NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 G 3.9444 8.3549 109.7392 44.3980 0.0000 173.0793 13 P 4.6702 0.0000 0.0000 60.8943 31.8974 174.6713 14 M 4.9594 9.9491 121.1299 53.1219 35.3452 174.3179 15 D 4.8565 8.7378 119.2256 54.8764 41.8118 175.2942 16 A 5.0999 8.7022 122.9297 50.8538 23.1487 175.0082 17 S 4.7162 8.8277 111.7044 56.7857 66.0721 175.8526 18 V 3.7577 8.3502 114.1060 63.7714 31.4475 177.6945 19 E 4.0769 7.7760 119.2280 58.7331 29.7127 177.7124 20 E 4.2354 8.2810 120.1818 55.3786 30.7181 176.6063 21 E 4.0010 9.0825 125.1606 59.7398 29.5637 179.3698 22 G 3.7353 8.0450 106.1214 47.1530 0.0000 175.5986 23 V 3.1311 7.6224 120.0705 65.6470 31.6547 177.9309 24 R 3.8665 7.9643 118.4006 59.4574 29.8853 178.7659 25 R 3.8590 8.1476 117.8343 59.0917 29.9806 178.8062 26 A 3.8716 7.9374 121.0010 54.8842 18.1840 179.4211 27 L 3.9110 8.1589 119.1371 58.5101 42.1799 179.0019 28 D 4.3180 8.1714 118.7930 57.1896 40.6933 178.5187 29 F 4.0933 8.3646 120.9111 61.2959 39.3957 177.0388 30 A 3.4439 8.2011 120.6416 54.8963 17.9842 179.7136 31 V 3.4348 7.7331 117.0850 65.9188 31.5074 178.2393 32 G 3.6411 8.2419 105.8458 48.0021 0.0000 175.4350 33 E 3.7241 7.8253 121.1875 58.9494 29.4154 178.4495 34 Y 3.9376 7.8555 119.7426 61.0715 38.5457 178.3626 35 N 4.2997 8.2461 115.7121 56.0882 38.7637 176.8126 36 K 3.8946 8.0869 120.1347 59.7435 32.2569 178.2180 37 A 4.0553 7.7070 119.5211 53.8026 18.7764 178.1565 38 S 3.9955 6.9790 110.7183 58.7054 62.8596 173.7846 39 N 4.6142 8.3505 121.1592 53.2670 39.0990 175.2711 40 D 4.4211 7.9646 118.8453 54.8932 41.7673 176.2911 41 M 4.0854 8.7886 124.5018 57.3037 32.7050 174.7712 42 Y 5.2474 8.2911 115.4647 56.3482 41.5594 174.9368 43 H 4.6818 9.4823 122.6073 56.4547 31.0491 174.2818 44 S 5.5243 9.3488 122.2735 57.0591 65.2263 173.3891 45 R 4.7956 8.8958 118.1178 54.3148 33.7132 173.8455 46 A 4.6681 8.6496 121.7054 52.1785 18.0063 177.4173 47 C 4.0913 8.5975 118.5671 60.6402 30.7552 174.1466 48 Q 4.4918 7.7139 120.5242 54.7255 32.3772 173.1743 49 V 4.2949 8.4250 126.7266 62.0212 31.7535 175.3822 50 V 3.9631 8.8668 129.5557 65.3685 32.2430 176.3127 51 R 4.8240 7.7236 118.7373 54.9369 33.8916 173.2416 52 A 5.2972 8.6727 126.1508 50.4715 22.4062 175.0417 53 R 5.3789 9.3068 120.5272 54.6368 35.3442 174.2446 54 K 5.1785 9.1642 119.2125 55.8898 36.9713 174.8036 55 Q 4.7805 8.7818 121.4217 54.6916 32.6085 173.5744 56 I 4.5650 8.5793 127.7677 60.1604 37.5640 175.6604 57 V 4.4087 8.7978 122.2478 61.8746 31.6740 179.6747 58 A 4.5140 8.6089 125.3238 49.1471 17.3971 175.3545 59 G 3.6815 7.9676 107.2987 43.1952 0.0000 169.9364 60 V 4.7507 8.4008 119.3460 61.2875 35.1266 175.3275 61 N 5.1297 9.1195 125.8123 52.0406 40.4649 173.4205 62 Y 4.8716 8.6803 121.9462 56.3145 40.7014 174.7163 63 F 5.2620 9.3176 123.0824 55.9110 41.7096 174.3853 64 L 5.3725 9.2945 124.5349 52.9463 45.1432 175.3848 65 D 5.3432 9.4764 124.0232 52.7178 43.3580 175.9491 66 V 4.9675 8.8148 115.9976 59.8960 37.2501 173.8067 67 E 4.9775 9.0713 121.4447 54.7261 31.8575 175.2953 68 L 5.1555 8.6277 124.7468 53.1958 44.5407 175.4007 69 C 5.1861 8.8003 119.8624 57.7823 32.5190 173.8501 70 R 4.7212 9.0412 121.7651 56.5102 31.0854 175.8500 71 T 5.2354 8.5264 112.4962 59.9852 71.3939 174.3129 72 T 4.0468 8.3093 110.8906 63.3241 69.4896 174.6849 73 C 4.7634 8.2523 121.3172 56.3477 39.2495 173.4316 74 T 4.4106 8.4519 114.0821 60.7254 69.5409 175.7909 75 K 3.8583 8.3294 123.0717 59.7904 32.3609 179.0375 76 T 3.9617 7.8542 108.3715 64.1626 69.2624 174.7394 77 Q 4.3537 7.4309 119.7156 53.8054 29.9352 173.4897 78 P 4.4092 0.0000 0.0000 63.0640 32.2038 176.6373 79 N 4.6826 8.1451 119.5220 52.3139 40.9163 173.5787 *82 N 4.6100 8.6600 115.5786 54.4230 40.6013 176.6535 83 C 3.7902 8.1069 113.7311 56.5802 36.0160 171.9050 84 P 4.4587 0.0000 0.0000 62.0328 32.9013 175.3762 85 F 4.9906 8.2042 120.0781 57.4355 39.7243 175.1929 86 H 4.1928 8.6984 120.6625 56.6642 28.5186 175.4970 87 D 4.4906 8.8589 121.8623 55.6660 40.3229 176.9514 88 Q 4.2103 7.9498 119.8196 54.4919 29.5329 174.5861 89 P 4.2438 0.0000 0.0000 66.2123 31.4512 177.8227 90 H 4.5216 8.1694 111.5754 56.9889 28.9169 175.6910 91 L 4.3536 7.4884 118.5798 55.6828 43.3100 177.7312 92 K 3.9497 8.7542 120.3474 59.0048 32.6725 177.1387 93 R 3.6542 7.9911 115.2857 56.3534 27.6951 176.6917 94 K 4.0107 7.6050 118.0583 57.1544 33.6733 175.8933 95 A 4.7190 8.6462 128.0382 50.0670 22.8127 174.8743 96 F 5.0661 9.1878 120.9385 56.5296 40.4719 174.2897 97 C 5.3399 9.1952 122.2961 55.0075 42.2601 173.3321 98 S 5.0403 8.6886 118.8161 56.6925 65.3626 173.1024 99 F 5.6774 9.0175 123.4816 55.7347 42.3385 174.2567 100 Q 5.0722 9.3979 123.5624 54.4804 31.7583 173.9839 101 I 5.0355 8.8367 127.5738 59.6971 40.5626 173.8949 102 Y 4.9838 9.0434 128.6741 56.2758 40.1555 173.8811 103 A 4.6018 8.4137 129.1073 50.0340 22.2240 175.2749 104 V 3.3694 7.5961 121.4930 59.6362 31.8501 174.2218 105 P 3.9989 0.0000 0.0000 64.5935 31.5973 178.3059 106 W 4.5197 7.3168 112.1556 57.6086 28.2230 176.2280 107 Q 4.4235 7.5543 117.0575 54.9443 29.3976 175.6805 108 G 3.8327 7.8478 106.0514 46.5817 0.0000 173.5840 109 T 4.5602 7.2212 108.5355 59.9246 71.8179 172.7935 110 M 5.0149 7.9134 122.0649 54.5266 35.3043 173.7816 111 T 4.8664 8.8664 115.7381 59.7883 72.8428 172.8013 112 L 4.7055 8.8985 126.2068 54.8056 41.9626 176.3336 113 S 4.5058 9.0813 124.0954 61.2689 63.4666 175.1429 114 K 4.8454 7.9567 116.6254 55.3170 36.8148 175.4235 115 S 5.2581 8.5080 116.4448 57.7065 65.6732 173.3415 116 T 4.6797 9.0554 121.6645 60.9124 70.4762 171.5386 117 C 5.6204 9.0582 126.1308 55.1752 40.4273 173.4572 118 Q 4.7877 8.7791 120.1202 54.5516 32.0192 174.3829 119 D 5.0100 8.7438 120.2798 53.2277 42.4221 176.4052 120 A 4.3135 7.8169 121.4864 53.0289 18.3497 177.6965 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 12 G 8.35 3.94 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 0.00 0.00 0.00 13 P 0.00 4.67 0.00 1.91 1.88 0.00 3.55 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.89 0.00 14 M 9.95 4.96 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.73 0.00 15 D 8.74 4.86 0.00 2.61 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 16 A 8.70 5.10 1.31 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 0.00 0.00 0.00 17 S 8.83 4.72 0.00 3.94 3.95 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 18 V 8.35 3.76 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 0.76 0.00 0.00 0.96 0.00 0.00 19 E 7.78 4.08 0.00 1.93 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 2.37 2.31 0.00 20 E 8.28 4.24 0.00 2.18 1.94 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 2.38 2.43 0.00 21 E 9.08 4.00 0.00 2.07 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 2.46 0.00 22 G 8.05 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 23 V 7.62 3.13 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 1.12 0.00 0.00 1.14 0.00 0.00 24 R 7.96 3.87 0.00 1.88 2.01 0.00 3.29 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 25 R 8.15 3.86 0.00 1.87 1.85 0.00 3.12 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 26 A 7.94 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.16 3.91 0.00 1.83 1.93 1.03 1.18 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 28 D 8.17 4.32 0.00 2.88 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 29 F 8.36 4.09 0.00 3.10 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 30 A 8.20 3.44 0.70 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 31 V 7.73 3.43 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 1.08 0.00 0.00 0.98 0.00 0.00 32 G 8.24 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.83 3.72 0.00 1.77 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 0.00 1.47 1.69 0.00 34 Y 7.86 3.94 0.00 2.95 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 35 N 8.25 4.30 0.00 2.76 2.91 0.00 0.00 7.05 8.43 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 36 K 8.09 3.89 0.00 1.74 1.91 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.43 7.81 37 A 7.71 4.06 1.20 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 0.00 0.00 0.00 0.00 0.00 38 S 6.98 4.00 0.00 3.41 3.73 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 39 N 8.35 4.61 0.00 2.72 2.82 0.00 0.00 6.88 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 40 D 7.96 4.42 0.00 2.66 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 41 M 8.79 4.09 0.00 1.91 1.94 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 2.38 1.73 0.00 42 Y 8.29 5.25 0.00 3.05 3.01 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 43 H 9.48 4.68 0.00 3.27 3.35 0.00 5.74 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 9.35 5.52 0.00 4.01 3.75 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 45 R 8.90 4.80 0.00 1.94 2.02 0.00 2.75 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.85 0.00 46 A 8.65 4.67 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 C 8.60 4.09 0.00 2.47 1.51 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 48 Q 7.71 4.49 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 49 V 8.42 4.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.98 0.00 0.00 50 V 8.87 3.96 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 0.76 0.00 0.00 0.99 0.00 0.00 51 R 7.72 4.82 0.00 1.90 1.88 0.00 3.18 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 52 A 8.67 5.30 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 53 R 9.31 5.38 0.00 1.96 1.98 0.00 3.07 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 54 K 9.16 5.18 0.00 1.40 1.73 0.00 1.19 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.34 7.81 55 Q 8.78 4.78 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 56 I 8.58 4.56 1.91 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 1.37 0.96 1.00 0.00 0.00 57 V 8.80 4.41 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 0.76 0.00 0.00 1.14 0.00 0.00 58 A 8.61 4.51 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 59 G 7.97 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 60 V 8.40 4.75 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 0.45 0.00 0.00 0.96 0.00 0.00 61 N 9.12 5.13 0.00 2.54 2.07 0.00 0.00 6.52 7.08 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 62 Y 8.68 4.87 0.00 2.84 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 63 F 9.32 5.26 0.00 3.00 3.01 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 64 L 9.29 5.37 0.00 1.79 1.69 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 65 D 9.48 5.34 0.00 2.52 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 0.00 0.00 0.00 0.00 66 V 8.81 4.97 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 0.82 0.00 0.00 0.94 0.00 0.00 67 E 9.07 4.98 0.00 1.78 1.61 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 2.11 2.40 0.00 68 L 8.63 5.16 0.00 1.34 1.35 0.20 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 69 C 8.80 5.19 0.00 2.21 2.60 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 70 R 9.04 4.72 0.00 2.05 1.93 0.00 3.11 0.00 0.00 3.47 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 71 T 8.53 5.24 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 1.21 0.00 0.00 72 T 8.31 4.05 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 1.05 0.00 0.00 73 C 8.25 4.76 0.00 3.03 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 74 T 8.45 4.41 3.95 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 0.81 0.00 0.00 75 K 8.33 3.86 0.00 1.71 1.89 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.50 1.41 7.81 76 T 7.85 3.96 4.20 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 0.00 0.00 1.16 0.00 0.00 77 Q 7.43 4.35 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 7.01 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 78 P 0.00 4.41 0.00 2.04 2.00 0.00 3.64 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 79 N 8.15 4.68 0.00 2.62 2.72 0.00 0.00 6.89 8.00 0.00 0.00 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 N 8.66 4.61 0.00 2.66 2.83 0.00 0.00 6.80 7.65 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 83 C 8.11 3.79 0.00 2.93 3.04 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 84 P 0.00 4.46 0.00 2.04 2.08 0.00 3.62 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 1.97 1.93 0.00 85 F 8.20 4.99 0.00 2.99 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 86 H 8.70 4.19 0.00 3.11 3.26 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.86 4.49 0.00 2.80 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 88 Q 7.95 4.21 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.87 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 89 P 0.00 4.24 0.00 2.16 2.11 0.00 3.56 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 90 H 8.17 4.52 0.00 3.09 3.30 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.49 4.35 0.00 1.59 1.15 0.75 0.77 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 92 K 8.75 3.95 0.00 1.96 1.92 0.00 1.70 0.00 0.00 1.51 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.39 7.81 93 R 7.99 3.65 0.00 1.91 1.89 0.00 3.21 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 94 K 7.60 4.01 0.00 1.64 1.47 0.00 1.40 0.00 0.00 1.61 0.00 0.00 2.59 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.88 1.11 7.81 95 A 8.65 4.72 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 F 9.19 5.07 0.00 2.89 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 97 C 9.20 5.34 0.00 2.33 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 0.00 0.00 0.00 98 S 8.69 5.04 0.00 3.68 3.73 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 99 F 9.02 5.68 0.00 3.00 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 0.00 100 Q 9.40 5.07 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 101 I 8.84 5.04 2.02 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.78 0.97 0.00 0.00 102 Y 9.04 4.98 0.00 3.05 2.87 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 0.00 103 A 8.41 4.60 1.07 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 0.00 104 V 7.60 3.37 1.57 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 0.11 0.00 0.00 0.34 0.00 0.00 105 P 0.00 4.00 0.00 2.28 2.04 0.00 2.31 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.92 0.00 106 W 7.32 4.52 0.00 3.37 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 0.00 107 Q 7.55 4.42 0.00 1.81 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.31 2.00 0.00 108 G 7.85 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 0.00 109 T 7.22 4.56 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 1.11 0.00 0.00 110 M 7.91 5.01 0.00 1.08 1.43 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.97 0.00 111 T 8.87 4.87 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 1.25 0.00 0.00 112 L 8.90 4.71 0.00 1.76 1.72 1.11 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.08 4.51 0.00 3.99 3.95 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 0.00 114 K 7.96 4.85 0.00 1.77 1.73 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.53 7.81 115 S 8.51 5.26 0.00 4.07 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 0.00 116 T 9.06 4.68 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 1.23 0.00 0.00 117 C 9.06 5.62 0.00 3.01 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 0.00 118 Q 8.78 4.79 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 119 D 8.74 5.01 0.00 2.58 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 0.00 120 A 7.82 4.31 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 * Residues marked with a * may have inaccurate shift predictions.