684 31.1454 178.8364 157 E 3.9857 8.1762 116.5714 59.2906 29.3088 179.4015 158 V 3.6295 8.0340 118.5240 65.9204 31.6961 177.7841 159 I 3.6512 7.9132 118.8731 64.5800 37.0136 177.7809 160 A 3.9836 8.2001 121.1196 55.2166 17.9027 179.2144 161 F 4.0922 8.0922 118.6009 61.7386 39.4205 177.4158 162 L 3.8586 8.1607 118.3942 57.6686 41.1499 179.2723 163 N 4.1770 8.0832 115.8208 56.3327 38.6124 176.5981 164 N 4.2987 7.8875 117.0576 56.5419 38.8932 175.9974 165 E 4.2447 7.3391 121.0332 57.5003 29.9852 176.9094 166 L 4.2855 7.5582 122.8765 55.1313 43.3496 176.3498 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 29 E 8.34 4.51 0.00 2.01 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 2.27 2.35 0.00 30 N 7.33 4.86 0.00 2.69 2.64 0.00 0.00 6.99 7.15 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 31 P 0.00 4.79 0.00 1.92 2.00 0.00 3.69 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 2.02 2.10 0.00 32 A 8.43 3.98 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 33 P 0.00 4.23 0.00 1.87 1.87 0.00 2.78 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.77 0.00 34 D 8.44 4.55 0.00 2.58 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.56 5.14 0.00 3.15 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 36 T 8.71 4.73 4.31 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 1.25 0.00 0.00 37 L 8.74 4.99 0.00 1.68 1.51 0.55 0.46 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 38 N 8.77 5.02 0.00 2.73 2.75 0.00 0.00 6.44 7.05 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 39 T 8.13 5.18 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 1.28 0.00 0.00 40 L 8.74 4.31 0.00 1.77 1.80 1.19 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.73 4.99 0.00 2.75 2.88 0.00 0.00 7.24 6.88 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 42 G 8.66 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 43 E 7.84 4.48 0.00 1.96 1.92 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 2.39 2.32 0.00 44 V 8.12 4.93 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 0.80 0.00 0.00 0.95 0.00 0.00 45 V 8.48 4.37 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 0.87 0.00 0.00 0.94 0.00 0.00 46 K 8.53 4.81 0.00 1.79 1.58 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.35 7.81 47 L 8.01 3.63 0.00 0.79 1.38 0.71 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.02 4.05 0.00 3.90 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.49 4.59 0.00 2.43 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 50 L 7.96 4.50 0.00 1.81 1.58 0.91 0.63 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 51 K 7.33 4.26 0.00 1.68 1.73 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.57 1.37 7.81 52 G 9.53 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.76 4.87 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 54 V 7.86 4.45 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 0.80 0.00 0.00 1.11 0.00 0.00 55 V 8.31 5.16 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 1.00 0.00 0.00 0.82 0.00 0.00 56 I 7.92 4.79 1.70 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.06 0.60 0.00 0.00 57 V 8.72 4.36 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 0.30 0.00 0.00 0.98 0.00 0.00 58 N 8.66 5.44 0.00 2.61 2.45 0.00 0.00 6.72 7.12 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 59 F 9.84 5.30 0.00 3.07 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 60 W 8.99 5.66 0.00 3.36 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 61 A 7.95 3.98 -0.22 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 62 T 8.18 2.98 4.31 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 1.03 0.00 0.00 63 W 6.66 4.44 0.00 3.45 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 64 C 7.30 4.71 0.00 2.91 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 65 P 0.00 4.30 0.00 2.14 2.20 0.00 3.86 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 66 P 0.00 4.48 0.00 2.22 2.15 0.00 3.69 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 2.17 2.23 0.00 67 C 8.35 4.35 0.00 3.31 3.34 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 68 R 8.32 4.12 0.00 2.08 2.38 0.00 3.64 0.00 0.00 3.52 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.00 0.00 69 E 7.84 4.21 0.00 2.13 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 2.36 2.50 0.00 70 E 8.05 4.33 0.00 2.37 2.27 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 2.65 2.35 0.00 71 I 6.99 3.34 1.35 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.49 0.16 0.00 0.00 72 P 0.00 4.11 0.00 1.93 2.00 0.00 3.66 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.64 0.00 73 S 7.28 4.35 0.00 4.13 4.17 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 *76 R 8.03 4.21 0.00 2.04 2.16 0.00 3.11 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 77 L 8.04 3.94 0.00 1.83 1.81 0.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.03 4.41 0.00 2.71 2.80 0.00 0.00 6.90 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 79 A 7.96 4.13 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 80 A 7.72 4.07 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 *82 A 7.67 3.95 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 83 G 9.03 4.17 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 0.00 0.00 0.00 84 K 7.48 4.16 0.00 1.74 1.76 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.40 7.81 85 P 0.00 4.60 0.00 2.21 2.24 0.00 3.50 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 2.08 2.09 0.00 86 F 8.15 4.95 0.00 3.01 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 87 R 7.57 4.33 0.00 1.50 1.62 0.00 3.34 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.65 0.00 *89 L 8.36 4.24 0.00 1.58 1.66 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 90 C 8.60 4.83 0.00 2.89 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 91 V 8.61 4.39 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 0.64 0.00 0.00 0.31 0.00 0.00 92 S 9.04 3.93 0.00 2.85 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 93 I 7.56 4.80 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.62 0.91 0.00 0.00 94 D 7.06 4.28 0.00 2.46 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 95 E 9.33 3.85 0.00 1.93 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 2.29 2.40 0.00 96 G 8.21 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.79 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 98 K 8.67 3.88 0.00 1.83 1.81 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.46 7.81 99 V 7.73 3.57 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 1.00 0.00 0.00 0.93 0.00 0.00 100 A 7.92 3.99 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 0.00 101 V 7.50 3.45 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 0.77 0.00 0.00 0.79 0.00 0.00 102 E 8.31 4.05 0.00 2.16 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 2.41 2.43 0.00 103 E 8.30 4.06 0.00 2.30 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 2.36 2.43 0.00 104 F 7.96 4.32 0.00 3.13 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 0.00 105 F 8.49 4.45 0.00 3.10 3.05 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 0.00 106 R 7.81 3.93 0.00 1.96 2.01 0.00 3.18 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.97 0.00 107 K 7.73 4.08 0.00 1.64 1.80 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.67 7.81 108 T 7.35 3.82 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 0.41 0.00 0.00 109 G 7.50 3.76 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 0.00 0.00 0.00 110 F 7.05 4.85 0.00 2.81 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 0.00 111 T 7.58 3.58 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 1.07 0.00 0.00 112 L 7.41 4.59 0.00 1.59 1.37 0.54 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.54 0.00 2.06 2.02 0.00 3.51 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 114 V 8.36 4.88 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 1.18 0.00 0.00 1.45 0.00 0.00 115 L 8.74 5.22 0.00 1.53 1.43 1.02 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.29 4.72 0.00 1.53 1.53 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.73 4.73 0.00 2.55 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.97 4.08 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 0.00 119 D 8.02 4.59 0.00 2.79 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 0.00 120 K 7.99 3.96 0.00 1.96 1.94 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.54 1.36 7.81 121 R 8.35 3.87 0.00 2.07 1.96 0.00 3.21 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 122 V 8.15 3.82 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 0.86 0.00 0.00 0.95 0.00 0.00 123 G 8.78 3.33 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 0.00 124 K 8.20 3.92 0.00 1.98 1.86 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.42 7.81 125 L 7.77 3.98 0.00 1.89 1.99 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 126 Y 7.94 4.04 0.00 2.72 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 0.00 127 G 8.52 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 128 T 7.35 5.10 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 1.14 0.00 0.00 129 T 8.69 4.49 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 1.23 0.00 0.00 130 G 7.45 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 0.00 0.00 0.00 131 V 8.13 4.58 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 0.77 0.00 0.00 0.82 0.00 0.00 132 P 0.00 5.26 0.00 2.31 2.32 0.00 3.64 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 2.16 2.01 0.00 133 E 8.66 5.13 0.00 2.12 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 2.19 2.34 0.00 134 T 9.17 5.21 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 0.90 0.00 0.00 135 F 10.09 5.35 0.00 3.13 3.12 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 0.00 136 V 9.42 4.73 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 1.29 0.00 0.00 1.22 0.00 0.00 137 I 8.68 5.29 1.99 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.67 0.97 0.00 0.00 138 D 9.06 4.99 0.00 2.80 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 0.00 139 R 8.58 4.58 0.00 1.73 1.92 0.00 3.39 0.00 0.00 3.42 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.66 0.00 140 H 8.17 4.37 0.00 3.13 3.35 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.94 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 0.00 142 V 8.52 4.56 2.54 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 1.11 0.00 0.00 1.00 0.00 0.00 143 I 8.27 4.41 2.10 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.08 1.21 0.00 0.00 144 L 9.49 4.35 0.00 1.86 1.96 1.06 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 145 K 8.08 4.72 0.00 1.95 1.66 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.70 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 0.99 7.81 146 K 8.74 4.73 0.00 1.69 1.57 0.00 1.82 0.00 0.00 1.60 0.00 0.00 2.63 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.91 0.21 7.81 147 V 8.96 4.41 2.35 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 1.02 0.00 0.00 0.94 0.00 0.00 148 V 8.60 4.57 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 0.72 0.00 0.00 0.92 0.00 0.00 149 G 9.12 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 8.05 4.89 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 *152 E 8.30 3.96 0.00 1.87 1.54 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 1.89 2.15 0.00 153 W 8.51 4.37 0.00 3.28 3.24 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 0.00 154 D 7.84 4.78 0.00 2.81 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 0.00 155 H 7.88 4.49 0.00 3.33 3.14 0.00 5.71 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 P 0.00 4.24 0.00 2.13 2.11 0.00 3.52 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 157 E 8.18 3.99 0.00 2.08 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 2.40 1.94 0.00 158 V 8.03 3.63 2.36 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 1.36 0.00 0.00 0.85 0.00 0.00 159 I 7.91 3.65 2.04 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 1.74 0.73 0.89 0.00 0.00 160 A 8.20 3.98 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 0.00 161 F 8.09 4.09 0.00 3.22 3.35 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 0.00 162 L 8.16 3.86 0.00 1.95 1.74 1.11 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 163 N 8.08 4.18 0.00 2.89 2.85 0.00 0.00 6.97 7.57 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 0.00 164 N 7.89 4.30 0.00 2.68 2.90 0.00 0.00 7.28 7.41 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 0.00 165 E 7.34 4.24 0.00 1.84 1.91 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 2.07 2.15 0.00 166 L 7.56 4.29 0.00 1.70 1.42 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.