NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.3691 8.3449 119.1198 54.2909 30.5447 175.1127 4 L 4.7534 7.5261 116.9676 50.6277 44.5229 175.5070 5 T 4.2160 9.1413 113.9470 61.2082 71.9122 175.2402 6 E 3.9374 8.7866 121.9585 59.8601 29.6346 179.0480 7 E 3.9114 8.3149 118.4229 59.9232 29.5857 179.0214 8 Q 4.0464 7.7235 117.1025 58.6366 28.8051 178.7533 9 I 4.0382 7.9697 121.0508 64.3739 37.0248 178.1957 10 A 4.0646 8.0658 121.4963 55.2491 18.3228 179.6146 11 E 3.9310 8.1901 116.8242 59.6204 29.4852 179.6214 12 F 4.7697 8.4111 117.7033 60.2524 38.4084 177.6731 13 K 3.5526 8.2055 119.3838 59.4124 31.6835 178.7406 14 E 4.0726 7.9290 117.9167 59.0813 29.5462 178.7939 15 A 4.2670 8.1309 120.7299 55.1671 18.4621 179.2520 16 F 3.8591 8.9074 119.8883 61.5569 39.1397 177.5661 17 S 4.1059 7.8140 111.9676 61.0816 62.8854 175.7818 18 L 3.9844 7.4540 123.2091 58.0046 41.7976 178.8109 19 F 4.3146 7.7363 116.2219 59.6076 40.0672 176.3669 20 D 4.4976 7.7550 120.9893 52.8187 39.0604 176.7115 21 K 4.0252 8.3330 123.3016 58.9241 32.5330 178.8651 22 D 4.3448 8.1504 116.0827 54.4368 39.3954 176.8915 23 G 3.8642 7.6935 106.6852 46.4991 0.0000 173.6288 24 D 4.5757 8.1595 116.2329 52.9142 39.4878 176.8407 25 G 4.0813 10.0327 107.3271 46.2881 0.0000 173.6027 26 T 4.9718 8.0354 113.5119 62.3947 73.4353 173.1171 27 I 4.5238 8.6935 127.4009 60.0827 39.3253 176.1304 28 T 4.6635 8.5922 117.8374 61.1364 70.8551 176.2401 29 T 3.8461 8.5453 117.4327 66.6026 68.4653 176.6036 30 K 3.8664 8.1037 121.0489 59.7672 31.8936 178.4255 31 E 3.9823 8.0330 118.1612 59.3817 28.9290 179.0173 32 L 4.3467 7.9889 120.2781 58.1004 42.0191 179.3869 33 G 3.6110 8.1341 105.5042 48.1581 0.0000 175.5559 34 T 3.8768 7.7325 118.1494 66.5750 68.2441 176.5503 35 V 3.7466 7.2305 118.5848 65.0444 31.7982 177.8076 36 M 4.2743 7.8514 117.7538 58.6322 31.7655 179.0051 37 R 4.6367 8.4796 119.8364 58.7677 29.6786 179.2984 38 S 4.2064 8.1359 113.5430 60.4581 62.6887 175.4067 39 L 4.5176 7.2975 121.1812 53.7021 43.2456 176.1706 40 G 3.6005 8.2897 105.1352 45.5955 0.0000 173.4436 41 Q 4.6355 7.2922 118.7813 54.9354 32.8899 173.5900 42 N 5.2221 8.3284 118.2923 51.8259 39.7886 173.3211 43 P 4.5000 0.0000 0.0000 63.4605 32.3681 176.4398 44 T 4.5993 8.3170 114.2532 60.0960 70.5084 174.9650 45 E 3.9266 8.7689 124.3259 59.3534 29.3817 178.7971 46 A 4.1773 7.8836 119.8984 54.5180 18.9848 179.1466 47 E 3.9679 8.0625 116.7496 59.2744 29.5692 179.4589 48 L 3.9311 7.9155 119.1324 57.9392 41.8103 179.2371 49 Q 3.9855 7.7168 118.7921 59.3958 28.6459 178.0693 50 D 4.3946 8.2051 119.9504 57.3279 41.1967 178.4084 51 M 4.0459 7.9150 118.7045 58.4052 32.2299 178.4597 52 I 3.6669 7.8278 120.2513 64.4147 37.1365 178.1422 53 N 4.4567 7.9941 116.3407 55.7887 38.4243 176.8658 54 E 4.1762 7.8054 117.5664 57.9861 29.9836 177.6618 55 V 4.2842 6.7776 109.3024 61.0357 33.4405 176.3320 56 D 4.5861 7.8885 121.1352 53.1515 39.2501 176.2513 57 A 3.9865 8.2787 126.2540 54.7858 18.8684 179.2393 58 D 4.3982 7.7584 111.7414 54.1919 39.6596 176.9602 59 G 3.8828 7.7898 108.3709 46.7492 0.0000 173.3270 60 N 4.7279 8.4734 114.9195 52.2037 37.6402 175.9023 61 G 4.1333 8.1716 104.2221 47.1485 0.0000 173.6823 62 T 4.6901 7.6331 111.8138 60.5359 71.1397 173.2160 63 I 4.9991 8.5907 126.7318 58.9671 39.2863 175.5364 64 D 5.2174 8.8017 127.5574 52.3931 41.6672 177.4304 65 F 3.5837 8.7058 119.2561 60.9278 39.4025 174.6667 66 P 4.0032 0.0000 0.0000 65.9108 30.9692 178.3659 67 E 3.9786 8.2450 116.4818 59.3456 28.9500 178.8685 68 F 4.0347 8.4029 120.7981 61.4278 39.0302 177.3053 69 L 3.5589 7.2235 117.8674 57.7954 41.4734 179.2684 70 T 3.8842 7.0260 107.4441 64.8729 68.8511 175.9311 71 M 3.9508 7.5827 120.1553 59.5435 32.5009 177.0633 72 M 3.8866 6.8858 116.3066 54.8198 33.5897 176.3736 *81 S 4.3518 8.3397 113.0485 58.8970 64.5123 174.9431 82 E 4.2762 8.3765 124.8431 60.0508 29.4699 177.6864 83 E 4.0685 8.3251 120.5518 61.7614 29.7340 184.8370 84 E 4.2462 8.1770 117.6559 61.4881 29.9343 182.5157 85 I 4.1193 7.8130 120.7095 64.3856 37.2629 178.6629 86 R 4.1341 8.3932 119.2586 59.1028 29.7371 178.5592 87 E 4.0748 8.4668 118.1160 58.5623 29.7540 178.4300 88 A 4.1933 8.2149 121.4452 55.1974 18.5592 179.2522 89 F 3.7515 8.2478 119.2387 61.3157 39.2125 176.9861 90 R 3.8822 7.6049 116.0104 58.2117 29.9228 178.1012 91 V 3.6207 7.1344 117.6858 66.1552 31.5471 177.5197 92 F 4.4907 7.5908 116.4286 59.3182 40.0738 176.0858 93 D 4.4953 7.2355 118.5575 52.5521 38.8906 175.6755 94 K 3.9010 8.1502 122.2867 59.2378 32.7855 178.2361 95 D 4.3936 7.9024 118.4527 54.1675 40.4461 176.2646 96 G 3.7699 8.0399 108.8034 46.7959 0.0000 174.3232 97 N 4.5850 8.6213 114.2763 52.7821 37.4353 175.5622 98 G 4.3198 9.1215 106.3037 45.9718 0.0000 172.9060 99 F 5.2252 8.7016 116.7519 55.8632 43.4902 173.9972 100 I 4.7590 9.1328 124.6220 59.0939 39.0249 176.0616 101 S 4.7669 8.7896 122.1295 57.1645 65.2615 175.1158 102 A 4.0318 8.6477 120.6429 55.1555 17.9920 179.5193 103 A 4.0694 8.0228 118.7463 54.7576 18.0248 179.3490 104 E 4.1864 7.9237 117.0299 58.9542 29.7963 178.6714 105 L 4.1358 7.9335 120.4362 58.2470 42.2838 178.9561 106 R 3.8970 8.0002 118.3087 59.6582 30.0338 178.0417 107 H 4.1217 7.8705 116.7912 59.2207 29.9171 177.5003 108 V 3.6780 7.8644 119.6551 65.9066 31.3534 177.7378 109 M 4.0920 8.4585 119.1913 58.9154 32.0520 178.9009 110 T 4.0068 7.8719 108.9977 64.3717 68.8652 176.5653 111 N 4.3474 7.7676 118.6406 56.2720 38.6545 177.0804 112 L 4.1152 7.8341 119.1865 56.0348 41.7733 178.1112 113 G 4.0731 7.3036 104.2773 44.9920 0.0000 173.7419 114 E 4.0611 8.1676 120.2463 55.9553 29.9588 176.3640 115 K 4.5155 8.2966 123.1126 54.7174 33.5945 175.4416 116 L 4.5069 7.9895 122.3831 53.9629 42.9080 174.9406 117 T 4.3895 7.9907 110.6090 60.8313 71.4484 175.4481 118 D 4.3729 8.4871 120.0964 57.0845 41.1741 177.9660 119 E 3.9545 8.2089 119.0429 59.5303 29.5565 178.9055 120 E 3.9246 7.6491 117.9562 59.3923 29.6008 179.5335 121 V 3.5655 7.8148 118.1017 66.3040 31.6918 177.7393 122 D 4.3837 8.4013 118.8233 57.4057 40.6200 178.5126 123 E 3.9464 8.2274 119.8889 59.2003 29.2329 178.5585 124 M 3.9533 7.9834 118.2075 58.8521 32.5162 178.1726 125 I 3.6866 7.6326 119.8156 64.3743 36.9931 178.4725 126 R 3.8853 7.6818 118.3660 59.6077 30.0951 178.3368 127 E 4.0560 7.8927 116.1325 58.7803 29.4524 178.4747 128 A 4.4989 7.4579 119.2657 52.6691 19.5577 176.8585 129 D 4.6749 7.5343 116.2736 53.5698 39.9906 175.8114 130 I 3.9051 8.3375 128.0829 63.5553 37.4581 177.3203 131 D 4.5383 7.8148 118.1680 53.4608 39.9838 176.8345 132 G 3.8292 8.5469 107.5356 46.4551 0.0000 173.3246 133 D 4.6413 8.1822 117.2093 52.5024 39.7963 177.3664 134 G 3.9918 8.9153 108.3659 45.7165 0.0000 172.7683 135 Q 4.8600 8.2071 116.8569 54.3301 33.8170 174.4151 136 V 4.4015 8.6633 119.7897 61.2720 33.7121 175.0923 137 N 4.5550 8.2201 125.7142 51.1109 39.1039 175.5935 138 Y 2.8902 7.8683 118.8751 60.1943 38.1363 177.3939 139 E 3.7386 7.8733 118.2150 59.4641 29.3806 178.8628 140 E 4.0425 8.4001 120.6513 58.0807 29.1783 179.0390 141 F 3.7401 7.5846 121.0615 61.0436 39.0372 177.3323 142 V 3.6495 7.3264 118.1098 65.9451 31.3025 178.2104 143 T 3.8847 7.4700 114.9654 66.7051 68.1662 175.9623 144 M 3.9590 7.5926 119.9771 58.7877 32.0456 178.0112 145 M 3.6167 6.9713 118.1186 58.8659 32.6831 178.1032 146 T 4.2741 7.3726 114.9691 65.3918 69.0806 175.6842 147 S 4.3002 7.9755 121.7712 58.1999 62.3335 179.0214 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 3 Q 8.34 4.37 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.69 0.00 0.00 0.00 0.00 0.00 2.18 1.96 0.00 4 L 7.53 4.75 0.00 1.73 1.68 0.93 0.76 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 5 T 9.14 4.22 4.27 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 1.23 0.00 0.00 6 E 8.79 3.94 0.00 2.05 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 2.44 2.42 0.00 7 E 8.31 3.91 0.00 2.03 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 2.38 2.43 0.00 8 Q 7.72 4.05 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 9 I 7.97 4.04 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.16 1.16 0.00 0.00 10 A 8.07 4.06 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 11 E 8.19 3.93 0.00 1.96 1.85 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 2.55 2.40 0.00 12 F 8.41 4.77 0.00 3.56 3.53 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 0.00 0.00 0.00 13 K 8.21 3.55 0.00 1.67 1.85 0.00 1.42 0.00 0.00 1.37 0.00 0.00 2.34 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.09 0.41 7.81 14 E 7.93 4.07 0.00 2.12 2.02 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 2.52 2.46 0.00 15 A 8.13 4.27 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 0.00 0.00 0.00 0.00 0.00 16 F 8.91 3.86 0.00 3.01 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 17 S 7.81 4.11 0.00 4.11 4.05 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 18 L 7.45 3.98 0.00 1.58 1.57 0.85 1.20 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 19 F 7.74 4.31 0.00 2.83 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 20 D 7.75 4.50 0.00 2.16 2.34 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 21 K 8.33 4.03 0.00 1.79 1.82 0.00 1.74 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.63 1.49 7.81 22 D 8.15 4.34 0.00 2.78 2.80 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 23 G 7.69 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 0.00 0.00 0.00 24 D 8.16 4.58 0.00 2.85 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 G 10.03 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.04 4.97 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 1.27 0.00 0.00 27 I 8.69 4.52 1.81 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.61 0.85 0.00 0.00 28 T 8.59 4.66 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 29 T 8.55 3.85 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 30 K 8.10 3.87 0.00 1.82 1.83 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.56 7.81 31 E 8.03 3.98 0.00 2.06 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 2.33 2.31 0.00 32 L 7.99 4.35 0.00 1.90 1.86 0.79 0.99 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 33 G 8.13 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.73 3.88 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 1.20 0.00 0.00 35 V 7.23 3.75 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 0.54 0.00 0.00 0.77 0.00 0.00 36 M 7.85 4.27 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.75 0.00 37 R 8.48 4.64 0.00 1.97 1.98 0.00 3.14 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.51 0.00 38 S 8.14 4.21 0.00 4.17 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 39 L 7.30 4.52 0.00 1.72 1.65 0.81 0.87 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 40 G 8.29 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.29 4.64 0.00 2.23 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 6.98 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 42 N 8.33 5.22 0.00 2.70 2.75 0.00 0.00 6.96 8.02 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 43 P 0.00 4.50 0.00 2.05 2.01 0.00 3.63 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 44 T 8.32 4.60 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 1.29 0.00 0.00 45 E 8.77 3.93 0.00 2.12 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 2.39 2.46 0.00 46 A 7.88 4.18 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 47 E 8.06 3.97 0.00 2.17 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 2.40 2.40 0.00 48 L 7.92 3.93 0.00 1.72 1.71 0.94 0.80 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 49 Q 7.72 3.99 0.00 2.32 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 50 D 8.21 4.39 0.00 2.90 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 51 M 7.92 4.05 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 52 I 7.83 3.67 2.02 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 1.52 0.88 0.91 0.00 0.00 53 N 7.99 4.46 0.00 2.71 2.87 0.00 0.00 7.11 7.75 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 54 E 7.81 4.18 0.00 2.08 2.20 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 2.27 2.49 0.00 55 V 6.78 4.28 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 0.63 0.00 0.00 0.99 0.00 0.00 56 D 7.89 4.59 0.00 2.93 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 57 A 8.28 3.99 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 58 D 7.76 4.40 0.00 2.84 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 59 G 7.79 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.47 4.73 0.00 2.91 3.04 0.00 0.00 6.91 7.72 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 61 G 8.17 4.13 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 0.00 62 T 7.63 4.69 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 1.26 0.00 0.00 63 I 8.59 5.00 2.07 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 0.95 1.62 1.09 0.00 0.00 64 D 8.80 5.22 0.00 2.85 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 65 F 8.71 3.58 0.00 2.12 2.80 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 66 P 0.00 4.00 0.00 2.27 2.07 0.00 3.80 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 67 E 8.25 3.98 0.00 2.22 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 2.44 2.40 0.00 68 F 8.40 4.03 0.00 3.33 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 69 L 7.22 3.56 0.00 1.60 1.46 0.65 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.03 3.88 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 1.11 0.00 0.00 71 M 7.58 3.95 0.00 1.87 2.09 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 72 M 6.89 3.89 0.00 1.60 1.76 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.85 0.00 *81 S 8.34 4.35 0.00 4.04 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 82 E 8.38 4.28 0.00 2.12 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 2.44 2.52 0.00 83 E 8.33 4.07 0.00 2.01 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 2.31 1.94 0.00 84 E 8.18 4.25 0.00 1.97 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 2.31 1.97 0.00 85 I 7.81 4.12 2.24 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.60 1.17 0.00 0.00 86 R 8.39 4.13 0.00 1.92 1.87 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 87 E 8.47 4.07 0.00 2.04 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 2.34 2.33 0.00 88 A 8.21 4.19 1.67 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 0.00 0.00 89 F 8.25 3.75 0.00 2.78 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 90 R 7.60 3.88 0.00 2.05 1.99 0.00 3.31 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 91 V 7.13 3.62 1.79 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 0.70 0.00 0.00 0.91 0.00 0.00 92 F 7.59 4.49 0.00 2.97 2.95 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 93 D 7.24 4.50 0.00 2.11 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 0.00 0.00 0.00 0.00 94 K 8.15 3.90 0.00 1.74 1.77 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.38 7.81 95 D 7.90 4.39 0.00 2.78 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 96 G 8.04 3.77 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 0.00 0.00 0.00 97 N 8.62 4.59 0.00 2.85 2.96 0.00 0.00 6.37 7.00 0.00 0.00 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 G 9.12 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 0.00 0.00 0.00 0.00 99 F 8.70 5.23 0.00 3.11 3.02 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 0.00 100 I 9.13 4.76 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.31 0.94 0.00 0.00 101 S 8.79 4.77 0.00 3.94 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 0.00 102 A 8.65 4.03 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 0.00 103 A 8.02 4.07 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 0.00 104 E 7.92 4.19 0.00 2.21 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 2.31 2.33 0.00 105 L 7.93 4.14 0.00 1.87 1.69 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.00 3.90 0.00 2.06 2.20 0.00 3.21 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 107 H 7.87 4.12 0.00 3.44 3.47 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.86 3.68 2.40 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 0.84 0.00 0.00 0.97 0.00 0.00 109 M 8.46 4.09 0.00 2.15 2.32 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.63 0.00 110 T 7.87 4.01 4.21 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 1.29 0.00 0.00 111 N 7.77 4.35 0.00 2.92 3.01 0.00 0.00 7.03 7.21 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 0.00 112 L 7.83 4.12 0.00 1.90 1.69 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.30 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 0.00 0.00 0.00 0.00 114 E 8.17 4.06 0.00 2.08 1.90 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 2.34 2.44 0.00 115 K 8.30 4.52 0.00 1.71 1.72 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.32 7.81 116 L 7.99 4.51 0.00 1.77 1.66 0.93 0.73 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 0.00 117 T 7.99 4.39 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 0.00 118 D 8.49 4.37 0.00 2.82 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 E 8.21 3.95 0.00 2.05 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 2.40 2.42 0.00 120 E 7.65 3.92 0.00 2.03 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 2.32 2.32 0.00 121 V 7.81 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 1.09 0.00 0.00 0.94 0.00 0.00 122 D 8.40 4.38 0.00 3.00 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 0.00 123 E 8.23 3.95 0.00 2.19 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 0.00 2.30 2.31 0.00 124 M 7.98 3.95 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 125 I 7.63 3.69 2.02 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 1.40 0.96 0.97 0.00 0.00 126 R 7.68 3.89 0.00 2.03 2.07 0.00 3.26 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 127 E 7.89 4.06 0.00 1.95 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 2.39 2.45 0.00 128 A 7.46 4.50 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 0.00 129 D 7.53 4.67 0.00 2.85 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 0.00 130 I 8.34 3.91 2.02 0.00 0.00 0.82 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 0.81 0.90 0.00 0.00 131 D 7.81 4.54 0.00 2.86 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.55 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 0.00 133 D 8.18 4.64 0.00 2.78 2.84 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 0.00 0.00 0.00 134 G 8.92 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 0.00 0.00 0.00 135 Q 8.21 4.86 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.61 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 136 V 8.66 4.40 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 1.17 0.00 0.00 0.95 0.00 0.00 137 N 8.22 4.56 0.00 2.25 1.53 0.00 0.00 6.37 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 0.00 138 Y 7.87 2.89 0.00 1.89 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 0.00 139 E 7.87 3.74 0.00 2.18 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 0.00 2.43 2.33 0.00 140 E 8.40 4.04 0.00 2.06 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 2.28 2.11 0.00 141 F 7.58 3.74 0.00 3.13 2.75 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 0.00 142 V 7.33 3.65 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 0.91 0.00 0.00 0.53 0.00 0.00 143 T 7.47 3.88 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 1.16 0.00 0.00 144 M 7.59 3.96 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 145 M 6.97 3.62 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 146 T 7.37 4.27 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 1.18 0.00 0.00 147 S 7.98 4.30 0.00 3.63 3.63 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 * Residues marked with a * may have inaccurate shift predictions.