NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.9419 8.3093 119.4218 56.9788 39.5625 174.7712 4 S 3.9530 8.6217 121.2701 58.0471 64.0633 171.6024 5 E 3.9185 9.1280 124.9701 59.4432 29.7072 179.8316 6 E 4.1667 8.2463 119.1535 59.4169 29.4334 178.8263 7 Q 3.9325 7.6460 117.1960 59.4981 28.8443 177.9258 8 T 2.9907 7.7549 118.1483 66.1795 68.2148 176.1828 9 A 3.9003 8.6367 122.5468 55.1788 18.5924 179.2337 10 E 4.3032 7.7331 116.2402 59.2224 29.6174 179.0630 11 F 4.4905 9.2423 119.3547 61.0479 39.0640 177.8229 12 K 4.0908 8.0271 117.6612 59.8934 31.7128 179.0306 13 E 4.0097 8.5502 118.5718 59.3120 29.0856 179.5088 14 A 4.0794 7.9418 119.4519 55.0375 19.2010 178.7241 15 F 3.9579 9.0003 119.5012 61.7897 39.2423 177.1677 16 Q 4.3193 8.8604 116.3442 58.8079 28.9375 179.2057 17 L 4.4116 7.5626 121.2517 54.4467 42.0303 177.6153 18 F 4.5647 7.5122 110.4743 57.3134 41.5541 173.9614 19 D 4.8049 7.9333 120.4593 52.1383 42.6645 175.3849 20 R 4.0486 8.9020 127.7900 59.3698 30.9645 176.8590 21 T 3.8728 8.0824 106.5505 61.7864 68.2996 174.3445 22 G 4.5696 8.6248 120.9225 44.8472 0.0000 174.4496 23 D 4.4135 8.3873 119.7365 55.0679 39.1427 177.2868 24 G 4.1098 8.3830 105.9888 45.6961 0.0000 173.1240 25 K 5.7574 8.6411 117.3257 53.3873 35.6526 176.6248 26 I 4.2134 8.2815 124.5208 59.2477 39.0431 174.9837 27 L 4.2534 8.6527 127.1525 55.5930 42.0355 178.0927 28 Y 4.2423 9.0596 121.0289 61.7672 37.9967 179.1884 29 S 4.2166 8.4547 114.5962 61.4567 63.2865 176.2531 30 Q 3.8005 8.2493 122.3008 58.3297 28.3368 179.1602 31 C 3.7373 7.9243 119.4539 62.5491 31.6351 175.5542 32 G 3.7871 7.6977 106.8307 48.5237 0.0000 175.0965 33 D 4.3396 7.9038 121.1320 56.7014 40.8153 179.1114 34 V 2.7809 7.4015 118.6737 65.8263 31.3133 178.1327 35 M 4.0956 8.1649 118.6636 58.2873 31.7333 178.7726 36 R 4.6647 8.3714 119.4320 59.0587 30.1227 178.7450 37 A 3.8565 8.6462 120.2324 55.3323 18.2594 178.6086 38 L 4.4070 7.3668 115.0386 54.6614 41.7514 177.2068 39 G 3.8561 8.6898 106.8867 46.6006 0.0000 173.6574 40 Q 4.6817 7.8327 119.9187 54.0873 31.1759 175.3320 41 N 5.1740 8.3130 120.6123 51.8458 39.3380 173.5248 42 P 4.5368 0.0000 0.0000 62.6500 32.5245 177.0952 43 T 4.1682 9.4089 113.5509 61.4420 70.5219 175.2506 44 N 4.3503 8.6583 117.7239 56.1265 38.3293 177.6122 45 A 4.0630 7.9483 122.1697 55.1382 18.4934 179.4005 46 E 3.9106 8.2186 115.1130 59.1237 29.5869 179.1330 47 V 3.8372 7.2899 117.6157 65.5165 31.8690 177.6643 48 M 3.9487 7.6493 116.7101 58.3533 31.8743 177.8001 49 K 3.8172 8.1113 119.7730 59.2999 32.3290 177.0991 50 V 4.2544 7.1038 115.7976 62.8923 31.3973 175.8248 51 L 4.4528 7.9740 115.0329 52.8955 43.4574 177.1530 52 G 3.8202 8.3355 105.9377 45.9557 0.0000 174.1436 53 N 4.1473 8.2429 112.9965 53.6492 35.9351 173.2575 54 P 4.7090 0.0000 0.0000 61.9204 33.4480 175.7660 55 K 4.5632 8.1331 117.4004 56.7466 35.6935 178.8985 56 S 3.6189 7.7621 117.8113 59.9889 65.4799 175.1416 57 D 4.3608 8.1003 121.2951 56.1344 38.9229 178.3078 58 E 4.1111 8.4845 118.9447 57.5748 29.5164 177.9727 59 M 4.4237 7.8298 118.7940 56.4590 32.3697 175.9016 60 N 4.9074 7.9557 116.0558 53.1935 40.2053 174.1152 61 L 4.5089 7.6270 115.1060 56.9577 43.7305 177.1660 62 K 3.9611 7.7232 118.0880 57.0920 33.0446 175.9679 63 T 5.3980 8.2126 111.9177 60.0769 72.4901 172.5241 64 L 5.3973 8.5666 118.7890 52.2512 46.5523 175.9073 65 K 4.8794 8.6537 120.2243 54.4775 35.1714 176.7583 66 F 2.8215 8.4815 126.7524 61.3638 39.0794 177.2364 67 E 3.9703 8.4486 116.9594 59.3195 29.3469 178.0121 68 Q 4.2667 8.4240 116.7598 57.5246 29.1628 177.8036 69 F 4.1051 7.6957 122.8207 60.8649 39.6066 176.4502 70 L 3.4147 8.3170 121.3931 57.7881 41.9072 177.2182 71 P 4.9857 0.0000 0.0000 65.2390 30.7320 177.8710 72 M 4.5260 7.9220 119.9930 57.0662 32.2540 177.6752 73 M 3.5757 7.1955 117.8840 59.0645 32.1459 178.1030 74 Q 4.0916 8.1640 117.6505 59.2323 28.9773 178.7054 75 T 3.8314 7.4779 109.3295 65.5781 68.4765 175.4457 76 I 3.7492 8.2835 121.7838 63.5214 37.2256 178.5010 77 A 3.8848 7.9621 123.4836 54.6071 18.9980 177.7401 78 K 4.2865 7.8067 117.7891 55.2101 31.6435 175.4676 79 N 5.1419 8.1670 120.1050 51.0038 42.6176 175.1194 80 K 4.2259 8.5938 117.8877 58.8975 32.8558 176.6875 81 D 4.8375 8.1548 118.0324 55.0738 43.3874 174.3662 82 Q 4.8458 8.0716 126.2613 56.8783 31.1622 174.7252 83 G 3.1028 7.9180 111.4756 44.6573 0.0000 173.1510 84 C 4.9483 7.0681 110.5118 57.3171 32.3656 174.5110 85 F 3.6049 8.7394 124.5526 61.2142 39.6940 178.7341 86 E 3.8674 7.3209 118.4223 58.7190 30.1743 178.4613 87 D 4.7238 7.7837 118.9002 55.7423 41.9257 177.8537 88 Y 4.4413 8.1346 116.9988 62.1413 37.9062 179.5944 89 V 3.3626 7.9588 112.6656 64.2013 31.7093 178.1127 90 E 4.0476 7.9113 118.8457 59.2191 29.0630 179.2615 91 G 3.6670 7.8279 105.0291 47.3666 0.0000 175.9805 92 L 4.2269 7.5092 120.9637 57.2985 41.8705 178.8880 93 R 3.5679 7.7477 118.1500 58.0164 29.7206 177.5265 94 V 3.8633 7.0134 115.8490 64.1476 31.7140 175.7574 95 F 4.8844 8.1045 115.4087 58.0116 39.8206 176.4335 96 D 4.7769 8.1658 121.9305 54.2480 39.1197 177.8209 97 K 4.7329 7.3708 124.0211 58.5405 34.7430 176.3588 98 E 4.6490 8.5527 117.1293 57.3064 31.0292 174.8785 99 G 4.1958 8.2709 102.8030 46.1659 0.0000 172.2362 100 N 4.3190 8.2040 119.5278 54.7253 38.5045 176.4769 101 G 4.0553 9.4690 105.3518 44.5251 0.0000 173.0410 102 T 4.5773 7.2528 108.1918 59.6441 72.0985 173.3704 103 V 4.6282 8.3574 122.2249 61.0448 35.4719 174.5324 104 M 4.4567 8.6508 125.6657 54.9920 32.4821 177.6067 105 G 4.2251 9.4208 110.6676 45.7047 0.0000 174.2693 106 A 4.2417 8.0792 123.0604 53.4659 20.7111 178.9949 107 E 4.0219 7.8388 116.6041 59.4760 29.7168 179.3415 108 I 3.5551 7.6037 119.4020 64.3607 37.0515 178.3241 109 R 3.9355 7.3007 117.8982 60.0407 29.8549 176.7789 110 H 4.3774 8.4810 119.2693 56.7957 29.6174 177.5369 111 V 3.3019 7.0845 118.7691 65.9685 32.2821 178.4467 112 L 4.0751 7.7556 118.0867 56.5021 41.3435 178.0198 113 V 4.8026 9.0086 118.8029 61.9127 31.8414 176.2905 114 T 4.5329 7.7401 104.0652 62.0314 72.1988 172.9921 115 L 4.7941 7.4461 121.2330 53.8612 46.4087 178.3635 116 G 3.7148 8.6676 109.5963 46.6936 0.0000 176.1788 117 E 4.2946 8.6310 114.6545 55.7907 26.9752 175.9414 118 K 3.7795 7.8032 116.9998 57.4493 33.0782 177.6599 119 M 4.6644 8.2318 125.1625 54.8550 34.5155 175.2927 120 T 4.6752 8.7484 109.4653 60.1599 71.7946 175.4845 121 E 3.9485 8.8883 120.9877 59.9224 29.2040 179.3456 122 E 3.9088 8.0642 118.7642 59.2310 29.6366 178.3279 123 E 3.9041 8.2580 118.4908 60.1502 29.5846 180.0259 124 V 3.5910 7.9383 111.6507 64.5016 31.6775 177.8756 125 E 3.8352 7.9947 118.6657 59.9121 29.1954 178.9384 126 Q 4.0205 8.2923 117.5637 59.4983 28.8310 178.2340 127 L 4.1110 7.5156 121.0374 57.5858 42.3869 178.7646 128 V 3.7742 8.4039 111.7323 63.2538 31.5768 176.0197 129 A 3.8292 7.4327 120.9981 54.2942 17.7107 177.2018 130 G 4.0628 9.4358 111.1888 46.0895 0.0000 172.9071 131 H 4.7936 8.4424 114.4709 54.8758 30.7825 173.2259 132 E 4.5756 7.9812 120.5465 55.5506 30.8856 176.0602 133 D 5.0513 8.3652 124.6263 52.6279 41.4479 177.0930 134 S 4.0641 8.8190 111.5768 61.8762 62.9786 174.6436 135 N 4.7363 8.3735 116.0036 52.3712 38.5233 174.7673 136 G 3.9842 8.0994 106.0126 46.8586 0.0000 173.0777 137 C 4.9175 8.9963 117.1628 57.8345 30.4322 173.4035 138 I 5.1468 8.3874 124.2501 59.0245 39.8866 174.5655 139 N 4.7386 8.4878 124.5910 52.0442 39.2027 174.5752 140 Y 4.2080 8.5025 124.8271 60.9994 38.2846 179.7110 141 E 3.9549 8.2749 120.4938 58.4812 30.1445 179.4533 142 E 4.0946 8.1362 117.8813 59.1182 29.7454 178.7024 143 L 3.9580 8.1086 120.1838 58.7996 42.0472 179.0941 144 V 3.5016 8.8082 118.9091 66.2450 31.4358 177.9424 145 R 4.1024 8.2578 117.2293 59.8192 30.0640 178.2929 146 M 4.0028 8.7382 117.8967 59.3308 31.9540 178.7694 147 V 3.6911 7.6335 111.4902 63.9278 31.9050 178.0091 148 L 4.0452 8.2725 118.4292 55.9433 41.1308 177.8356 149 S 4.1996 6.7046 125.4155 61.7737 64.1227 175.2999 150 G 3.7672 7.9106 113.2501 45.7030 0.0000 173.3348 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 F 8.31 4.94 0.00 3.08 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 4 S 8.62 3.95 0.00 4.13 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 5 E 9.13 3.92 0.00 2.08 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 2.35 2.40 0.00 6 E 8.25 4.17 0.00 2.06 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 2.37 2.39 0.00 7 Q 7.65 3.93 0.00 1.85 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.49 0.00 0.00 0.00 0.00 0.00 2.41 1.85 0.00 8 T 7.75 2.99 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 9 A 8.64 3.90 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 10 E 7.73 4.30 0.00 2.28 2.16 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 2.40 2.77 0.00 11 F 9.24 4.49 0.00 3.51 3.57 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 0.00 0.00 0.00 0.00 12 K 8.03 4.09 0.00 1.67 1.55 0.00 1.64 0.00 0.00 1.37 0.00 0.00 2.64 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.34 1.50 7.81 13 E 8.55 4.01 0.00 2.14 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 2.58 0.00 14 A 7.94 4.08 1.50 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 15 F 9.00 3.96 0.00 3.15 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 16 Q 8.86 4.32 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.44 0.00 0.00 0.00 0.00 0.00 2.60 2.65 0.00 17 L 7.56 4.41 0.00 1.72 1.84 0.82 0.76 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 18 F 7.51 4.56 0.00 3.10 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.93 4.80 0.00 2.59 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.90 4.05 0.00 1.81 1.95 0.00 3.28 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 21 T 8.08 3.87 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 1.21 0.00 0.00 22 G 8.62 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.39 4.41 0.00 2.84 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 24 G 8.38 4.11 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 0.00 0.00 0.00 25 K 8.64 5.76 0.00 1.81 1.75 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.50 7.81 26 I 8.28 4.21 1.55 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.31 0.66 0.00 0.00 27 L 8.65 4.25 0.00 1.61 1.66 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 9.06 4.24 0.00 2.75 3.09 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 0.00 0.00 0.00 29 S 8.45 4.22 0.00 4.04 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 0.00 30 Q 8.25 3.80 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 31 C 7.92 3.74 0.00 2.93 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 32 G 7.70 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 33 D 7.90 4.34 0.00 2.60 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 34 V 7.40 2.78 1.72 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 0.48 0.00 0.00 -0.78 0.00 0.00 35 M 8.16 4.10 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.72 0.00 36 R 8.37 4.66 0.00 2.00 1.99 0.00 3.26 0.00 0.00 3.27 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 37 A 8.65 3.86 1.50 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 38 L 7.37 4.41 0.00 1.66 1.38 0.04 1.36 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 39 G 8.69 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 40 Q 7.83 4.68 0.00 2.36 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.41 6.90 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 41 N 8.31 5.17 0.00 2.75 2.78 0.00 0.00 7.00 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 42 P 0.00 4.54 0.00 2.16 2.05 0.00 3.84 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 43 T 9.41 4.17 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 1.31 0.00 0.00 44 N 8.66 4.35 0.00 3.08 2.91 0.00 0.00 6.70 7.54 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 45 A 7.95 4.06 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 46 E 8.22 3.91 0.00 2.09 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 0.00 2.31 2.38 0.00 47 V 7.29 3.84 2.05 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 0.96 0.00 0.00 0.95 0.00 0.00 48 M 7.65 3.95 0.00 2.21 2.03 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 2.61 2.59 0.00 49 K 8.11 3.82 0.00 1.71 1.94 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.38 7.81 50 V 7.10 4.25 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 0.77 0.00 0.00 0.88 0.00 0.00 51 L 7.97 4.45 0.00 1.65 1.54 0.63 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.34 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 53 N 8.24 4.15 0.00 2.83 2.83 0.00 0.00 7.14 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 54 P 0.00 4.71 0.00 2.17 2.14 0.00 3.69 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 2.32 2.60 0.00 55 K 8.13 4.56 0.00 2.24 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.50 7.81 56 S 7.76 3.62 0.00 4.04 4.11 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 57 D 8.10 4.36 0.00 2.88 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 58 E 8.48 4.11 0.00 2.11 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 0.00 2.52 2.48 0.00 59 M 7.83 4.42 0.00 2.09 2.29 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 2.69 2.79 0.00 60 N 7.96 4.91 0.00 2.67 2.77 0.00 0.00 7.00 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 61 L 7.63 4.51 0.00 1.58 1.62 0.91 0.89 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 62 K 7.72 3.96 0.00 1.07 0.74 0.00 1.07 0.00 0.00 1.44 0.00 0.00 2.66 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.16 0.96 7.81 63 T 8.21 5.40 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 1.28 0.00 0.00 64 L 8.57 5.40 0.00 2.08 1.88 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.65 4.88 0.00 1.72 1.71 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.49 7.81 66 F 8.48 2.82 0.00 2.56 2.83 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 67 E 8.45 3.97 0.00 2.08 2.05 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 2.36 2.38 0.00 68 Q 8.42 4.27 0.00 2.35 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.72 0.00 69 F 7.70 4.11 0.00 3.08 2.64 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 70 L 8.32 3.41 0.00 1.26 1.65 1.31 1.05 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 71 P 0.00 4.99 0.00 2.25 2.29 0.00 3.68 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 2.20 1.99 0.00 72 M 7.92 4.53 0.00 1.81 1.88 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.27 0.00 73 M 7.20 3.58 0.00 1.96 1.52 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.06 0.00 74 Q 8.16 4.09 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.36 0.00 0.00 0.00 0.00 0.00 2.64 2.75 0.00 75 T 7.48 3.83 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 1.22 0.00 0.00 76 I 8.28 3.75 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.66 0.90 0.00 0.00 77 A 7.96 3.88 1.41 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 0.00 0.00 0.00 78 K 7.81 4.29 0.00 1.70 1.73 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.40 7.81 79 N 8.17 5.14 0.00 2.65 2.69 0.00 0.00 7.21 7.61 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 80 K 8.59 4.23 0.00 1.71 1.85 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.50 7.81 81 D 8.15 4.84 0.00 2.58 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.07 4.85 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 83 G 7.92 3.10 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 0.00 0.00 0.00 84 C 7.07 4.95 0.00 3.32 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 85 F 8.74 3.60 0.00 3.30 3.10 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 86 E 7.32 3.87 0.00 2.00 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 2.35 2.59 0.00 87 D 7.78 4.72 0.00 2.49 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 88 Y 8.13 4.44 0.00 3.01 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 89 V 7.96 3.36 1.71 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 -0.32 0.00 0.00 0.70 0.00 0.00 90 E 7.91 4.05 0.00 1.99 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 2.23 2.30 0.00 91 G 7.83 3.67 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 0.00 92 L 7.51 4.23 0.00 1.35 1.71 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.75 3.57 0.00 1.24 1.71 0.00 3.20 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 94 V 7.01 3.86 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.76 0.00 0.00 95 F 8.10 4.88 0.00 3.20 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 96 D 8.17 4.78 0.00 3.08 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 97 K 7.37 4.73 0.00 1.84 1.82 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.56 7.81 98 E 8.55 4.65 0.00 2.17 1.82 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 2.25 2.28 0.00 99 G 8.27 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 0.00 0.00 0.00 0.00 100 N 8.20 4.32 0.00 2.73 2.90 0.00 0.00 7.15 7.02 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 0.00 101 G 9.47 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 0.00 102 T 7.25 4.58 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 1.09 0.00 0.00 103 V 8.36 4.63 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 1.13 0.00 0.00 1.30 0.00 0.00 104 M 8.65 4.46 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.57 0.00 105 G 9.42 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 0.00 106 A 8.08 4.24 1.24 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 0.00 0.00 107 E 7.84 4.02 0.00 2.11 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 2.37 2.40 0.00 108 I 7.60 3.56 1.86 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 1.54 1.33 0.88 0.00 0.00 109 R 7.30 3.94 0.00 2.03 1.94 0.00 3.24 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 110 H 8.48 4.38 0.00 3.37 3.10 0.00 5.69 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.08 3.30 1.68 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 0.88 0.00 0.00 0.01 0.00 0.00 112 L 7.76 4.08 0.00 1.74 1.67 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 113 V 9.01 4.80 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 0.85 0.00 0.00 0.99 0.00 0.00 114 T 7.74 4.53 4.11 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 1.10 0.00 0.00 115 L 7.45 4.79 0.00 1.67 1.56 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.67 3.71 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 0.00 0.00 0.00 117 E 8.63 4.29 0.00 1.97 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 2.32 2.29 0.00 118 K 7.80 3.78 0.00 1.62 1.79 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.55 7.81 119 M 8.23 4.66 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.46 0.00 120 T 8.75 4.68 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 0.00 121 E 8.89 3.95 0.00 2.17 2.26 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 2.36 2.36 0.00 122 E 8.06 3.91 0.00 1.99 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 2.39 2.33 0.00 123 E 8.26 3.90 0.00 2.27 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 2.33 2.38 0.00 124 V 7.94 3.59 2.05 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 0.74 0.00 0.00 0.99 0.00 0.00 125 E 7.99 3.84 0.00 2.32 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 2.31 2.41 0.00 126 Q 8.29 4.02 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 127 L 7.52 4.11 0.00 1.56 1.71 0.87 1.41 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 0.00 128 V 8.40 3.77 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 0.66 0.00 0.00 1.04 0.00 0.00 129 A 7.43 3.83 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 0.00 130 G 9.44 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 0.00 131 H 8.44 4.79 0.00 3.33 3.30 0.00 5.81 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 7.98 4.58 0.00 2.03 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 2.39 2.30 0.00 133 D 8.37 5.05 0.00 2.90 2.78 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 0.00 134 S 8.82 4.06 0.00 3.99 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 0.00 135 N 8.37 4.74 0.00 2.73 2.86 0.00 0.00 6.87 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 0.00 136 G 8.10 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 0.00 137 C 9.00 4.92 0.00 3.06 2.83 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 0.00 138 I 8.39 5.15 2.00 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 1.24 2.05 0.93 0.00 0.00 139 N 8.49 4.74 0.00 2.68 2.65 0.00 0.00 6.82 7.56 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 0.00 140 Y 8.50 4.21 0.00 3.12 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 0.00 141 E 8.27 3.95 0.00 2.33 2.38 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 2.57 2.37 0.00 142 E 8.14 4.09 0.00 2.34 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 0.00 2.65 2.48 0.00 143 L 8.11 3.96 0.00 1.79 1.88 0.82 0.79 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 0.00 144 V 8.81 3.50 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 0.95 0.00 0.00 0.80 0.00 0.00 145 R 8.26 4.10 0.00 2.06 2.10 0.00 3.27 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 146 M 8.74 4.00 0.00 2.23 2.13 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 2.70 2.64 0.00 147 V 7.63 3.69 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 0.75 0.00 0.00 0.97 0.00 0.00 148 L 8.27 4.05 0.00 1.98 1.61 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 149 S 6.70 4.20 0.00 4.07 4.01 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 0.00 150 G 7.91 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