NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2054 8.3031 120.0583 56.1727 32.7849 174.9391 3 G 3.6578 8.5740 113.0450 44.3554 0.0000 168.7700 4 D 4.4991 8.6410 119.9939 53.7444 42.3205 175.4324 5 K 3.8821 8.8957 126.4268 59.6900 32.2273 179.0869 6 K 3.9672 8.0639 118.3189 58.9759 32.0385 179.4351 7 V 3.5553 7.9614 118.7479 66.1071 31.4942 178.0215 8 I 3.7268 7.8645 119.6641 64.4622 36.9085 178.2332 9 Q 3.9008 7.9359 120.2058 59.4122 28.8498 177.8351 10 H 4.1031 8.2046 117.1976 59.0354 28.7188 177.6079 11 L 3.9858 8.4460 120.9163 58.1558 41.4615 179.4842 12 N 4.3638 8.3269 116.1603 55.6966 38.4180 177.5777 13 K 3.9460 8.1271 121.4915 59.4554 32.2991 178.8347 14 I 3.6861 7.9637 120.3120 64.3684 37.0553 178.0532 15 L 4.0411 8.2683 121.4010 58.1984 41.8415 179.2131 16 G 3.6771 8.1705 105.5886 47.8932 0.0000 175.4388 17 N 4.3519 8.1105 118.6740 56.1646 38.5772 177.2237 18 E 3.9712 8.3234 120.0407 59.5825 29.0414 179.5462 19 L 4.0476 8.0170 118.8405 57.6267 41.5276 179.6952 20 I 3.6384 7.5797 119.2872 64.2398 37.0506 178.2276 21 A 3.2250 7.7886 121.5188 54.9215 18.1192 179.5553 22 I 3.5988 7.9416 118.5953 64.8159 37.1298 178.4458 23 N 4.4109 7.7001 115.9936 56.1148 38.3855 177.4517 24 Q 3.8588 8.1980 121.3383 59.4150 29.1093 177.9091 25 Y 4.7262 8.2337 119.6382 60.3550 37.9126 178.0173 26 F 3.9563 8.5442 121.7529 61.1550 39.4917 176.8310 27 L 3.9844 8.2899 120.1675 58.6736 41.8957 178.6487 28 H 3.9115 8.3619 116.1255 58.6747 28.5535 177.4948 29 S 4.3535 8.5199 115.3867 61.9092 62.1412 176.7167 30 R 3.8710 7.9157 120.2498 58.9737 29.7214 178.9888 31 M 3.4616 7.9975 119.0602 58.0657 31.9089 178.7661 32 W 4.5719 7.9038 118.9149 59.7886 29.1121 178.3084 33 N 4.3448 8.4208 116.5471 56.5474 37.8268 176.9393 34 D 4.2969 7.9246 117.9974 56.9916 41.3726 177.6845 35 W 4.8212 7.8973 117.3771 57.2247 29.2346 177.0755 36 G 3.9602 8.2107 107.2479 46.1207 0.0000 175.0804 37 L 4.5900 8.3936 121.5111 53.3265 40.4128 177.7087 38 K 4.0649 8.3106 121.1943 58.9428 32.4339 179.3298 39 R 3.8491 8.0858 119.4211 59.2548 29.9710 178.2395 40 L 3.7597 7.8382 118.4764 57.8279 41.5094 179.6531 41 G 3.8020 8.3081 105.2397 47.8450 0.0000 175.6264 42 A 4.0543 8.2287 123.2716 55.1436 18.4310 179.2604 43 H 3.9834 8.3964 116.8931 59.3428 29.5347 177.1549 44 E 4.0175 8.7011 121.6078 59.2594 29.3762 178.1382 45 Y 4.0681 8.2014 119.8080 60.9508 38.8989 177.4728 46 H 3.9839 8.2343 118.8203 59.2304 29.8670 177.0527 47 E 3.7322 8.0864 120.2974 59.3637 29.3090 178.9773 48 S 4.2364 8.1726 113.1245 61.8166 62.4816 176.4264 49 I 3.5925 7.7791 122.4165 64.3459 36.7065 178.1479 50 D 4.2429 8.0038 119.7053 57.4831 40.6170 178.7915 51 E 4.0278 8.1856 118.9751 59.5530 29.4493 179.3135 52 M 4.0392 7.9910 118.9333 58.2252 32.0566 178.8529 53 K 4.0719 7.8886 118.4725 59.3331 32.2647 179.1552 54 H 4.2663 8.3445 116.6759 58.7379 28.5598 177.5068 55 A 3.9981 8.1854 122.6574 55.1726 18.2282 178.9646 56 D 4.2774 7.9756 116.2866 57.7444 41.3027 178.8706 57 K 4.0390 7.9818 118.4566 59.2698 31.8932 179.4818 58 L 3.9937 8.0542 119.3494 57.7819 41.5960 179.3479 59 I 3.6970 8.0605 120.1174 64.6163 37.1021 178.2977 60 E 3.9975 8.2417 119.1212 59.4658 29.2886 179.4797 61 R 4.0370 8.0924 118.7257 59.4048 30.1421 178.6661 62 I 3.7246 8.0928 119.8504 64.3568 37.1670 178.1857 63 L 3.9913 7.9492 119.8261 58.0379 41.2763 179.5085 64 F 4.2988 8.1171 119.0839 61.1359 39.6904 176.4251 65 L 3.8473 8.0988 116.5496 54.6336 41.2446 177.1927 66 E 3.7472 7.9639 118.9978 56.8645 28.3095 174.2982 67 G 3.9463 8.1474 106.9949 43.6866 0.0000 173.3393 68 L 4.6257 8.0087 118.7149 51.9517 43.2325 175.0958 69 P 4.3687 0.0000 0.0000 62.3704 31.7265 175.7766 70 N 4.5898 9.4246 123.3209 52.8751 38.0322 174.0590 71 L 4.6064 8.3367 124.2252 54.5262 42.3484 177.2422 72 Q 4.1765 8.4923 121.8328 57.3552 29.6471 175.5411 73 D 4.5759 8.1151 117.9036 52.8690 41.3862 175.2596 74 L 4.5330 8.3117 126.6743 52.7801 43.5431 176.7369 75 G 3.8199 8.3517 116.7928 45.0166 0.0000 170.9740 76 K 4.2621 8.3415 120.6346 55.1836 32.9761 176.9458 77 L 4.1415 8.3747 126.5649 54.2292 42.3351 176.5635 78 L 4.3905 8.7754 124.5093 53.4787 41.1260 175.9277 79 I 4.3543 8.1874 125.1124 59.3562 38.3643 176.5502 80 G 4.0238 8.6472 115.2490 44.5762 0.0000 172.4684 81 E 4.7956 8.6526 114.3194 55.4255 30.1477 175.6406 82 N 4.8761 7.6417 116.3056 51.2831 41.2113 174.9104 83 T 4.3321 8.5975 115.2292 65.4901 67.4969 175.9317 84 Q 3.9471 8.1698 121.0784 59.3326 29.2251 177.9994 85 E 4.0465 8.7846 119.7481 59.4985 29.4036 179.3002 86 M 3.9281 8.3103 118.9125 58.2992 31.9606 178.6827 87 L 4.1315 8.3455 119.3117 58.0010 41.7731 179.4180 88 Q 4.0125 8.1910 119.3626 59.3853 28.9708 178.0806 89 C 4.2134 8.7372 118.0828 62.9926 28.1823 175.8254 90 D 4.6757 8.5071 120.5810 57.3314 40.4410 178.5202 91 L 4.0163 8.4628 121.2440 58.3035 42.0531 178.8512 92 N 4.3616 8.6141 116.7204 56.2361 38.4618 176.9599 93 L 3.9894 7.9948 121.7222 58.5394 42.1577 179.0299 94 E 4.1424 8.4079 118.3063 59.1887 29.3449 179.4318 95 L 3.9984 8.1199 119.2433 57.5586 41.8696 179.0768 96 K 3.8238 8.2291 119.4628 59.7796 32.0741 178.4474 97 A 4.0573 8.3417 121.1024 55.5691 18.2587 179.8280 98 T 3.8697 8.0443 114.2582 66.4132 68.4245 176.7619 99 K 3.8522 8.0553 121.6368 59.9471 32.2252 178.5572 100 D 4.4136 8.0132 118.4893 57.1880 40.6822 178.5896 101 L 4.0137 7.8433 120.6145 57.8629 42.1132 179.0502 102 R 3.9313 7.9339 118.0528 59.4965 30.1966 178.9229 103 E 3.9865 8.0477 117.8068 59.3254 29.4327 179.3407 104 A 3.5763 8.1677 120.9068 54.8732 18.3848 179.8180 105 I 3.7013 7.7769 118.6130 64.3297 37.1700 178.6421 106 V 3.5797 7.8688 119.1938 66.2527 31.3306 177.5823 107 H 4.0009 8.0314 117.4484 59.5261 29.6803 176.9509 108 C 4.0755 8.1071 118.5056 62.7657 27.9383 175.8069 109 E 3.9145 8.2435 120.8380 59.2465 29.0439 178.4695 110 Q 3.9628 7.8976 118.3617 58.9366 29.1096 178.0654 111 V 3.9786 7.2277 109.8488 60.7160 31.8852 175.6542 112 H 2.9245 7.4921 113.9781 57.0544 26.6518 176.3345 113 D 4.5260 7.6995 121.1488 53.6113 38.3782 175.6015 114 Y 4.3353 7.6121 121.5881 60.2553 38.4606 177.4676 115 V 3.6508 7.8792 119.0953 65.9767 31.7621 177.9497 116 S 4.1177 8.6857 115.2431 61.7405 62.7181 176.5193 117 R 3.9111 7.9866 121.2488 59.5613 29.7415 177.8633 118 D 4.3294 8.3235 117.6631 57.3728 41.2390 178.0059 119 L 3.9560 7.8902 120.7228 58.2828 41.9949 178.9946 120 L 4.0419 8.0373 118.9304 57.4795 41.5101 179.3368 121 K 3.9471 8.2743 119.8251 59.5153 31.9902 178.6921 122 D 4.3608 8.1467 119.3485 57.2512 40.6615 178.7982 123 I 3.5706 7.6986 120.5795 63.9593 37.0693 178.1198 124 L 3.9268 8.1516 121.5537 58.0486 41.9438 178.5247 125 E 3.9021 8.2934 119.2968 59.5675 29.5736 178.8772 126 S 4.1030 7.8711 112.7820 61.3663 62.4466 175.9511 127 E 4.0206 8.5921 121.8668 59.2672 29.1580 179.1064 128 E 4.0668 8.7490 119.2610 59.3405 29.4295 179.1948 129 E 4.0528 8.3643 118.8128 59.6656 29.4281 178.9545 130 H 4.4082 8.2504 116.3337 58.9818 28.6784 177.9620 131 I 3.7674 7.9083 121.5284 64.3444 36.9139 177.7954 132 D 4.3250 8.2489 118.8988 57.5729 41.0687 177.4508 133 Y 4.1662 8.4580 120.2701 60.9635 38.7478 178.3353 134 L 3.6427 8.2138 119.6436 57.8446 41.6816 179.4870 135 E 3.9403 8.3817 118.6643 59.5184 29.2676 179.4740 136 T 3.8019 8.1326 116.2278 66.7752 68.4903 176.6855 137 Q 3.7882 7.7597 119.8236 58.6967 28.4853 178.7996 138 L 3.8582 7.7504 120.1976 57.7000 41.6582 179.8158 139 G 3.5658 8.2993 106.0188 47.6987 0.0000 175.7633 140 L 4.0181 8.0775 121.6335 57.5967 41.7474 179.5064 141 I 3.5857 7.5094 119.7990 64.3961 36.7522 178.5255 142 Q 3.9491 7.4800 117.6916 59.0628 28.6813 178.7438 143 K 4.1581 7.9812 118.1012 58.5268 32.2217 178.8788 144 V 4.2265 8.2660 110.1343 59.8047 32.9939 176.5712 145 G 4.0207 7.7406 106.7819 45.8397 0.0000 174.3117 146 L 3.9564 8.6398 123.8233 58.2874 42.0526 179.4582 147 E 3.9891 8.1346 117.8453 59.3559 29.3665 178.9619 148 N 4.2906 8.1000 116.0517 56.4311 38.5156 176.3414 149 Y 4.0114 8.0349 119.8541 61.0364 39.0825 178.1969 150 L 4.0917 8.2587 119.6759 57.4743 41.8413 179.0293 151 Q 3.9040 8.2187 119.7575 59.4827 28.8452 178.7220 152 S 4.2598 8.0377 113.6317 60.3810 62.9730 174.6257 153 H 4.6174 7.6583 118.5616 55.6068 29.3615 175.8186 154 M 4.0290 8.0063 121.1520 58.5127 32.2325 175.5052 155 H 5.0837 7.5992 114.1974 53.8154 30.6845 174.9048 156 E 4.1297 8.7256 121.9854 56.7621 29.2811 176.7923 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 2 K 8.30 4.21 0.00 1.60 1.81 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.36 7.81 3 G 8.57 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 4 D 8.64 4.50 0.00 2.79 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.90 3.88 0.00 1.83 1.77 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.51 7.81 6 K 8.06 3.97 0.00 1.91 1.57 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.46 7.81 7 V 7.96 3.56 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 0.94 0.00 0.00 0.92 0.00 0.00 8 I 7.86 3.73 2.00 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 1.39 0.42 0.89 0.00 0.00 9 Q 7.94 3.90 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 10 H 8.20 4.10 0.00 3.37 3.30 0.00 5.69 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 11 L 8.45 3.99 0.00 1.81 1.74 0.94 0.72 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 12 N 8.33 4.36 0.00 2.94 2.85 0.00 0.00 6.66 7.14 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 13 K 8.13 3.95 0.00 1.81 1.98 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 7.96 3.69 2.02 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 1.42 0.53 0.92 0.00 0.00 15 L 8.27 4.04 0.00 1.75 1.82 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.17 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 17 N 8.11 4.35 0.00 2.98 2.88 0.00 0.00 6.98 7.77 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 18 E 8.32 3.97 0.00 2.14 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 2.54 0.00 19 L 8.02 4.05 0.00 1.66 1.67 0.90 0.56 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 20 I 7.58 3.64 1.95 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 1.41 0.82 0.88 0.00 0.00 21 A 7.79 3.23 1.06 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 22 I 7.94 3.60 1.94 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 1.48 0.81 0.87 0.00 0.00 23 N 7.70 4.41 0.00 2.79 2.83 0.00 0.00 6.72 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 24 Q 8.20 3.86 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 25 Y 8.23 4.73 0.00 3.06 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 26 F 8.54 3.96 0.00 3.31 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 27 L 8.29 3.98 0.00 1.88 1.75 0.88 1.31 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 28 H 8.36 3.91 0.00 3.52 2.92 0.00 5.71 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.52 4.35 0.00 4.03 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 30 R 7.92 3.87 0.00 1.85 1.87 0.00 2.88 0.00 0.00 2.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 31 M 8.00 3.46 0.00 0.99 1.77 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.09 0.00 32 W 7.90 4.57 0.00 3.63 3.36 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 33 N 8.42 4.34 0.00 2.89 2.85 0.00 0.00 6.63 7.66 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 34 D 7.92 4.30 0.00 2.51 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 35 W 7.90 4.82 0.00 3.82 3.21 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 0.00 36 G 8.21 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.39 4.59 0.00 2.14 1.67 1.26 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.31 4.06 0.00 1.94 1.86 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.48 7.81 39 R 8.09 3.85 0.00 1.84 1.89 0.00 3.29 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 40 L 7.84 3.76 0.00 1.37 0.24 0.43 0.15 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 41 G 8.31 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 42 A 8.23 4.05 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 43 H 8.40 3.98 0.00 3.28 3.21 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.70 4.02 0.00 2.52 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 0.00 2.77 2.68 0.00 45 Y 8.20 4.07 0.00 3.09 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 46 H 8.23 3.98 0.00 3.29 3.35 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.09 3.73 0.00 2.06 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 2.31 2.19 0.00 48 S 8.17 4.24 0.00 4.08 4.09 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 49 I 7.78 3.59 1.78 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.69 0.81 0.00 0.00 50 D 8.00 4.24 0.00 2.84 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 51 E 8.19 4.03 0.00 1.98 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 2.73 2.57 0.00 52 M 7.99 4.04 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.52 0.00 53 K 7.89 4.07 0.00 1.92 1.84 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 54 H 8.34 4.27 0.00 3.44 3.32 0.00 5.65 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 55 A 8.19 4.00 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 56 D 7.98 4.28 0.00 2.96 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 57 K 7.98 4.04 0.00 2.03 1.85 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.65 7.81 58 L 8.05 3.99 0.00 1.89 1.72 0.98 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.06 3.70 2.03 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 1.52 0.91 0.92 0.00 0.00 60 E 8.24 4.00 0.00 2.16 2.01 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 2.34 2.56 0.00 61 R 8.09 4.04 0.00 2.05 2.13 0.00 3.33 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 62 I 8.09 3.72 2.02 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 1.53 0.51 0.89 0.00 0.00 63 L 7.95 3.99 0.00 2.09 1.79 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.12 4.30 0.00 2.97 3.33 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 0.00 65 L 8.10 3.85 0.00 1.84 1.60 0.95 0.63 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 66 E 7.96 3.75 0.00 1.98 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 2.13 2.24 0.00 67 G 8.15 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 0.00 0.00 0.00 68 L 8.01 4.63 0.00 1.60 1.58 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.37 0.00 2.04 1.99 0.00 3.66 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 2.03 2.07 0.00 70 N 9.42 4.59 0.00 2.61 2.75 0.00 0.00 7.13 7.81 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 71 L 8.34 4.61 0.00 1.62 1.62 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.49 4.18 0.00 1.96 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 73 D 8.12 4.58 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.31 4.53 0.00 1.52 1.52 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.35 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 76 K 8.34 4.26 0.00 1.72 1.72 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.45 7.81 77 L 8.37 4.14 0.00 1.63 1.56 0.88 0.98 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 78 L 8.78 4.39 0.00 1.77 1.69 1.02 0.79 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 79 I 8.19 4.35 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.82 0.91 0.00 0.00 80 G 8.65 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 0.00 0.00 0.00 81 E 8.65 4.80 0.00 2.16 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 0.00 2.28 2.29 0.00 82 N 7.64 4.88 0.00 2.89 2.85 0.00 0.00 5.81 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 83 T 8.60 4.33 5.30 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 1.60 0.00 0.00 84 Q 8.17 3.95 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 85 E 8.78 4.05 0.00 2.21 2.01 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 2.35 2.51 0.00 86 M 8.31 3.93 0.00 1.28 1.92 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.09 0.00 87 L 8.35 4.13 0.00 1.88 1.72 0.82 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.19 4.01 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 89 C 8.74 4.21 0.00 3.27 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 90 D 8.51 4.68 0.00 2.97 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 91 L 8.46 4.02 0.00 1.85 1.89 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.61 4.36 0.00 2.92 2.89 0.00 0.00 6.68 6.29 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 93 L 7.99 3.99 0.00 2.00 1.98 0.92 1.02 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 94 E 8.41 4.14 0.00 2.26 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 0.00 2.77 2.65 0.00 95 L 8.12 4.00 0.00 1.90 1.74 0.95 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.23 3.82 0.00 1.89 2.01 0.00 1.55 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.54 7.81 97 A 8.34 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.04 3.87 4.65 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 0.00 0.00 0.00 1.29 0.00 0.00 99 K 8.06 3.85 0.00 1.85 2.01 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 100 D 8.01 4.41 0.00 2.93 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 0.00 101 L 7.84 4.01 0.00 1.94 1.77 0.91 1.37 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 0.00 102 R 7.93 3.93 0.00 2.08 1.97 0.00 3.19 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 103 E 8.05 3.99 0.00 2.14 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 2.35 2.34 0.00 104 A 8.17 3.58 1.33 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 0.00 0.00 0.00 105 I 7.78 3.70 2.02 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 1.42 0.82 0.93 0.00 0.00 106 V 7.87 3.58 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 0.98 0.00 0.00 0.98 0.00 0.00 107 H 8.03 4.00 0.00 3.40 3.20 0.00 5.84 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 0.00 108 C 8.11 4.08 0.00 3.14 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 0.00 109 E 8.24 3.91 0.00 2.23 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 2.38 2.45 0.00 110 Q 7.90 3.96 0.00 2.31 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 111 V 7.23 3.98 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 0.79 0.00 0.00 0.96 0.00 0.00 112 H 7.49 2.92 0.00 3.15 3.06 0.00 5.64 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.70 4.53 0.00 2.61 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 0.00 114 Y 7.61 4.34 0.00 3.09 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 0.00 115 V 7.88 3.65 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 1.09 0.00 0.00 1.00 0.00 0.00 116 S 8.69 4.12 0.00 4.23 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 0.00 117 R 7.99 3.91 0.00 1.95 2.14 0.00 3.19 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 118 D 8.32 4.33 0.00 3.05 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 0.00 119 L 7.89 3.96 0.00 1.92 1.86 0.94 0.71 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 0.00 120 L 8.04 4.04 0.00 1.89 1.69 0.92 0.90 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 0.00 121 K 8.27 3.95 0.00 2.00 2.03 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.35 7.81 122 D 8.15 4.36 0.00 2.89 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 0.00 123 I 7.70 3.57 1.94 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 1.22 0.77 0.76 0.00 0.00 124 L 8.15 3.93 0.00 1.81 1.84 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.29 3.90 0.00 2.16 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 2.31 2.33 0.00 126 S 7.87 4.10 0.00 3.91 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 0.00 127 E 8.59 4.02 0.00 2.01 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 0.00 2.49 2.52 0.00 128 E 8.75 4.07 0.00 2.10 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 2.35 2.55 0.00 129 E 8.36 4.05 0.00 2.18 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 2.53 0.00 130 H 8.25 4.41 0.00 3.58 3.42 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 7.91 3.77 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.95 0.00 0.00 132 D 8.25 4.33 0.00 2.84 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 0.00 133 Y 8.46 4.17 0.00 3.13 3.27 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 0.00 134 L 8.21 3.64 0.00 2.09 1.67 1.04 1.15 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 0.00 135 E 8.38 3.94 0.00 1.97 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 2.31 2.46 0.00 136 T 8.13 3.80 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 1.19 0.00 0.00 137 Q 7.76 3.79 0.00 1.77 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.99 0.00 138 L 7.75 3.86 0.00 1.71 1.61 0.83 0.94 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 0.00 139 G 8.30 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 0.00 0.00 0.00 140 L 8.08 4.02 0.00 1.79 1.88 1.03 0.73 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 0.00 141 I 7.51 3.59 1.81 0.00 0.00 0.52 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 0.18 0.82 0.00 0.00 142 Q 7.48 3.95 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 143 K 7.98 4.16 0.00 1.73 1.87 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.69 7.81 144 V 8.27 4.23 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 0.79 0.00 0.00 1.05 0.00 0.00 145 G 7.74 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 0.00 0.00 0.00 146 L 8.64 3.96 0.00 1.76 1.69 0.95 0.97 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 0.00 147 E 8.13 3.99 0.00 2.05 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 2.39 2.40 0.00 148 N 8.10 4.29 0.00 3.07 2.88 0.00 0.00 6.74 7.48 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 0.00 149 Y 8.03 4.01 0.00 2.99 3.18 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 0.00 150 L 8.26 4.09 0.00 1.75 1.72 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.22 3.90 0.00 2.16 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 152 S 8.04 4.26 0.00 3.76 3.65 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 0.00 0.00 0.00 0.00 153 H 7.66 4.62 0.00 2.90 3.03 0.00 5.81 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 8.01 4.03 0.00 1.76 2.12 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.39 0.00 155 H 7.60 5.08 0.00 3.14 3.15 0.00 5.77 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 0.00 156 E 8.73 4.13 0.00 1.95 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 2.30 2.30 0.00