NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 E 4.3349 8.2876 120.2209 56.8651 32.1934 176.8496 15 H 4.0739 8.0141 119.3944 57.0949 29.1497 172.2621 16 V 3.3651 8.4124 122.7580 66.2699 31.5944 178.6641 17 N 4.2307 8.1579 115.6423 56.2256 38.2931 176.9125 18 A 3.9883 8.0580 121.7060 56.0012 18.2768 179.2057 19 I 3.8043 7.6407 117.6549 63.7641 37.2697 178.3109 20 Q 3.9569 8.9725 118.9575 59.4586 27.9302 179.9444 21 E 3.8994 8.7298 119.2682 59.4708 29.4734 179.3207 22 A 4.4072 7.6592 120.7908 55.0461 18.2309 179.4755 23 R 3.8056 8.5076 117.6075 59.7701 29.8646 178.7876 24 R 3.9099 7.9761 118.3708 59.1079 29.9297 177.7132 25 L 4.0186 9.2380 118.3399 56.4790 42.2846 178.0307 26 L 4.2096 7.4634 120.4603 58.3520 42.2120 178.0325 27 N 4.2880 7.6231 114.7308 55.9781 38.7460 176.3530 28 L 4.2079 7.2369 117.3537 56.5101 42.2351 177.4270 29 S 4.2503 7.5618 112.6641 58.8936 62.7784 173.6979 30 R 4.5199 7.9290 117.9805 55.6100 31.6430 173.7111 31 D 5.0885 8.5489 121.4168 52.5878 44.6698 175.2343 32 T 4.5877 9.5581 110.5755 60.3825 72.0849 175.1190 33 A 3.9641 8.5721 123.4928 55.6073 18.1379 179.6842 34 A 3.9072 8.0198 117.1131 55.8356 18.5085 179.3057 35 E 3.9080 7.8495 115.4562 59.7038 29.6951 179.1937 36 M 4.4627 8.5584 118.8120 58.8876 31.8337 178.9954 37 N 4.4208 8.1414 115.7458 55.2329 38.4287 175.2795 38 E 3.7368 7.5162 120.9275 56.0750 29.9282 176.2656 39 T 4.5439 8.3451 116.6965 62.1206 70.0556 174.1229 40 V 4.5723 8.8623 116.3222 59.9501 36.7035 173.5149 41 E 5.0638 8.6075 123.5719 55.5151 30.5091 175.6970 42 V 4.3861 7.9736 117.3608 60.0021 36.3477 174.5536 43 I 3.7919 8.2501 123.4335 61.2584 36.2098 176.5988 44 S 4.3135 8.3818 119.8579 61.2946 63.2678 174.6839 45 E 3.6939 7.8532 119.6727 55.0983 29.3856 177.5434 46 M 4.4342 8.5548 121.6009 55.0063 32.3075 174.8038 47 F 4.5987 8.5905 120.6305 56.1956 41.4280 173.7660 48 D 4.9596 7.6529 126.0693 52.3189 43.8322 175.1665 49 L 4.3135 8.2689 124.8576 56.5712 42.7169 177.8549 50 Q 4.0705 7.8994 116.5435 58.0764 28.9672 175.7619 51 E 4.3167 7.5815 116.5759 53.9133 31.9421 172.9236 52 P 3.9988 0.0000 0.0000 62.3798 31.6712 176.2922 53 T 4.2939 7.6698 120.2186 63.4288 69.9573 172.6284 54 C 4.3007 8.7317 125.3704 56.7455 38.4570 179.5089 55 L 3.2201 7.9203 116.3152 54.9089 44.9630 176.2217 56 Q 4.0608 7.1066 120.1713 59.8987 29.4654 179.9338 57 T 4.0656 8.7011 116.1625 66.1526 68.3008 177.3123 58 R 3.8212 8.2495 120.9434 58.8857 30.0030 178.8708 59 L 4.4661 7.9293 118.5588 57.8150 41.5686 178.8507 60 E 3.9791 7.7278 115.8400 59.7589 29.5956 179.0170 61 L 4.1090 7.8330 119.3160 57.6561 41.7564 178.8327 62 Y 4.7696 8.6407 117.8450 61.7061 37.8894 178.7856 63 K 3.8911 8.9727 119.2102 60.3480 32.0365 179.0391 64 Q 4.1175 8.0310 117.0900 59.0364 28.7536 179.1847 65 G 3.1653 7.8735 105.4407 45.4799 0.0000 174.3624 66 L 4.1728 6.9920 120.6870 55.4490 42.5649 176.5078 67 R 4.4390 8.6847 120.3930 55.8178 33.8496 175.5224 68 G 3.9351 8.2719 110.7064 46.3790 0.0000 176.1217 69 S 4.0529 8.7034 113.1533 61.2850 62.7672 176.3107 70 L 4.2053 8.0632 117.9505 55.8787 41.2486 178.7396 71 T 3.9047 8.6771 118.2496 66.8766 68.2333 175.6229 72 K 4.2350 7.4310 117.4951 57.9777 32.3149 178.3102 73 L 4.2491 8.1971 119.7809 55.8977 41.6428 178.6618 74 K 3.9657 7.8336 119.6049 60.0017 32.0546 178.5668 75 G 3.6580 8.1636 105.2400 47.1404 0.0000 173.2784 76 P 4.2514 0.0000 0.0000 65.3800 31.0586 178.3641 77 L 3.9655 7.9367 118.6146 57.8160 41.5624 179.6582 78 T 3.5107 8.2252 115.1825 66.0315 68.1558 176.8266 79 M 4.1176 7.9401 121.4220 58.7540 32.1740 178.2909 80 M 3.6879 8.0700 118.5498 58.2930 31.8720 178.3260 81 A 4.0313 8.4778 120.9611 55.8181 18.7536 179.5091 82 S 4.3615 7.8153 110.9148 60.4810 63.2569 176.1223 83 H 3.9893 8.6989 122.9255 59.7032 29.4245 176.1997 84 Y 4.3815 7.5737 112.1251 58.6617 37.3394 176.1856 85 K 4.4650 8.3923 122.1435 56.6714 33.8379 177.4475 86 Q 4.0194 7.9279 116.5626 59.1083 28.4668 176.5198 87 H 4.3093 7.1200 116.7589 56.1217 31.8451 172.0103 88 C 4.7694 8.1289 123.9312 59.3481 31.9506 170.8364 89 P 4.6876 0.0000 0.0000 60.6957 31.9595 173.4491 90 P 4.2857 0.0000 0.0000 63.2974 31.3584 175.8769 91 T 3.6487 8.1091 113.5000 59.8079 68.1496 171.9731 92 P 4.4293 0.0000 0.0000 62.7190 29.4556 174.8250 93 E 4.7925 8.0344 122.6535 55.9355 32.5986 174.4772 94 T 4.5736 7.8158 114.2326 63.4888 76.4400 174.0046 95 S 4.4947 7.8215 123.9077 56.9786 62.7467 174.3493 96 C 4.7580 8.4850 125.8075 54.7351 41.3658 174.2094 97 A 4.3418 8.0319 127.2291 52.2656 19.1045 176.1448 98 T 4.8010 8.3688 113.5117 62.5604 69.1820 171.9164 99 Q 5.0497 7.8872 123.9782 56.1334 31.8288 174.3447 100 I 4.5703 8.0985 128.1237 59.9866 35.4677 175.0144 101 I 4.2824 7.9850 118.1613 59.6575 40.4130 176.7114 102 T 4.3665 8.4342 117.7167 62.1566 68.2529 174.8870 103 F 4.4773 8.5153 126.2386 61.2746 39.2141 176.6790 104 E 3.7823 8.3049 119.0542 59.5738 29.2059 178.9994 105 S 4.0276 8.0622 112.3266 61.2809 62.6987 175.3076 106 F 3.9891 7.9882 123.1511 61.5516 38.9010 177.0427 107 K 3.7976 7.9871 117.5610 59.9806 31.9233 179.2136 108 E 3.7771 7.7756 117.8101 59.0822 29.2479 178.4972 109 N 4.2560 8.2841 117.6449 56.7140 38.9709 176.3567 110 L 3.6136 7.7169 120.6448 57.9611 41.9866 178.7143 111 K 3.7645 8.3255 118.6962 59.9521 32.4320 177.8919 112 D 4.4595 8.2772 118.6132 57.2990 40.6458 178.1452 113 F 3.9540 8.8581 121.7564 61.6380 39.1110 176.9830 114 L 4.1963 8.3770 115.5009 56.3716 41.5074 178.5795 115 L 4.1082 7.6042 120.6528 57.5976 42.2767 177.6963 116 V 3.6647 7.6843 111.9168 64.5009 31.8435 177.4352 117 I 3.7524 6.7352 118.5503 60.8535 37.5504 174.2312 118 P 4.5189 0.0000 0.0000 62.9961 31.4203 175.3047 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 14 E 8.29 4.33 0.00 2.00 1.86 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 2.29 2.25 0.00 15 H 8.01 4.07 0.00 3.19 3.25 0.00 5.48 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.41 3.37 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 1.00 0.00 0.00 0.83 0.00 0.00 17 N 8.16 4.23 0.00 2.85 2.82 0.00 0.00 6.89 6.99 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 18 A 8.06 3.99 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 19 I 7.64 3.80 1.98 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 1.56 0.65 0.91 0.00 0.00 20 Q 8.97 3.96 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 21 E 8.73 3.90 0.00 2.16 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 2.32 2.49 0.00 22 A 7.66 4.41 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 23 R 8.51 3.81 0.00 1.96 1.93 0.00 3.24 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 24 R 7.98 3.91 0.00 2.13 2.02 0.00 3.30 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 25 L 9.24 4.02 0.00 1.81 1.67 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.46 4.21 0.00 1.97 1.78 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 27 N 7.62 4.29 0.00 2.73 2.88 0.00 0.00 7.17 7.64 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 28 L 7.24 4.21 0.00 1.68 1.72 1.03 0.82 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 29 S 7.56 4.25 0.00 3.84 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 0.00 30 R 7.93 4.52 0.00 1.92 1.85 0.00 3.04 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 1.48 1.62 0.00 31 D 8.55 5.09 0.00 2.74 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 32 T 9.56 4.59 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 1.26 0.00 0.00 33 A 8.57 3.96 1.36 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 0.00 0.00 34 A 8.02 3.91 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 35 E 7.85 3.91 0.00 2.33 1.93 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 2.24 2.32 0.00 36 M 8.56 4.46 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.68 0.00 37 N 8.14 4.42 0.00 2.74 2.89 0.00 0.00 6.91 7.74 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 38 E 7.52 3.74 0.00 1.84 1.80 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 2.21 2.23 0.00 39 T 8.35 4.54 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 40 V 8.86 4.57 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 0.57 0.00 0.00 1.04 0.00 0.00 41 E 8.61 5.06 0.00 1.99 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 2.26 2.29 0.00 42 V 7.97 4.39 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 0.88 0.00 0.00 0.91 0.00 0.00 43 I 8.25 3.79 1.85 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 1.34 0.74 1.01 0.00 0.00 44 S 8.38 4.31 0.00 3.81 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 45 E 7.85 3.69 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 2.32 2.36 0.00 46 M 8.55 4.43 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 47 F 8.59 4.60 0.00 3.12 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 48 D 7.65 4.96 0.00 2.49 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 0.00 0.00 0.00 0.00 49 L 8.27 4.31 0.00 1.63 1.65 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 7.90 4.07 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.61 0.00 0.00 0.00 0.00 0.00 2.48 2.29 0.00 51 E 7.58 4.32 0.00 1.79 1.73 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 2.15 2.23 0.00 52 P 0.00 4.00 0.00 2.17 2.05 0.00 3.63 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 1.94 1.95 0.00 53 T 7.67 4.29 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 1.16 0.00 0.00 54 C 8.73 4.30 0.00 3.25 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.92 3.22 0.00 2.14 1.95 1.00 0.80 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 56 Q 7.11 4.06 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.48 2.65 0.00 57 T 8.70 4.07 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 1.28 0.00 0.00 58 R 8.25 3.82 0.00 1.92 1.74 0.00 3.74 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 59 L 7.93 4.47 0.00 1.91 1.78 1.07 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 60 E 7.73 3.98 0.00 2.11 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 0.00 2.59 2.40 0.00 61 L 7.83 4.11 0.00 1.80 1.86 0.86 1.20 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 62 Y 8.64 4.77 0.00 3.05 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 63 K 8.97 3.89 0.00 2.07 1.92 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.72 7.81 64 Q 8.03 4.12 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.01 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 65 G 7.87 3.17 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 66 L 6.99 4.17 0.00 1.77 1.70 0.99 0.90 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 67 R 8.68 4.44 0.00 1.15 0.76 0.00 2.77 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.36 0.00 68 G 8.27 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 69 S 8.70 4.05 0.00 3.97 3.92 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 70 L 8.06 4.21 0.00 2.06 1.81 0.97 0.83 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 71 T 8.68 3.90 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 1.20 0.00 0.00 72 K 7.43 4.23 0.00 1.75 1.87 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.49 7.81 73 L 8.20 4.25 0.00 1.81 1.71 1.01 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 74 K 7.83 3.97 0.00 1.77 1.91 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.64 7.81 75 G 8.16 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 76 P 0.00 4.25 0.00 2.28 2.41 0.00 3.81 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 2.18 2.07 0.00 77 L 7.94 3.97 0.00 1.88 1.76 0.85 0.63 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 78 T 8.23 3.51 4.33 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 1.23 0.00 0.00 79 M 7.94 4.12 0.00 2.06 2.31 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 80 M 8.07 3.69 0.00 2.18 2.31 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 2.69 2.62 0.00 81 A 8.48 4.03 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 82 S 7.82 4.36 0.00 3.93 3.91 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 83 H 8.70 3.99 0.00 3.01 3.09 0.00 5.78 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 7.57 4.38 0.00 3.10 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 85 K 8.39 4.46 0.00 1.69 1.96 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.35 7.81 86 Q 7.93 4.02 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.45 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 87 H 7.12 4.31 0.00 3.15 3.18 0.00 5.80 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 88 C 8.13 4.77 0.00 3.05 2.88 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 89 P 0.00 4.69 0.00 2.18 2.06 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.94 0.00 90 P 0.00 4.29 0.00 2.22 2.16 0.00 3.81 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 2.00 1.97 0.00 91 T 8.11 3.65 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 1.26 0.00 0.00 92 P 0.00 4.43 0.00 2.19 2.15 0.00 3.84 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 1.96 1.94 0.00 93 E 8.03 4.79 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 2.20 2.50 0.00 94 T 7.82 4.57 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 95 S 7.82 4.49 0.00 3.81 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 96 C 8.49 4.76 0.00 2.98 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 97 A 8.03 4.34 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 98 T 8.37 4.80 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 1.22 0.00 0.00 99 Q 7.89 5.05 0.00 2.23 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.78 0.00 0.00 0.00 0.00 0.00 2.20 2.15 0.00 100 I 8.10 4.57 1.89 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 1.41 1.01 0.93 0.00 0.00 101 I 7.99 4.28 1.93 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 1.19 1.12 0.95 0.00 0.00 102 T 8.43 4.37 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 1.28 0.00 0.00 103 F 8.52 4.48 0.00 3.48 3.28 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 0.00 104 E 8.30 3.78 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 2.31 2.33 0.00 105 S 8.06 4.03 0.00 3.97 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 0.00 106 F 7.99 3.99 0.00 3.26 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 0.00 107 K 7.99 3.80 0.00 1.93 1.76 0.00 1.53 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.28 0.97 7.81 108 E 7.78 3.78 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 2.31 2.28 0.00 109 N 8.28 4.26 0.00 2.75 2.86 0.00 0.00 6.69 6.32 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 0.00 110 L 7.72 3.61 0.00 1.32 1.57 -0.09 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.33 3.76 0.00 1.91 1.99 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.50 7.81 112 D 8.28 4.46 0.00 3.12 2.73 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 0.00 113 F 8.86 3.95 0.00 3.18 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 0.00 114 L 8.38 4.20 0.00 1.62 1.73 0.83 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.60 4.11 0.00 1.66 1.62 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.68 3.66 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 0.75 0.00 0.00 0.84 0.00 0.00 117 I 6.74 3.75 1.91 0.00 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.56 0.96 0.00 0.00 118 P 0.00 4.52 0.00 2.24 2.05 0.00 3.97 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 2.05 1.98 0.00