NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5174 8.3049 120.3284 55.6323 33.4090 174.3073 2 T 3.7503 8.7301 123.3958 63.1048 67.9098 174.3628 3 H 4.7087 9.1701 128.8659 55.8094 32.0464 173.9382 4 D 4.6121 7.9499 124.5850 53.3583 42.3783 172.7781 5 N 5.0379 7.8030 118.8515 50.7137 41.7396 174.5383 6 K 4.3655 8.4473 123.2929 56.9880 32.5662 176.1943 7 L 4.8831 7.5203 115.0289 52.5035 45.6411 176.1714 8 Q 4.3487 8.5013 119.6576 55.3459 29.3694 175.8976 9 V 4.6028 8.0524 114.8960 60.2133 36.3081 175.3337 10 E 4.6456 8.2450 116.7320 53.9847 29.6336 175.2838 11 A 3.8472 7.7766 121.9012 52.2559 19.4533 177.7802 12 I 4.0607 7.8479 114.8008 58.2748 38.0671 175.2639 13 K 2.7150 7.8196 127.0096 57.2073 31.9067 174.8259 14 R 3.8538 8.4997 128.9234 56.0807 27.6464 174.5394 15 G 3.7905 7.8216 109.0379 45.7666 0.0000 168.8277 16 T 4.8844 9.0302 116.3655 61.4780 71.6897 173.7972 17 V 4.6692 8.6067 125.6359 61.0436 34.9725 174.2252 18 I 4.7114 8.5596 128.3539 59.8321 39.2562 174.7222 19 D 5.0649 8.5566 127.4535 51.5376 42.6425 175.5999 20 H 3.8586 8.4624 112.1401 57.0786 26.1784 175.3898 21 I 4.3321 7.3429 119.7587 59.2718 37.6898 174.8304 22 P 4.5981 0.0000 0.0000 62.6690 32.4214 175.8581 23 A 4.5781 8.5891 123.4522 51.7830 19.3023 176.7706 24 Q 3.5005 8.6640 114.9731 56.8165 26.6580 175.1100 25 I 4.6878 7.5872 115.0735 61.1209 42.2415 178.2316 26 G 3.5453 7.9688 104.4956 47.7940 0.0000 175.4048 27 F 4.0894 8.2833 123.5566 60.6977 39.5479 176.8620 28 K 4.1021 8.0731 119.9104 58.9915 31.8201 178.4901 29 L 3.8866 8.0558 119.3360 56.9417 41.1691 178.5570 30 L 4.2805 7.8391 117.8053 55.1786 41.7886 177.8913 31 S 4.6134 7.4829 112.9407 57.6555 63.0349 174.2380 32 L 4.5506 6.9341 117.2951 56.8579 44.2695 177.9197 33 F 3.9866 8.6853 115.7536 57.4224 38.7625 176.9241 34 K 3.7822 7.4409 116.4290 57.8500 29.1950 174.8623 35 L 4.6937 7.6275 123.3654 55.2647 42.4106 177.9903 36 T 4.4406 7.6587 114.8596 64.0075 71.5766 175.4695 37 E 4.2476 7.9227 122.6865 55.3336 27.4129 176.3863 38 T 4.3589 7.2070 115.2625 62.6304 71.9934 175.1810 39 D 4.6995 8.4135 131.9854 52.8133 39.7467 175.9413 40 Q 4.4590 7.1747 118.9109 53.7862 33.1244 173.8255 41 R 4.1446 8.7937 123.5320 56.5368 31.0015 174.9951 42 I 4.8684 8.3691 119.9243 59.3331 40.4346 174.8583 43 T 4.5831 8.9257 121.7170 61.8513 71.5625 173.0736 44 I 4.3361 8.6073 127.3048 59.7606 38.7939 175.0179 45 G 4.1102 8.9839 116.1111 44.4451 0.0000 171.0442 46 L 4.9452 8.3157 125.4942 53.0624 44.3837 176.5680 47 N 4.2187 8.8493 120.0407 54.6558 35.6785 173.9190 48 L 4.8146 8.9956 119.1274 52.6697 46.1131 176.2245 49 P 5.1296 0.0000 0.0000 60.9232 30.4492 175.7665 50 S 4.2771 7.8948 116.0382 60.8528 62.6942 174.8858 51 G 3.6461 7.4738 108.3927 46.2796 0.0000 174.5018 52 E 4.7682 7.6993 120.2790 53.7329 33.8097 176.6361 53 M 4.3728 8.3355 119.0212 54.3818 30.3728 174.4607 54 G 4.1587 7.2329 107.2342 45.0302 0.0000 171.4552 55 R 4.4650 8.6011 119.2865 55.0452 29.7518 176.4333 56 K 4.8111 8.7103 124.4774 55.1471 36.0441 174.6360 57 D 5.3206 8.9938 118.9312 52.5375 44.7672 175.1091 58 L 4.9552 9.2255 122.7635 53.0455 45.1580 175.6463 59 I 4.7140 8.2786 124.0574 59.4191 39.1272 174.1967 60 K 4.6270 8.6979 127.2376 55.7290 33.1649 176.3382 61 I 4.8000 8.7542 124.9325 59.5952 41.7765 174.2039 62 E 4.1634 8.5979 126.5240 55.3428 29.6960 176.5951 63 N 3.5979 7.7212 126.1229 55.2203 38.3596 174.6694 64 T 4.5207 6.5437 109.2986 62.2725 69.4645 175.8595 65 F 4.1728 7.4875 118.4995 57.1432 39.3488 175.8765 66 L 4.3132 8.4381 127.0492 53.6711 41.9906 177.3720 67 S 4.3011 8.7427 120.2086 58.7292 63.7200 175.5010 68 E 4.1029 8.8116 120.7602 58.9470 28.5658 178.8146 69 D 4.6217 7.9596 118.5364 56.1056 41.4262 177.5940 70 Q 4.3237 8.0616 118.0051 57.5962 29.4018 177.4834 71 V 3.9349 7.6165 112.7547 64.2761 32.0560 177.7181 72 D 4.4046 7.7449 117.5905 57.5326 40.7957 178.2182 73 Q 4.3997 7.8321 114.6283 57.3413 28.7662 177.2250 74 L 4.3153 8.0624 118.5667 55.4840 42.3952 178.0502 75 A 3.7305 8.0473 120.3196 54.1981 18.3373 178.2529 76 L 4.2838 7.8894 116.5435 55.8920 42.5758 176.1299 77 Y 4.5248 8.7607 114.7152 59.2670 40.5317 176.3243 78 A 4.7706 7.5117 121.3595 50.3252 19.8179 174.5434 79 P 4.1339 0.0000 0.0000 64.5509 32.2820 178.3881 80 Q 4.1099 8.0984 116.0969 57.9093 29.2072 176.5344 81 A 4.1520 7.5065 119.2552 52.3860 18.9899 177.1802 82 T 4.6729 8.3805 113.0767 60.7256 71.3989 174.1546 83 V 4.6569 9.0951 121.8674 60.2265 34.4132 173.9723 84 N 5.0819 9.1598 124.0289 51.4397 40.8312 173.9954 85 R 4.9212 8.4319 124.6569 55.1818 32.1799 174.9596 86 I 4.7600 8.6472 126.5332 59.7920 40.8921 174.5514 87 D 4.6355 8.5564 126.8283 53.1621 40.4778 174.2863 88 N 3.8349 8.8193 121.9989 55.4392 36.5956 173.3392 89 Y 3.5143 7.2920 112.0629 58.5507 37.2480 171.3050 90 E 4.4970 8.4123 122.0256 53.2716 28.8029 175.2675 91 V 3.8726 7.8029 116.8330 61.3895 32.5505 175.1971 92 V 4.2487 8.7349 120.1119 62.1403 34.8697 175.0828 93 G 3.5151 7.2129 108.4108 41.5897 0.0000 174.7438 94 K 4.7843 7.8850 123.0017 55.5613 35.7449 174.4733 95 S 4.7358 7.8992 113.3977 58.5523 66.8176 176.3177 96 R 4.5298 8.9818 119.4152 56.2717 30.8364 172.9133 97 P 3.8674 0.0000 0.0000 59.0634 32.9796 175.2242 98 S 4.4588 8.3110 113.6958 56.1077 64.8594 173.1308 99 L 3.8818 8.8365 127.3286 54.5853 41.4981 175.5516 100 P 4.4192 0.0000 0.0000 62.9844 32.0519 176.1862 101 E 4.2776 8.6969 120.4286 58.7381 30.6760 175.9743 102 R 5.6191 7.5146 115.2411 56.1968 34.2915 175.1077 103 I 4.7639 7.9752 119.7637 60.0580 36.9169 174.9071 104 D 4.9195 8.0936 124.3465 54.8685 42.7621 178.1689 105 N 4.4766 9.7585 117.7331 53.8451 37.4345 175.2466 106 V 4.1105 7.4862 116.3705 63.5194 33.8118 175.0327 107 L 4.8780 7.5518 118.1299 54.0240 44.3230 175.8250 108 V 4.5791 7.5154 118.8942 62.2478 34.8724 174.8886 109 C 4.6112 9.1954 128.6527 59.3915 32.1521 172.2047 110 P 4.3406 0.0000 0.0000 63.3835 31.1467 175.8831 111 N 4.6329 7.9546 119.3857 52.4848 38.3622 175.5462 112 S 4.1699 8.7681 121.9066 61.0862 63.0708 174.9428 113 N 4.5743 8.0302 116.9990 54.0664 39.2941 174.4765 114 C 4.1338 7.7376 118.0677 60.0402 32.2797 173.5002 115 I 3.8304 8.3787 125.8424 63.9897 37.8478 177.5893 116 S 4.0399 7.9049 110.9288 59.7053 62.4589 173.8575 117 H 4.8365 7.9748 117.0622 56.0909 28.4923 175.5573 118 A 4.6866 7.6297 118.6909 51.6944 21.7759 176.1641 119 E 4.7584 7.7116 114.0488 53.4489 33.3045 174.7615 120 P 4.6190 0.0000 0.0000 62.9608 28.9537 175.3817 121 V 4.3354 7.2036 111.6768 59.0264 35.2282 175.7458 122 S 4.5048 8.7277 121.0386 57.9871 63.2030 174.3576 123 S 4.5257 8.8715 120.1125 59.4609 64.1102 173.5376 124 S 5.3282 8.3489 115.7849 57.6506 67.6535 173.0773 125 F 5.8846 9.1809 120.5581 55.3313 43.1298 173.5337 126 A 4.5648 8.7526 125.4505 51.8019 19.7483 176.1551 127 V 4.3127 8.2979 122.9750 61.8128 32.8878 175.3218 128 R 4.5478 8.5012 127.4963 54.3377 32.9514 173.8320 129 K 4.5767 8.7776 128.6189 56.1130 32.9007 176.2718 130 R 4.4533 8.5502 124.6626 55.1938 31.0598 174.1856 131 A 4.2902 8.6798 122.1424 52.2887 19.1713 177.1042 132 N 4.1522 8.6673 121.8546 53.4907 36.2370 173.7220 133 D 4.5462 6.7878 117.1561 54.3504 43.8305 174.3244 134 I 4.8848 7.1698 121.6812 59.2502 40.8918 174.3249 135 A 4.8891 9.5262 129.4344 50.3165 21.1862 175.2700 136 L 5.0766 9.1483 123.6847 53.1280 44.3589 175.6234 137 K 5.1651 8.4202 124.1731 53.4393 34.3645 175.2132 138 C 4.4098 8.4664 124.8217 59.5018 28.7721 174.6628 139 K 3.6445 8.2130 122.1627 58.5836 32.0305 176.7916 140 Y 4.4442 7.7519 116.8616 59.9205 39.0507 176.5619 141 C 4.1451 7.8985 114.6635 59.3282 30.1146 175.4488 142 E 3.8173 7.5482 118.3848 56.4225 29.3324 174.0403 143 K 4.2808 7.3069 117.1007 56.7694 34.2956 175.0368 144 E 4.6643 7.6649 120.6643 55.2782 32.4656 174.5153 145 F 5.1996 9.0606 124.9346 55.4583 43.5928 174.2060 146 S 4.8842 8.6890 114.7488 57.6174 62.6788 174.5085 147 H 3.7185 8.5344 123.7682 58.4634 28.1528 176.7304 148 N 4.0738 8.1781 115.9583 54.9473 38.6716 175.8585 149 V 4.0366 8.3237 110.4782 60.9911 32.5580 175.7128 150 V 4.0286 7.0982 120.7230 61.6046 31.2929 175.5448 151 L 4.6088 8.3119 127.9508 54.4924 43.5859 175.5290 152 A 4.6863 8.2619 120.2928 52.0704 22.1932 176.1171 153 N 4.3349 8.5335 116.8880 54.1958 39.3060 174.2169 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 8.30 4.52 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 2 T 8.73 3.75 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 1.26 0.00 0.00 3 H 9.17 4.71 0.00 3.09 3.27 0.00 5.96 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 7.95 4.61 0.00 2.60 2.48 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 5 N 7.80 5.04 0.00 2.66 2.65 0.00 0.00 7.18 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 6 K 8.45 4.37 0.00 1.71 1.78 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.45 7.81 7 L 7.52 4.88 0.00 1.62 1.51 1.06 0.99 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 8 Q 8.50 4.35 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 9 V 8.05 4.60 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 0.78 0.00 0.00 1.00 0.00 0.00 10 E 8.25 4.65 0.00 1.90 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 2.22 2.29 0.00 11 A 7.78 3.85 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 12 I 7.85 4.06 1.72 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.63 0.84 0.00 0.00 13 K 7.82 2.72 0.00 0.79 1.53 0.00 2.26 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.33 1.43 7.81 14 R 8.50 3.85 0.00 2.09 1.84 0.00 3.49 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 15 G 7.82 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 16 T 9.03 4.88 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 1.16 0.00 0.00 17 V 8.61 4.67 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 1.05 0.00 0.00 0.88 0.00 0.00 18 I 8.56 4.71 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.01 0.87 0.00 0.00 19 D 8.56 5.06 0.00 2.70 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 20 H 8.46 3.86 0.00 3.28 3.38 0.00 5.70 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.34 4.33 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 1.20 0.64 0.93 0.00 0.00 22 P 0.00 4.60 0.00 2.09 2.01 0.00 3.63 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 23 A 8.59 4.58 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 24 Q 8.66 3.50 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 25 I 7.59 4.69 2.12 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.06 0.96 0.00 0.00 26 G 7.97 3.55 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 0.00 0.00 0.00 27 F 8.28 4.09 0.00 3.16 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 28 K 8.07 4.10 0.00 1.98 1.92 0.00 1.96 0.00 0.00 2.06 0.00 0.00 3.18 0.00 0.00 3.50 0.00 0.00 0.00 0.00 1.43 1.45 7.81 29 L 8.06 3.89 0.00 1.76 1.46 0.77 0.17 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 30 L 7.84 4.28 0.00 1.52 1.59 0.90 0.70 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 31 S 7.48 4.61 0.00 3.51 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 32 L 6.93 4.55 0.00 1.86 1.74 0.76 1.11 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 33 F 8.69 3.99 0.00 2.92 3.03 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 0.00 0.00 0.00 34 K 7.44 3.78 0.00 1.80 1.79 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.52 7.81 35 L 7.63 4.69 0.00 1.40 1.63 0.86 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.66 4.44 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 37 E 7.92 4.25 0.00 1.91 1.88 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 2.28 2.32 0.00 38 T 7.21 4.36 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 39 D 8.41 4.70 0.00 2.66 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 7.17 4.46 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.98 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 41 R 8.79 4.14 0.00 1.92 2.09 0.00 3.17 0.00 0.00 3.38 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 42 I 8.37 4.87 1.84 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 1.32 0.84 0.92 0.00 0.00 43 T 8.93 4.58 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 44 I 8.61 4.34 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 1.28 0.57 0.95 0.00 0.00 45 G 8.98 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 46 L 8.32 4.95 0.00 1.51 1.58 1.01 1.21 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 47 N 8.85 4.22 0.00 2.87 2.87 0.00 0.00 6.85 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 48 L 9.00 4.81 0.00 1.52 1.52 0.93 1.02 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 49 P 0.00 5.13 0.00 2.04 2.02 0.00 3.72 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 50 S 7.89 4.28 0.00 3.84 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 51 G 7.47 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 0.00 0.00 0.00 52 E 7.70 4.77 0.00 1.92 1.87 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 2.24 2.23 0.00 53 M 8.34 4.37 0.00 2.01 2.04 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 2.59 2.48 0.00 54 G 7.23 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.60 4.47 0.00 1.71 1.93 0.00 3.18 0.00 0.00 3.28 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 56 K 8.71 4.81 0.00 1.86 1.97 0.00 1.44 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.60 1.42 7.81 57 D 8.99 5.32 0.00 2.71 2.56 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 0.00 0.00 0.00 0.00 58 L 9.23 4.96 0.00 1.51 1.53 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.28 4.71 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.79 0.86 0.00 0.00 60 K 8.70 4.63 0.00 1.67 1.68 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.55 7.81 61 I 8.75 4.80 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.13 0.81 0.00 0.00 62 E 8.60 4.16 0.00 1.77 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 0.00 2.24 2.38 0.00 63 N 7.72 3.60 0.00 2.75 2.76 0.00 0.00 7.03 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 6.54 4.52 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 1.17 0.00 0.00 65 F 7.49 4.17 0.00 3.02 3.05 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 0.00 0.00 0.00 66 L 8.44 4.31 0.00 1.66 1.66 0.90 0.96 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 67 S 8.74 4.30 0.00 3.92 3.85 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 68 E 8.81 4.10 0.00 2.02 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 2.42 2.43 0.00 69 D 7.96 4.62 0.00 2.72 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 70 Q 8.06 4.32 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 71 V 7.62 3.93 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 0.91 0.00 0.00 0.99 0.00 0.00 72 D 7.74 4.40 0.00 2.90 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 7.83 4.40 0.00 2.59 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.80 0.00 0.00 0.00 0.00 0.00 2.57 2.66 0.00 74 L 8.06 4.32 0.00 1.61 1.53 0.80 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.05 3.73 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 76 L 7.89 4.28 0.00 1.68 1.66 0.91 0.57 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 77 Y 8.76 4.52 0.00 2.86 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 78 A 7.51 4.77 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 79 P 0.00 4.13 0.00 2.06 2.14 0.00 3.69 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.37 0.00 80 Q 8.10 4.11 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 81 A 7.51 4.15 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 82 T 8.38 4.67 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 83 V 9.10 4.66 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 0.85 0.00 0.00 0.98 0.00 0.00 84 N 9.16 5.08 0.00 2.67 2.77 0.00 0.00 6.15 7.95 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 85 R 8.43 4.92 0.00 1.94 1.99 0.00 3.02 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.09 0.00 86 I 8.65 4.76 1.83 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 1.23 1.09 0.91 0.00 0.00 87 D 8.56 4.64 0.00 2.73 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 88 N 8.82 3.83 0.00 2.95 2.80 0.00 0.00 7.22 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 89 Y 7.29 3.51 0.00 3.13 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 E 8.41 4.50 0.00 2.20 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 2.24 2.28 0.00 91 V 7.80 3.87 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 0.75 0.00 0.00 0.95 0.00 0.00 92 V 8.73 4.25 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 0.70 0.00 0.00 1.15 0.00 0.00 93 G 7.21 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.88 4.78 0.00 1.75 1.84 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.41 7.81 95 S 7.90 4.74 0.00 3.87 3.72 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 96 R 8.98 4.53 0.00 1.82 1.89 0.00 3.12 0.00 0.00 3.24 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 97 P 0.00 3.87 0.00 2.11 2.11 0.00 3.80 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 2.00 2.11 0.00 98 S 8.31 4.46 0.00 3.77 3.99 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 0.00 0.00 0.00 99 L 8.84 3.88 0.00 1.68 1.68 0.92 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 0.00 100 P 0.00 4.42 0.00 2.14 2.11 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 101 E 8.70 4.28 0.00 2.07 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 2.38 2.35 0.00 102 R 7.51 5.62 0.00 1.73 1.99 0.00 3.26 0.00 0.00 3.89 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 103 I 7.98 4.76 1.93 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 1.44 0.68 0.99 0.00 0.00 104 D 8.09 4.92 0.00 2.65 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 0.00 105 N 9.76 4.48 0.00 2.83 2.95 0.00 0.00 6.66 5.16 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 0.00 106 V 7.49 4.11 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 0.72 0.00 0.00 0.69 0.00 0.00 107 L 7.55 4.88 0.00 1.20 1.30 0.55 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.52 4.58 2.15 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 0.80 0.00 0.00 0.99 0.00 0.00 109 C 9.20 4.61 0.00 3.23 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 0.00 110 P 0.00 4.34 0.00 1.02 1.72 0.00 3.10 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.98 0.00 111 N 7.95 4.63 0.00 3.09 2.87 0.00 0.00 6.89 8.97 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 0.00 112 S 8.77 4.17 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.03 4.57 0.00 2.74 2.92 0.00 0.00 6.89 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 0.00 114 C 7.74 4.13 0.00 3.18 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 8.38 3.83 1.87 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 1.43 0.98 0.85 0.00 0.00 116 S 7.90 4.04 0.00 3.81 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.97 4.84 0.00 3.38 3.31 0.00 5.63 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 0.00 118 A 7.63 4.69 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 119 E 7.71 4.76 0.00 1.81 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 120 P 0.00 4.62 0.00 2.01 2.01 0.00 3.58 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 121 V 7.20 4.34 1.56 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 0.53 0.00 0.00 0.57 0.00 0.00 122 S 8.73 4.50 0.00 3.84 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.87 4.53 0.00 4.24 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.35 5.33 0.00 3.61 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 0.00 125 F 9.18 5.88 0.00 2.96 2.98 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 0.00 126 A 8.75 4.56 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 0.00 127 V 8.30 4.31 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 0.76 0.00 0.00 1.02 0.00 0.00 128 R 8.50 4.55 0.00 1.81 1.71 0.00 3.29 0.00 0.00 3.08 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 129 K 8.78 4.58 0.00 1.80 1.68 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.42 7.81 130 R 8.55 4.45 0.00 1.88 1.80 0.00 3.08 0.00 0.00 3.41 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 131 A 8.68 4.29 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 0.00 132 N 8.67 4.15 0.00 2.88 2.91 0.00 0.00 7.00 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 D 6.79 4.55 0.00 2.80 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 0.00 134 I 7.17 4.88 1.49 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 1.21 0.50 0.86 0.00 0.00 135 A 9.53 4.89 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 0.00 136 L 9.15 5.08 0.00 1.75 1.87 0.71 0.61 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 0.00 137 K 8.42 5.17 0.00 1.76 1.62 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.21 1.23 7.81 138 C 8.47 4.41 0.00 2.82 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 0.00 139 K 8.21 3.64 0.00 1.46 1.21 0.00 1.46 0.00 0.00 1.47 0.00 0.00 2.47 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.65 1.14 7.81 140 Y 7.75 4.44 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 C 7.90 4.15 0.00 3.31 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 E 7.55 3.82 0.00 2.24 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 2.15 2.19 0.00 143 K 7.31 4.28 0.00 1.45 1.40 0.00 1.99 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.53 7.81 144 E 7.66 4.66 0.00 1.76 1.58 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 2.11 2.33 0.00 145 F 9.06 5.20 0.00 3.07 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 S 8.69 4.88 0.00 3.92 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 0.00 147 H 8.53 3.72 0.00 3.18 3.49 0.00 5.33 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 0.00 148 N 8.18 4.07 0.00 2.72 2.88 0.00 0.00 6.84 7.68 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 0.00 149 V 8.32 4.04 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 0.67 0.00 0.00 1.05 0.00 0.00 150 V 7.10 4.03 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 0.50 0.00 0.00 0.96 0.00 0.00 151 L 8.31 4.61 0.00 1.64 1.57 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 152 A 8.26 4.69 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 0.00 153 N 8.53 4.33 0.00 2.59 2.61 0.00 0.00 7.01 8.90 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