NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3524 8.2493 123.5838 52.5056 19.9871 176.3396 2 T 4.5492 8.2087 109.8053 60.8549 71.1553 172.6542 3 K 5.2576 8.4567 123.3384 54.4989 36.3359 176.3071 4 A 5.3363 8.9318 125.0799 50.5044 23.2963 174.7839 5 V 4.9267 8.5860 116.7052 61.2787 35.3742 172.9657 6 C 4.8925 8.7404 121.7172 58.3575 35.6465 172.5832 7 V 4.6896 8.4562 126.2339 61.1541 33.0930 174.2818 8 L 4.7030 8.4923 129.2299 54.5608 42.8419 176.5489 9 K 4.8029 8.9092 121.8406 55.8436 37.3888 175.2947 10 G 4.4769 7.9115 107.0670 46.8471 0.0000 172.7639 11 D 4.5913 9.0188 118.7993 56.1394 41.4076 176.8325 12 G 4.2289 7.6095 108.5021 43.8714 0.0000 171.4095 13 P 4.4105 0.0000 0.0000 63.0644 31.9977 175.8007 14 V 4.0019 7.6677 119.9191 63.6386 31.7579 174.8091 15 Q 4.8808 8.6778 126.0027 54.7694 32.6549 174.2177 16 G 4.2832 8.0068 105.8295 46.0750 0.0000 172.3111 17 I 5.0547 8.3859 120.3918 59.4291 40.7572 174.7983 18 I 4.6483 8.6489 128.1301 59.4783 39.8260 174.6177 19 N 4.7589 8.7399 125.3718 51.3968 41.1465 173.9636 20 F 5.3343 8.7234 119.9329 55.7602 42.9447 173.9579 21 E 5.2986 10.0354 123.2754 54.7810 33.3081 173.8353 22 Q 4.5231 9.6972 127.6961 54.4288 31.1413 175.6954 23 K 4.1226 8.9613 126.9869 58.1184 32.9066 177.5795 24 E 4.7344 7.9252 118.3816 53.9546 32.3557 176.8565 25 S 4.4367 8.9785 118.6007 60.5932 63.0598 174.7358 26 N 4.8143 8.2311 116.2085 52.2734 37.3048 174.1746 27 G 4.0623 8.0826 109.3330 43.4502 0.0000 171.5914 28 P 4.7231 0.0000 0.0000 62.4684 33.0217 175.8575 29 V 4.5799 9.1492 121.5682 61.0643 33.4940 174.8495 30 K 4.7416 8.9095 128.8024 56.3888 33.4220 176.2191 31 V 4.8127 9.2264 126.0134 60.8860 33.4697 174.3350 32 W 5.5128 9.5470 124.8200 54.1897 31.8166 175.7704 33 G 4.0619 7.5989 106.8983 46.3949 0.0000 171.1656 34 S 5.1067 7.7793 114.9559 56.8116 66.7872 174.2001 35 I 5.0995 8.7434 125.6714 59.4871 40.8857 174.7383 36 K 4.7907 9.4981 126.3796 55.4337 35.8447 177.0625 37 G 3.8000 9.0293 107.5250 45.3494 0.0000 173.0929 38 L 4.6090 7.6797 119.8679 52.5564 43.3789 176.3444 39 T 4.2108 8.4682 112.5615 61.3945 69.5278 173.4390 40 E 3.9704 8.4603 123.6817 57.2522 31.2240 175.4400 41 G 4.0391 10.6306 110.8526 44.2887 0.0000 171.8871 42 L 5.0434 8.1206 124.0768 53.4495 44.0415 175.7604 43 H 5.0228 9.0584 122.9361 53.7980 32.5129 172.8918 44 G 4.1703 8.8909 110.2011 46.3301 0.0000 172.0226 45 F 5.6898 9.7246 126.5809 56.8658 42.0603 172.9823 46 H 5.3833 9.0144 122.7404 53.7182 33.2898 173.0386 47 V 4.4060 8.4943 121.9643 62.8936 32.4362 174.8040 48 H 5.2089 9.1819 124.5572 53.8730 31.6147 175.0796 49 E 3.6977 8.9894 122.2053 58.8622 29.7596 177.0804 50 F 4.9305 7.8527 118.4428 54.8536 41.2752 177.2359 51 G 4.2491 8.3426 113.4177 44.4565 0.0000 174.1760 52 D 4.7888 7.9099 117.2122 52.6769 42.9069 174.4314 53 N 5.1934 8.4303 126.5199 53.4036 39.5680 176.6250 54 T 3.8816 8.5631 109.7971 63.3603 68.8816 174.6976 55 A 4.6330 7.7091 123.9386 51.4788 19.7292 177.7702 56 G 3.8433 7.7938 110.0563 47.3422 0.0000 174.5153 57 C 4.5271 8.5659 115.0156 59.2382 38.4534 175.7423 58 T 3.8613 7.7921 118.2941 66.3848 67.9814 175.9583 59 S 4.4581 7.6213 112.2078 59.6577 63.4258 175.5682 60 A 4.4403 7.3142 126.6651 54.2632 18.2156 178.6182 61 G 4.3033 7.8860 104.6481 44.5486 0.0000 171.1563 62 P 4.7004 0.0000 0.0000 61.7021 33.7294 174.9784 63 H 4.3028 8.6064 116.0741 56.4515 29.3120 175.1857 64 F 4.4080 9.2184 125.6677 58.1384 40.2792 174.9568 65 N 4.8670 8.0300 123.5374 51.8590 40.0666 172.3834 66 P 4.0844 0.0000 0.0000 65.2699 31.5629 178.5874 67 L 4.0045 7.1456 118.1993 56.2873 42.2924 176.6143 *79 R 4.1744 7.3959 115.4449 55.9105 30.8467 175.2451 80 H 4.5816 8.4333 115.6633 55.2072 29.5643 176.6176 81 V 3.4046 8.5261 122.4977 66.4550 31.2427 177.6644 82 G 3.8151 8.1837 104.8788 47.4286 0.0000 172.0867 83 D 4.5389 8.1629 120.7754 54.5878 41.1728 175.2416 84 L 4.5914 8.3670 125.7426 53.1292 42.7687 178.0192 85 G 4.0342 9.1240 113.0854 46.4556 0.0000 175.8600 86 N 5.5978 8.6965 120.3541 51.2827 42.3922 172.4548 87 V 4.3222 8.9336 113.3428 59.9727 35.3925 175.3264 88 T 4.9323 8.1096 118.0290 61.7176 70.9829 173.2428 89 A 4.6073 9.4932 131.3322 51.1874 19.7509 177.3788 90 D 4.7709 9.1659 123.6300 52.5573 40.4442 177.1829 91 K 4.3379 8.2797 116.6025 58.9739 32.8153 177.3406 92 D 4.5746 8.3273 118.3192 54.0926 40.6337 176.4040 93 G 4.4243 7.9275 106.5497 45.4521 0.0000 173.1153 94 V 4.8228 7.9028 119.3481 60.6814 34.0439 174.4407 95 A 5.3208 9.1534 129.1867 49.4302 21.4240 174.4028 96 D 5.0918 8.6955 122.5105 53.4025 42.5441 176.3273 97 V 4.2943 9.0957 124.8097 61.2493 33.9858 174.8466 98 S 4.9618 8.4298 122.4033 57.7168 64.4211 172.9115 99 I 4.8872 9.3108 128.0879 59.5863 41.8787 174.0195 100 E 5.2078 8.8224 124.5829 54.5785 32.3716 174.3222 101 D 4.9980 9.6533 125.6177 52.7444 44.8666 175.7879 102 S 4.7709 8.9181 118.5210 58.4472 64.3630 174.9745 103 V 4.0389 8.0039 120.4632 64.6698 32.0322 176.5142 104 I 3.9737 7.9671 112.0503 61.0344 38.1327 174.9496 105 S 4.7323 8.7919 115.5543 56.9158 65.4795 174.1284 106 L 4.4806 9.2734 124.1857 54.4772 41.5238 176.7532 107 S 4.5547 7.9450 112.0417 58.0563 66.5486 175.6991 108 G 3.8092 8.6092 108.0091 44.5895 0.0000 173.2563 109 D 4.4429 8.7343 117.1900 57.1062 41.4794 177.9846 110 H 5.0770 8.0599 114.1773 55.3271 29.5295 172.7185 111 C 5.1120 8.2829 120.2480 59.2965 31.7554 173.4741 112 I 3.8931 8.0919 118.8795 60.7528 38.1597 175.5757 113 T 3.8951 7.3967 118.8211 64.9385 68.8065 174.6050 114 G 3.8226 9.1441 113.6311 45.6876 0.0000 172.9902 115 R 4.9203 7.3832 119.6139 54.3931 33.9439 174.1971 116 T 4.9594 7.7225 114.1261 62.2133 71.9186 173.3766 117 L 4.6835 8.6194 129.0965 54.4063 43.8621 175.4989 118 V 5.0784 8.7486 125.6690 61.0856 35.0453 174.1352 119 V 5.0887 8.6352 127.4857 60.7540 33.4532 175.0594 120 H 5.2341 9.1211 121.9451 54.2286 30.8894 174.9604 121 E 4.1203 9.1493 121.0385 59.4779 29.5221 177.3200 122 K 4.6252 8.0965 117.9222 54.5600 34.4800 175.9545 123 A 4.3608 8.4861 124.6064 52.4271 18.7350 178.0339 124 D 4.3391 9.0368 121.2824 53.9698 39.5873 175.9091 *141 G 3.7944 8.0494 114.3502 44.2956 0.0000 169.9683 142 S 4.2851 8.4803 113.6907 58.9803 64.1107 173.5514 143 R 4.5832 8.2764 118.9256 54.7409 30.9797 176.3543 144 L 4.3161 8.9278 125.3155 57.4244 43.1243 177.0749 145 A 4.9753 7.7705 117.4567 51.3912 22.6355 174.1852 146 C 5.6257 8.7725 114.4398 55.8625 45.8445 172.8206 147 G 4.7359 8.1060 103.6764 46.0692 0.0000 172.7297 148 V 4.4265 8.3223 122.2391 62.3564 32.6837 175.5551 149 I 4.1231 9.2108 129.7762 61.0795 38.2118 175.3697 150 G 4.4997 9.1436 113.8621 44.0347 0.0000 171.6669 151 I 4.5695 8.2808 120.6762 60.7770 37.8433 175.5561 152 A 4.8356 8.3489 127.6238 49.5827 22.1152 176.1929 153 Q 4.0705 8.5517 118.9170 56.4517 29.1796 176.1568 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 1 A 8.25 4.35 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 2 T 8.21 4.55 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 1.24 0.00 0.00 3 K 8.46 5.26 0.00 1.74 1.76 0.00 1.78 0.00 0.00 1.93 0.00 0.00 3.10 0.00 0.00 3.42 0.00 0.00 0.00 0.00 1.53 1.48 7.81 4 A 8.93 5.34 1.18 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 0.00 0.00 5 V 8.59 4.93 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 0.77 0.00 0.00 0.92 0.00 0.00 6 C 8.74 4.89 0.00 3.16 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 7 V 8.46 4.69 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 0.95 0.00 0.00 0.93 0.00 0.00 8 L 8.49 4.70 0.00 1.80 1.61 1.05 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.91 4.80 0.00 1.68 1.63 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.40 7.81 10 G 7.91 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.02 4.59 0.00 2.68 2.74 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 12 G 7.61 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 0.00 0.00 0.00 13 P 0.00 4.41 0.00 2.18 2.16 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 2.11 1.94 0.00 14 V 7.67 4.00 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 0.80 0.00 0.00 0.96 0.00 0.00 15 Q 8.68 4.88 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.48 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 16 G 8.01 4.28 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 0.00 17 I 8.39 5.05 1.82 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 1.21 1.01 0.82 0.00 0.00 18 I 8.65 4.65 1.87 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 1.28 2.10 0.59 0.00 0.00 19 N 8.74 4.76 0.00 1.44 1.60 0.00 0.00 6.36 8.01 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 20 F 8.72 5.33 0.00 2.91 2.92 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 21 E 10.04 5.30 0.00 2.45 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 0.00 2.32 2.54 0.00 22 Q 9.70 4.52 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 23 K 8.96 4.12 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.48 1.49 7.81 24 E 7.93 4.73 0.00 1.99 1.81 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 2.29 2.26 0.00 25 S 8.98 4.44 0.00 3.98 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 26 N 8.23 4.81 0.00 2.82 2.91 0.00 0.00 5.89 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 27 G 8.08 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 28 P 0.00 4.72 0.00 2.13 2.10 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 29 V 9.15 4.58 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 1.10 0.00 0.00 1.09 0.00 0.00 30 K 8.91 4.74 0.00 2.04 1.88 0.00 1.43 0.00 0.00 1.42 0.00 0.00 2.67 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.43 7.81 31 V 9.23 4.81 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 0.81 0.00 0.00 1.12 0.00 0.00 32 W 9.55 5.51 0.00 3.48 3.11 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 33 G 7.60 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 34 S 7.78 5.11 0.00 3.87 3.62 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 35 I 8.74 5.10 1.80 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 1.25 0.49 0.94 0.00 0.00 36 K 9.50 4.79 0.00 1.75 1.89 0.00 1.29 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.30 1.43 7.81 37 G 9.03 3.80 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 0.00 0.00 0.00 38 L 7.68 4.61 0.00 1.79 1.55 0.76 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.47 4.21 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 40 E 8.46 3.97 0.00 2.03 1.87 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 2.38 2.36 0.00 41 G 10.63 4.04 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 0.00 42 L 8.12 5.04 0.00 1.51 1.49 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.06 5.02 0.00 3.04 3.34 0.00 5.71 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 44 G 8.89 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 45 F 9.72 5.69 0.00 2.95 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 46 H 9.01 5.38 0.00 3.31 3.08 0.00 5.86 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 47 V 8.49 4.41 2.14 0.00 0.00 0.00 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 0.83 0.00 0.00 48 H 9.18 5.21 0.00 3.03 3.34 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.99 3.70 0.00 1.58 1.12 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 1.63 2.20 0.00 50 F 7.85 4.93 0.00 3.23 2.93 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 0.00 0.00 0.00 51 G 8.34 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 0.00 0.00 0.00 0.00 52 D 7.91 4.79 0.00 2.63 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 53 N 8.43 5.19 0.00 2.73 2.70 0.00 0.00 6.89 7.22 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 54 T 8.56 3.88 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 1.23 0.00 0.00 55 A 7.71 4.63 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 56 G 7.79 3.84 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 0.00 0.00 0.00 57 C 8.57 4.53 0.00 2.94 3.08 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 58 T 7.79 3.86 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 1.22 0.00 0.00 59 S 7.62 4.46 0.00 4.18 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 60 A 7.31 4.44 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 61 G 7.89 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 0.00 0.00 0.00 0.00 62 P 0.00 4.70 0.00 2.12 2.23 0.00 3.59 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 1.98 2.00 0.00 63 H 8.61 4.30 0.00 3.04 3.24 0.00 5.72 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 64 F 9.22 4.41 0.00 2.93 2.97 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 65 N 8.03 4.87 0.00 2.69 2.48 0.00 0.00 6.95 7.71 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 66 P 0.00 4.08 0.00 2.11 2.04 0.00 3.08 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 67 L 7.15 4.00 0.00 1.58 1.64 0.91 0.92 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 *79 R 7.40 4.17 0.00 2.06 1.99 0.00 3.08 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 1.50 1.72 0.00 80 H 8.43 4.58 0.00 3.13 3.32 0.00 5.93 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.53 3.40 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 0.55 0.00 0.00 0.48 0.00 0.00 82 G 8.18 3.82 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 0.00 0.00 0.00 83 D 8.16 4.54 0.00 2.77 2.63 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 84 L 8.37 4.59 0.00 1.72 1.79 0.69 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 85 G 9.12 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 86 N 8.70 5.60 0.00 2.57 2.83 0.00 0.00 6.61 7.68 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 87 V 8.93 4.32 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 -0.35 0.00 0.00 0.70 0.00 0.00 88 T 8.11 4.93 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 1.19 0.00 0.00 89 A 9.49 4.61 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 90 D 9.17 4.77 0.00 2.86 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 91 K 8.28 4.34 0.00 1.81 2.48 0.00 1.06 0.00 0.00 0.61 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.48 7.81 92 D 8.33 4.57 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 93 G 7.93 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.90 4.82 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 0.83 0.00 0.00 1.00 0.00 0.00 95 A 9.15 5.32 1.16 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 0.00 0.00 0.00 96 D 8.70 5.09 0.00 2.54 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 97 V 9.10 4.29 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 0.97 0.00 0.00 0.62 0.00 0.00 98 S 8.43 4.96 0.00 3.91 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 99 I 9.31 4.89 2.01 0.00 0.00 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 1.19 0.72 1.02 0.00 0.00 100 E 8.82 5.21 0.00 1.96 1.81 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 2.21 2.32 0.00 101 D 9.65 5.00 0.00 2.81 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.92 4.77 0.00 3.88 3.85 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 0.00 103 V 8.00 4.04 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 0.83 0.00 0.00 0.95 0.00 0.00 104 I 7.97 3.97 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.79 1.01 0.00 0.00 105 S 8.79 4.73 0.00 3.86 3.85 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 0.00 106 L 9.27 4.48 0.00 1.83 1.66 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.95 4.55 0.00 3.96 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 0.00 108 G 8.61 3.81 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 0.00 0.00 0.00 109 D 8.73 4.44 0.00 2.64 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 0.00 110 H 8.06 5.08 0.00 3.23 3.27 0.00 5.69 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.28 5.11 0.00 3.01 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 0.00 112 I 8.09 3.89 1.61 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.12 1.01 0.00 0.00 113 T 7.40 3.90 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 1.19 0.00 0.00 114 G 9.14 3.82 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 0.00 0.00 0.00 115 R 7.38 4.92 0.00 1.61 1.69 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.23 0.00 116 T 7.72 4.96 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 1.25 0.00 0.00 117 L 8.62 4.68 0.00 1.79 1.56 0.25 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.75 5.08 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 0.76 0.00 0.00 0.76 0.00 0.00 119 V 8.64 5.09 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 0.83 0.00 0.00 1.03 0.00 0.00 120 H 9.12 5.23 0.00 3.20 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.15 4.12 0.00 2.25 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 2.36 2.32 0.00 122 K 8.10 4.63 0.00 1.88 1.73 0.00 1.76 0.00 0.00 1.86 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.50 1.47 7.81 123 A 8.49 4.36 1.23 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 0.00 0.00 124 D 9.04 4.34 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 *141 G 8.05 3.79 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 0.00 0.00 0.00 142 S 8.48 4.29 0.00 3.92 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 0.00 143 R 8.28 4.58 0.00 1.63 1.78 0.00 3.20 0.00 0.00 3.05 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.57 0.00 144 L 8.93 4.32 0.00 1.71 1.69 0.89 0.69 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 0.00 145 A 7.77 4.98 1.25 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 0.00 0.00 146 C 8.77 5.63 0.00 2.97 3.13 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 0.00 147 G 8.11 4.74 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 0.00 148 V 8.32 4.43 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 0.81 0.00 0.00 0.92 0.00 0.00 149 I 9.21 4.12 1.80 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.58 0.48 0.00 0.00 150 G 9.14 4.50 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 0.00 151 I 8.28 4.57 1.86 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 1.26 0.55 0.91 0.00 0.00 152 A 8.35 4.84 1.18 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 0.00 0.00 153 Q 8.55 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.