NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6294 8.1476 120.2827 55.1642 34.3494 173.6464 2 K 4.7965 8.4435 121.3902 55.3371 34.8439 170.3738 3 V 4.9514 9.0318 116.8005 59.5182 36.6467 175.3471 4 I 5.4007 8.5933 123.3472 59.1136 39.6897 174.1696 5 L 4.9824 8.4802 129.2650 53.2649 42.7345 176.6965 6 L 4.7054 7.9007 125.9218 52.6158 38.2199 176.1117 7 E 5.5492 7.5235 127.0826 55.6284 32.3143 174.3778 8 P 4.3580 0.0000 0.0000 62.8731 31.9572 175.5205 9 L 4.8312 8.9189 123.9207 54.1099 46.1572 176.7829 10 E 3.4024 8.2827 114.5638 55.6074 30.8054 179.4973 11 N 4.3961 9.4786 128.8030 56.9433 38.8724 173.8932 12 L 4.1152 7.0426 117.6107 54.0949 42.3608 180.2206 13 G 3.8906 7.4980 106.9602 46.2212 0.0000 171.0863 14 D 4.8341 8.3284 119.6173 52.2002 42.8151 175.9036 15 V 3.9100 7.6742 120.2311 62.3027 31.4311 176.1448 16 G 3.8319 8.6478 105.7761 46.7450 0.0000 173.8097 17 Q 4.2842 8.5274 119.1603 55.7237 30.2794 175.1051 18 V 4.8806 8.2811 121.8734 61.2594 33.2998 175.1466 19 V 4.6222 8.9819 126.8641 60.2176 35.4228 173.7747 20 D 5.1971 8.7095 121.9486 53.5303 41.9000 176.3566 21 V 4.5415 8.5125 117.6111 59.4730 35.0237 175.0772 22 K 4.4741 8.4030 120.0144 54.9985 33.2330 176.2172 23 P 4.3567 0.0000 0.0000 65.7709 31.2167 178.8449 24 G 3.9814 8.2381 103.9099 48.1634 0.0000 174.7569 25 Y 4.3654 8.2817 121.9948 60.5888 38.7979 177.7103 26 A 3.9145 8.0275 121.1850 55.4613 18.4152 179.7121 27 R 4.0065 9.1422 116.9412 58.1707 30.3315 178.0408 28 N 4.9705 8.0302 113.5613 53.6690 39.8146 173.9406 29 Y 4.6045 7.6060 120.4697 58.4514 42.2440 176.2464 30 L 3.6457 7.7452 118.8481 57.2991 42.7959 179.6895 31 L 3.9123 8.4302 119.2017 57.9306 41.8695 178.0392 32 P 4.2291 0.0000 0.0000 65.7049 31.5127 178.5571 33 R 4.0841 7.9354 112.6863 55.8733 29.6265 176.8410 34 G 3.9796 7.5860 106.1634 46.4525 0.0000 174.8459 35 L 4.0752 7.4271 118.5906 55.6795 41.8894 175.9625 36 A 4.5586 7.1511 118.6146 51.2402 22.4121 175.2687 37 V 4.4955 9.2451 118.7424 60.7863 35.7223 174.5874 38 L 4.3475 8.5847 124.7298 54.6937 42.6776 178.5170 39 A 4.6816 8.3911 126.9952 51.4857 17.7184 178.0000 40 T 3.8582 8.2304 110.2669 63.3726 68.9035 174.7890 41 E 4.1201 8.8045 124.0828 59.2547 29.8158 178.2599 42 S 4.3817 8.0364 111.0831 59.6654 62.2991 173.6837 43 N 5.0005 8.6620 115.3297 53.3986 40.5094 176.5720 44 L 3.7963 7.9147 117.9368 57.3392 41.7167 179.4065 45 K 4.0213 7.8183 117.8241 59.1686 31.1067 178.7285 46 A 4.2302 7.5033 118.5137 53.4265 18.0667 178.2018 47 L 4.5560 7.4425 118.6462 56.0776 43.1723 177.8732 48 E 3.9173 7.9082 118.3151 59.4791 29.3245 178.9489 49 A 4.1800 7.8754 119.2935 54.2257 18.8762 179.6294 50 R 3.9088 7.3052 116.6830 59.3741 29.8779 178.9507 51 I 3.8483 8.1301 120.0895 64.5634 37.2155 178.7174 52 R 3.8865 8.3521 118.5876 59.1529 30.1134 178.2415 53 A 4.4718 7.6450 118.3927 52.1155 18.4515 177.1855 54 Q 4.4933 7.6965 115.4233 55.9766 30.9107 176.8619 55 A 4.2904 7.8933 119.2716 55.0250 18.3614 178.9037 56 K 4.3246 8.5238 116.4763 58.5407 32.9298 178.4591 57 R 3.9737 7.8653 118.3648 57.7965 30.6105 176.0289 58 L 4.7459 7.5929 115.7181 55.0236 44.0235 177.7275 59 A 4.3219 8.3512 121.6191 51.8162 17.7209 176.8272 60 E 4.7218 7.7784 121.8261 57.6339 35.5679 176.4007 61 R 4.3152 8.1794 116.0810 56.7819 30.3986 176.4680 62 K 4.2857 7.6278 117.3190 58.6755 33.1341 177.5165 63 A 4.2056 7.9079 118.4872 53.7186 18.4066 177.9675 64 E 4.3019 7.8005 117.3426 58.0898 30.2746 177.1878 65 A 4.3868 7.6966 115.9054 52.9234 18.1495 177.9920 66 E 4.1149 7.8511 119.1070 58.6683 29.7177 178.7668 67 R 4.0212 7.7820 118.4696 58.9127 29.4527 178.2083 68 L 4.1617 7.9415 115.8670 56.0187 41.6353 177.8719 69 K 4.4409 7.2848 118.2689 56.9315 33.6541 177.2895 70 E 4.1238 8.3009 118.2987 58.7555 29.3762 177.5058 71 I 4.4176 7.5081 114.4457 60.5837 39.8261 175.5249 72 L 4.2759 7.3505 118.3486 55.5406 42.1996 176.6913 73 E 4.6764 7.8746 118.7731 57.2713 30.7022 178.6530 74 N 4.7020 8.0878 112.5576 52.7411 37.8226 174.3315 75 L 4.4286 7.6733 116.7614 54.8199 46.5178 174.1940 76 T 4.7274 8.1140 121.9165 59.9642 67.5386 176.7008 77 L 4.7663 8.6450 123.6138 54.0834 45.6476 173.2993 78 T 4.4023 8.7511 117.4930 61.9320 69.2134 174.3281 79 I 4.2997 8.6498 127.2571 58.2062 38.0772 172.7411 80 P 4.8730 0.0000 0.0000 62.4766 28.3770 174.2544 81 V 4.2956 7.7397 115.7999 60.6525 34.0628 175.4413 82 R 4.3049 8.5817 128.8061 57.0389 30.9607 174.2301 83 A 4.5875 8.5531 119.0165 52.3440 21.9015 174.8221 84 G 3.4257 9.5052 112.1028 47.1321 0.0000 174.0176 85 E 4.7039 8.7019 120.3769 56.0254 33.0954 176.4879 86 T 4.4895 7.6634 111.6262 64.1028 72.7414 173.1104 87 K 4.6499 7.5642 121.2640 54.4299 36.1863 175.9543 88 I 4.3191 8.3677 123.3932 61.9612 37.5793 175.9370 89 Y 4.1480 9.6958 120.8380 59.6508 39.0043 177.5642 90 G 4.1746 7.6179 113.4857 45.1525 0.0000 173.9762 91 S 5.1969 9.2416 119.1263 59.5359 64.1328 176.3462 92 V 3.8867 7.7607 117.7820 62.4100 30.1984 175.6119 93 T 4.4272 8.3053 126.2226 61.8241 68.4028 176.9264 94 A 4.2781 8.5731 118.8527 54.3867 18.2934 179.4938 95 K 3.9798 7.9692 117.2605 59.7053 32.2356 178.8618 96 D 4.3237 8.0393 119.7438 56.8611 40.8029 177.4661 97 I 4.1381 7.4328 117.9710 61.9624 36.9155 177.1190 98 A 4.0374 8.7838 128.0235 55.8020 18.6494 177.8952 99 E 3.8354 9.6385 119.8258 58.4246 29.8611 177.5680 100 A 4.2577 8.2028 122.1064 53.7565 18.8619 179.1332 101 L 3.8004 7.7812 119.2099 57.9208 42.4457 178.2336 102 S 5.0991 8.2359 112.7935 59.0228 61.9631 175.1341 103 R 4.2311 7.5402 119.1398 58.8661 30.9381 178.2026 104 Q 4.1760 8.6650 116.8941 58.5609 29.0700 176.9089 105 H 4.7419 8.3839 110.3549 57.9045 34.5251 173.0081 106 G 3.4607 8.1423 106.9598 45.8152 0.0000 173.1440 107 I 3.9472 7.6291 121.2465 60.3342 38.7816 174.8232 108 T 4.6014 8.2589 123.6829 62.5666 68.9849 174.2529 109 I 4.5268 7.9592 118.4656 59.7792 40.4530 173.4219 110 D 5.0108 8.6445 121.3827 52.4709 43.0536 174.6438 111 P 4.8821 0.0000 0.0000 62.6569 31.4968 176.1769 112 K 4.4172 7.7469 117.4026 58.1804 35.4803 178.4293 113 R 3.7680 7.8430 117.0961 58.6625 31.0358 177.0185 114 L 4.2208 7.0072 121.8577 54.5054 42.3626 178.5951 115 A 4.4570 8.8987 130.8611 51.4945 14.8664 175.9063 116 L 4.6041 7.5057 121.5411 53.4831 45.7346 174.2769 117 E 4.7176 8.3295 116.6332 57.0028 34.7112 175.8638 118 K 4.0702 7.7798 119.2511 55.1164 32.8352 175.0701 119 P 4.3722 0.0000 0.0000 61.9430 30.0918 175.7024 120 I 3.6561 8.0496 124.4394 61.6738 37.8135 177.3017 121 K 4.8662 7.8345 127.5577 53.6784 32.6008 174.7342 122 E 4.7579 7.2882 116.2633 55.2744 32.8233 174.8335 123 L 4.2477 8.8530 128.2032 53.8102 43.0188 176.2031 124 G 4.3836 7.6189 117.3814 46.1118 0.0000 171.0398 125 E 4.5656 7.8984 119.3290 55.8185 31.6607 175.6171 126 Y 4.6111 7.8554 117.1873 57.5430 42.5699 173.1650 127 V 4.4943 8.5792 121.3237 62.6632 34.4043 176.1485 128 L 4.8547 8.7456 129.5907 53.9533 44.9743 175.2153 129 T 5.8099 8.0816 113.8512 63.0791 73.0946 172.3448 130 Y 5.1058 8.4626 122.1901 56.2250 42.7894 173.9274 131 K 4.4348 7.7440 124.4912 55.2592 30.4185 173.8659 132 P 4.2944 0.0000 0.0000 64.1343 32.1635 176.9026 133 H 4.4491 8.4698 121.0151 53.9098 30.3355 173.9609 134 P 4.4504 0.0000 0.0000 63.6930 30.9039 176.6576 135 E 4.6461 8.0540 114.6348 56.0943 31.1993 176.2817 136 V 4.4720 8.2407 119.1938 60.9683 31.6952 171.7183 137 P 4.7121 0.0000 0.0000 63.2905 32.8127 177.4788 138 I 4.7190 8.1906 119.1944 59.7707 41.2746 174.9467 139 Q 5.2712 9.7637 125.4752 54.6685 29.9971 174.9064 140 L 4.6772 8.3279 127.8524 53.0082 43.3061 175.2458 141 K 4.3048 8.5371 126.7240 56.8088 32.9267 177.9983 142 V 4.0467 8.0323 127.0988 64.4904 32.5596 175.2446 143 S 5.7438 8.0946 117.6464 59.5164 65.0653 179.3010 144 V 4.3987 7.0385 119.8679 62.1987 28.7338 175.7913 145 V 3.7740 7.9195 125.6055 63.4871 31.2779 175.3524 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 M 8.15 4.63 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 2 K 8.44 4.80 0.00 1.92 2.24 0.00 1.45 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.54 7.81 3 V 9.03 4.95 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 1.00 0.00 0.00 4 I 8.59 5.40 1.87 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 0.91 1.68 0.96 0.00 0.00 5 L 8.48 4.98 0.00 1.84 1.75 0.95 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.90 4.71 0.00 1.64 1.73 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.52 5.55 0.00 1.99 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 2.04 2.09 0.00 8 P 0.00 4.36 0.00 2.23 2.31 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 9 L 8.92 4.83 0.00 1.66 1.66 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.28 3.40 0.00 2.07 1.42 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 2.44 2.34 0.00 11 N 9.48 4.40 0.00 2.65 2.86 0.00 0.00 6.90 7.78 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 12 L 7.04 4.12 0.00 1.98 1.61 1.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 13 G 7.50 3.89 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 0.00 0.00 0.00 14 D 8.33 4.83 0.00 2.63 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 15 V 7.67 3.91 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 1.24 0.00 0.00 0.92 0.00 0.00 16 G 8.65 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 17 Q 8.53 4.28 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 18 V 8.28 4.88 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 0.84 0.00 0.00 0.94 0.00 0.00 19 V 8.98 4.62 2.11 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 0.94 0.00 0.00 0.97 0.00 0.00 20 D 8.71 5.20 0.00 2.58 2.67 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 21 V 8.51 4.54 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 1.01 0.00 0.00 1.10 0.00 0.00 22 K 8.40 4.47 0.00 1.85 1.75 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.45 7.81 23 P 0.00 4.36 0.00 2.18 2.14 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 24 G 8.24 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.28 4.37 0.00 2.96 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 26 A 8.03 3.91 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 27 R 9.14 4.01 0.00 1.82 2.02 0.00 3.13 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 28 N 8.03 4.97 0.00 2.96 2.89 0.00 0.00 6.67 7.13 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 29 Y 7.61 4.60 0.00 2.89 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 30 L 7.75 3.65 0.00 1.68 1.43 0.81 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.43 3.91 0.00 1.78 1.72 0.94 0.94 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 32 P 0.00 4.23 0.00 1.94 2.08 0.00 3.70 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 2.11 2.26 0.00 33 R 7.94 4.08 0.00 1.38 1.67 0.00 3.30 0.00 0.00 3.09 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.87 0.00 34 G 7.59 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.43 4.08 0.00 1.52 1.62 0.75 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.15 4.56 1.19 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 0.00 0.00 37 V 9.25 4.50 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 0.96 0.00 0.00 0.91 0.00 0.00 38 L 8.58 4.35 0.00 1.60 1.59 0.92 0.93 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 39 A 8.39 4.68 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 40 T 8.23 3.86 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 1.21 0.00 0.00 41 E 8.80 4.12 0.00 2.02 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 2.38 2.31 0.00 42 S 8.04 4.38 0.00 3.87 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 43 N 8.66 5.00 0.00 2.88 2.76 0.00 0.00 6.91 6.61 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 44 L 7.91 3.80 0.00 1.69 1.72 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.82 4.02 0.00 1.87 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.59 7.81 46 A 7.50 4.23 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 47 L 7.44 4.56 0.00 1.93 1.74 0.92 0.97 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 48 E 7.91 3.92 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 2.55 2.49 0.00 49 A 7.88 4.18 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 50 R 7.31 3.91 0.00 2.13 2.00 0.00 3.17 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 51 I 8.13 3.85 2.14 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 1.64 1.39 0.91 0.00 0.00 52 R 8.35 3.89 0.00 1.87 1.98 0.00 3.17 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 53 A 7.64 4.47 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 54 Q 7.70 4.49 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 55 A 7.89 4.29 1.40 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 0.00 0.00 0.00 56 K 8.52 4.32 0.00 1.95 2.07 0.00 1.32 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.44 7.81 57 R 7.87 3.97 0.00 1.96 1.89 0.00 3.18 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 58 L 7.59 4.75 0.00 1.90 1.65 0.92 0.78 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 59 A 8.35 4.32 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 60 E 7.78 4.72 0.00 2.04 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 2.24 2.24 0.00 61 R 8.18 4.32 0.00 1.98 1.95 0.00 3.28 0.00 0.00 3.17 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 62 K 7.63 4.29 0.00 1.94 1.70 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.17 0.77 7.81 63 A 7.91 4.21 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 64 E 7.80 4.30 0.00 2.20 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 2.24 2.36 0.00 65 A 7.70 4.39 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 66 E 7.85 4.11 0.00 2.21 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 2.28 2.33 0.00 67 R 7.78 4.02 0.00 2.04 1.94 0.00 3.22 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 68 L 7.94 4.16 0.00 1.86 1.66 0.74 0.77 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 69 K 7.28 4.44 0.00 1.70 2.01 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.42 7.81 70 E 8.30 4.12 0.00 2.17 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 2.57 2.38 0.00 71 I 7.51 4.42 1.85 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 1.37 0.86 0.93 0.00 0.00 72 L 7.35 4.28 0.00 2.10 1.64 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 73 E 7.87 4.68 0.00 2.02 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 2.29 2.32 0.00 74 N 8.09 4.70 0.00 2.83 2.81 0.00 0.00 6.68 7.85 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 75 L 7.67 4.43 0.00 1.44 1.62 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 76 T 8.11 4.73 4.54 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 1.21 0.00 0.00 77 L 8.65 4.77 0.00 1.66 1.62 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.75 4.40 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 79 I 8.65 4.30 2.03 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 1.45 1.09 0.95 0.00 0.00 80 P 0.00 4.87 0.00 1.93 2.02 0.00 3.63 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 2.03 2.08 0.00 81 V 7.74 4.30 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 0.85 0.00 0.00 1.00 0.00 0.00 82 R 8.58 4.30 0.00 1.70 1.54 0.00 2.46 0.00 0.00 3.07 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 83 A 8.55 4.59 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 84 G 9.51 3.43 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 85 E 8.70 4.70 0.00 1.90 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 2.22 2.26 0.00 86 T 7.66 4.49 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 1.22 0.00 0.00 87 K 7.56 4.65 0.00 1.71 1.71 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.44 7.81 88 I 8.37 4.32 1.91 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 0.84 1.01 0.00 0.00 89 Y 9.70 4.15 0.00 2.93 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 90 G 7.62 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 91 S 9.24 5.20 0.00 3.78 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 92 V 7.76 3.89 2.11 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 1.03 0.00 0.00 0.94 0.00 0.00 93 T 8.31 4.43 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 94 A 8.57 4.28 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 95 K 7.97 3.98 0.00 1.83 1.86 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.54 7.81 96 D 8.04 4.32 0.00 2.70 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 97 I 7.43 4.14 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.27 0.95 0.00 0.00 98 A 8.78 4.04 1.48 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 99 E 9.64 3.84 0.00 1.95 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 0.00 2.32 2.27 0.00 100 A 8.20 4.26 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 0.00 101 L 7.78 3.80 0.00 1.86 1.82 0.89 0.69 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 0.00 102 S 8.24 5.10 0.00 3.94 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 0.00 103 R 7.54 4.23 0.00 1.93 1.92 0.00 3.19 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 104 Q 8.67 4.18 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 105 H 8.38 4.74 0.00 3.08 3.27 0.00 5.84 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 0.00 106 G 8.14 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.63 3.95 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.58 0.92 0.00 0.00 108 T 8.26 4.60 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 1.21 0.00 0.00 109 I 7.96 4.53 1.70 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.68 0.65 0.00 0.00 110 D 8.64 5.01 0.00 2.84 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 0.00 111 P 0.00 4.88 0.00 2.18 2.16 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 112 K 7.75 4.42 0.00 1.68 1.76 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.41 1.36 7.81 113 R 7.84 3.77 0.00 0.67 1.28 0.00 3.37 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 114 L 7.01 4.22 0.00 2.01 1.65 1.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.90 4.46 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 0.00 116 L 7.51 4.60 0.00 1.55 1.49 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.33 4.72 0.00 2.02 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 2.16 2.33 0.00 118 K 7.78 4.07 0.00 1.70 1.69 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.42 7.81 119 P 0.00 4.37 0.00 2.06 2.01 0.00 3.72 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 2.01 2.09 0.00 120 I 8.05 3.66 2.19 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 1.23 0.61 0.92 0.00 0.00 121 K 7.83 4.87 0.00 1.64 1.65 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.40 7.81 122 E 7.29 4.76 0.00 1.92 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 2.20 2.39 0.00 123 L 8.85 4.25 0.00 1.70 1.60 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.62 4.38 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 0.00 125 E 7.90 4.57 0.00 1.89 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 2.01 2.17 0.00 126 Y 7.86 4.61 0.00 2.97 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 0.00 127 V 8.58 4.49 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 0.85 0.00 0.00 0.97 0.00 0.00 128 L 8.75 4.85 0.00 1.88 1.65 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.08 5.81 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 1.29 0.00 0.00 130 Y 8.46 5.11 0.00 3.04 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 0.00 131 K 7.74 4.43 0.00 1.36 1.60 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.24 1.38 7.81 132 P 0.00 4.29 0.00 2.28 2.15 0.00 3.62 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.41 0.00 133 H 8.47 4.45 0.00 3.28 3.27 0.00 5.87 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.45 0.00 2.03 2.04 0.00 3.50 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 1.97 2.03 0.00 135 E 8.05 4.65 0.00 2.07 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 2.36 2.31 0.00 136 V 8.24 4.47 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 0.79 0.00 0.00 0.91 0.00 0.00 137 P 0.00 4.71 0.00 2.01 2.18 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 138 I 8.19 4.72 1.91 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 1.25 0.94 1.04 0.00 0.00 139 Q 9.76 5.27 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 140 L 8.33 4.68 0.00 1.78 1.61 0.95 0.68 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 0.00 141 K 8.54 4.30 0.00 1.76 1.77 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.46 7.81 142 V 8.03 4.05 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 0.80 0.00 0.00 1.12 0.00 0.00 143 S 8.09 5.74 0.00 3.95 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 0.00 144 V 7.04 4.40 2.28 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 0.93 0.00 0.00 1.06 0.00 0.00 145 V 7.92 3.77 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 0.86 0.00 0.00 1.03 0.00 0.00