NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3765 8.2649 123.5833 52.2527 19.1419 175.4127 2 T 4.6028 7.8969 117.5004 62.5462 72.5690 172.3853 3 K 5.3185 8.4188 121.4384 54.5527 36.8537 175.1089 4 A 5.3922 9.0063 124.6356 50.4519 23.1865 175.1834 5 V 4.9620 9.1721 117.7952 60.2616 35.5576 173.9554 6 A 4.8139 8.9436 123.6979 50.4497 22.3996 175.1145 7 V 4.3650 8.4287 123.1569 61.4763 33.0657 174.7731 8 L 4.7013 9.1233 130.2316 54.2423 42.6648 176.5319 9 K 4.9579 8.6825 122.7857 54.3559 36.7723 175.3295 10 G 4.2708 8.0083 107.1700 45.3090 0.0000 173.5714 11 D 4.8351 8.4603 120.5051 51.9927 38.6564 174.7545 12 G 4.0677 7.1399 106.5206 45.1546 0.0000 169.7600 13 P 4.3845 0.0000 0.0000 64.2570 31.8898 176.5151 14 V 4.6577 7.8056 120.0170 62.5363 32.2170 174.9679 15 Q 4.7916 8.2331 122.6832 56.0393 31.6444 172.8010 16 G 4.1673 8.4905 107.3057 46.1219 0.0000 172.0351 17 I 5.0281 8.2063 120.1078 59.4638 40.4322 175.0354 18 I 4.6761 8.6681 128.3285 59.3984 39.9825 174.5783 19 N 5.0096 8.7054 124.6913 51.3303 41.2782 173.8526 20 F 5.4449 8.7981 119.9558 55.8466 43.2689 173.9094 21 E 5.2255 9.5644 123.1538 54.9641 33.2045 173.4063 22 Q 4.7651 9.1184 129.1974 54.4430 30.0781 175.3776 23 K 4.2160 8.9716 127.2110 58.4743 32.7844 177.4242 24 E 4.8004 7.7608 116.4095 53.9289 32.8989 176.3960 25 S 4.1155 8.9050 116.3719 61.0544 62.3125 175.0629 26 N 4.9426 8.0931 114.0675 52.3184 37.3839 174.3930 27 G 3.9782 8.0632 108.7600 44.0680 0.0000 172.3777 28 P 4.5369 0.0000 0.0000 62.5876 32.1667 175.7235 29 V 4.5243 8.9336 120.4871 61.5462 33.8263 174.3014 30 K 4.8337 9.1284 129.2291 54.9858 34.1104 174.9055 31 V 4.8527 9.1026 128.8263 60.9511 33.3618 174.2986 32 W 5.5897 9.2283 124.7189 53.0859 32.0712 176.0834 33 G 3.8370 7.5654 106.3141 46.0962 0.0000 170.7672 34 S 5.0920 7.7746 112.7416 56.8293 66.5824 174.2122 35 I 5.0092 8.7667 125.0310 59.4773 41.2821 174.4801 36 K 5.4792 8.5869 125.3159 54.9114 35.8465 177.2217 37 G 3.8856 9.0677 108.8870 45.2372 0.0000 173.5831 38 L 4.3003 7.4692 120.1592 54.0296 42.9089 175.3859 39 T 4.6039 8.0025 109.5000 59.6555 70.5177 174.1881 40 E 3.9528 8.6305 123.6194 57.9318 30.1244 175.5446 41 G 3.8192 8.8059 110.6264 43.5976 0.0000 172.7003 42 L 4.7178 8.1073 118.6537 55.2081 42.6021 177.0733 43 H 4.8210 9.1863 118.9623 53.8345 33.4079 173.2512 44 G 4.0961 8.8738 110.7682 46.8282 0.0000 171.9587 45 F 5.7271 9.6798 126.2507 56.7994 42.3195 173.5115 46 H 5.1737 8.8006 121.6470 54.2759 34.1874 172.3969 47 V 4.5939 8.7357 119.4180 61.7258 33.1198 174.7093 48 H 4.9930 9.3512 125.8530 54.8397 30.3008 176.2515 49 E 3.7707 9.1463 122.2143 59.0779 29.7600 177.0612 50 F 4.9052 8.3073 117.9940 55.1416 41.7399 176.5890 51 G 4.2431 8.5385 110.0731 44.4577 0.0000 173.4001 52 D 4.7619 8.1629 120.1355 52.7202 41.9176 175.2339 53 N 5.2632 8.4007 125.6200 53.1199 39.7226 177.1644 54 T 3.7916 8.4890 111.3620 64.2273 68.8622 174.9025 55 A 4.5117 8.0732 122.6321 51.3406 19.7479 177.7742 56 G 3.8352 7.7662 108.1684 45.9612 0.0000 173.9352 57 C 4.3394 8.7274 114.6508 60.0524 40.4486 176.2433 58 T 3.7940 7.9438 109.2965 64.5249 68.2495 175.3743 59 S 4.2441 8.0812 114.8962 59.5797 63.4936 175.2271 60 A 4.5099 7.6359 123.6016 52.0399 18.1588 178.9087 61 G 4.4729 7.7096 106.3649 43.8944 0.0000 171.2204 62 P 4.7013 0.0000 0.0000 62.0204 33.3744 175.2702 63 H 4.3384 8.5004 116.4205 55.9257 29.4913 175.5910 64 F 4.2409 9.0248 124.5491 58.3310 39.9423 174.3329 65 N 4.7446 7.9766 125.5342 50.9416 38.9442 171.6382 66 P 4.1897 0.0000 0.0000 65.1744 31.8436 178.4366 67 L 4.3482 7.6638 117.5866 55.2042 41.9234 177.1625 68 S 3.8485 7.1227 112.8468 59.4884 60.6353 171.3398 69 R 4.5286 7.2169 120.7280 54.8722 32.9792 176.8277 70 K 4.4016 8.5854 119.2171 56.4534 34.5263 175.7041 71 H 4.5177 7.9964 120.2074 55.6142 31.3803 174.8737 72 G 3.9078 8.1111 111.3900 44.6844 0.0000 173.3769 73 G 3.7976 8.4972 108.5010 44.5257 0.0000 173.1747 74 P 4.3627 0.0000 0.0000 64.4149 31.3522 177.1188 75 K 4.4253 7.8194 116.7576 56.2588 32.7892 176.0011 76 D 4.6696 7.7247 119.4127 53.5344 41.7076 176.3260 77 E 3.9073 8.6789 122.3763 58.6013 29.8921 176.3736 78 E 4.3233 7.8059 120.4340 55.2345 29.2905 174.6720 79 R 4.6840 7.5697 119.8051 56.3710 31.8847 174.2676 80 H 4.4920 8.2677 115.9800 55.2859 29.6020 177.0042 81 V 3.5053 8.1787 122.1282 66.1872 31.6126 177.2672 82 G 3.8377 8.4412 105.2782 47.4246 0.0000 173.5557 83 D 5.0054 8.0492 121.2366 53.7158 39.8574 175.5503 84 L 4.4338 8.4525 122.0910 53.5180 42.4089 178.4424 85 G 4.0815 8.5308 107.9504 46.3588 0.0000 173.6229 86 N 5.6632 8.6835 120.7329 51.3838 42.3849 173.7857 87 V 4.4776 8.5768 113.5483 59.9379 35.5093 174.7220 88 T 5.0374 8.4861 120.0478 62.0273 70.4724 173.7268 89 A 4.8952 8.9131 128.2950 50.4458 21.6997 176.9783 90 D 4.7778 8.3082 121.2880 51.7003 41.5477 177.2276 91 K 4.4535 8.5006 116.9653 58.6589 32.1546 177.6065 92 D 4.7056 8.6182 117.5419 53.3632 41.0745 176.8387 93 G 4.2177 8.5128 107.1960 46.0459 0.0000 173.2658 94 V 4.8430 7.4601 116.5024 60.5118 34.3417 174.0288 95 A 4.7164 9.4072 130.8193 50.6045 20.8264 175.1535 96 D 4.9676 8.5592 123.1947 53.2380 39.8703 176.2830 97 V 3.5115 8.0901 123.1318 63.4597 32.9565 175.1326 98 S 5.0459 8.3555 120.4000 57.5361 63.4857 172.6827 99 I 4.7913 9.0579 125.2233 58.8305 41.2567 173.8262 100 E 5.1148 8.7593 124.8542 54.7110 32.2893 173.9867 101 D 5.1247 9.5128 126.2274 52.8303 44.8235 176.0794 102 S 4.7483 8.8832 117.3765 58.5040 64.3228 175.2935 103 V 3.9901 7.8903 119.8462 64.3982 31.9143 176.4610 104 I 4.2176 7.6927 111.3731 60.6185 38.6681 174.4355 105 S 4.6231 8.3108 114.7746 57.4888 65.4550 174.2389 106 L 4.5449 8.5744 122.4576 54.4735 41.6823 176.9169 107 S 4.5297 7.7260 114.2159 57.9181 67.3572 175.7587 108 G 3.8337 8.5836 111.7599 44.7471 0.0000 172.9485 109 D 4.3799 8.8042 117.0231 57.9683 41.2548 177.8994 110 H 4.9298 8.2257 113.9367 56.1043 28.5193 174.3548 111 S 4.4210 7.8926 115.8289 58.1882 62.4778 174.0462 112 I 3.5900 8.4775 120.7111 60.8065 37.9118 175.4989 113 I 3.5805 7.0312 123.6603 62.9485 37.0724 176.2026 114 G 3.8206 9.4448 114.2854 45.1027 0.0000 172.2931 115 R 4.7657 7.3667 118.4582 54.4079 33.9792 174.5098 116 T 4.9308 7.9452 115.5595 62.2691 70.6509 174.0582 117 L 4.6452 8.7292 128.4820 53.8133 44.3239 175.3449 118 V 5.0276 8.4691 125.1555 61.0647 35.4630 174.0345 119 V 4.9951 8.7435 127.4143 60.4566 33.4270 175.3815 120 H 5.0577 9.2155 123.2660 55.1446 29.7383 175.5272 121 E 4.1639 9.2858 121.2271 59.2652 29.7161 177.2467 122 K 4.6033 8.5785 118.3363 54.4253 34.7819 175.6806 123 A 4.4218 8.2575 123.8640 51.8993 19.0514 176.4321 124 D 4.7776 9.1003 121.8315 53.7779 41.2851 176.4769 125 D 4.4800 9.3952 126.3999 53.8544 39.6680 176.9683 126 L 3.5599 9.6577 120.1083 56.0775 39.4865 175.8343 127 G 3.9731 8.7097 104.7837 45.9997 0.0000 174.7684 128 K 4.5346 7.7549 116.4210 55.9407 32.2946 177.8257 129 G 3.7039 7.5870 110.7863 46.0490 0.0000 175.7946 130 G 3.9748 8.8764 106.6724 44.8624 0.0000 171.9372 131 N 5.1027 7.4185 115.0203 50.2099 40.4305 174.1577 132 E 4.0669 8.8741 117.3542 60.1427 29.7817 179.8867 133 E 3.9507 8.2902 117.3645 59.5167 29.5753 179.0525 134 S 4.1556 8.8778 113.8276 61.3640 62.1913 175.4041 135 T 4.4130 7.4879 110.1055 61.6169 68.6034 175.6020 136 E 4.4154 7.9008 122.0104 57.5370 31.6135 176.2836 137 T 4.1632 8.1320 105.3035 59.8124 70.6541 175.2753 138 G 4.2257 8.2875 110.2263 45.2890 0.0000 173.4544 139 N 4.3335 8.1476 114.9040 53.9748 36.7424 176.4496 140 A 4.3611 7.0026 122.0225 53.1606 18.9589 179.3508 141 G 3.5783 7.3344 102.9737 44.1782 0.0000 173.0988 142 S 4.4817 8.0280 112.7431 58.1929 65.0070 174.1590 143 R 4.4012 8.3834 119.8699 55.2512 29.2714 176.6448 144 L 4.2723 8.5790 125.1625 57.3807 42.2210 177.8312 145 A 4.9486 7.7374 118.5184 50.8424 22.9294 173.8715 146 C 5.4108 9.2028 114.4217 54.5324 46.2674 172.9030 147 G 4.5777 8.5175 103.4858 45.8913 0.0000 173.2328 148 V 4.2528 8.4340 123.8235 62.6728 32.7793 175.2575 149 I 4.3027 8.9715 128.7438 60.5744 38.3562 175.2654 150 G 4.4437 8.9580 114.2971 43.9604 0.0000 172.0166 151 I 4.5179 8.2541 121.5613 61.0127 37.4572 176.0248 152 A 4.5214 8.4794 129.5969 50.3333 20.6241 176.9689 153 Q 4.0681 8.4501 118.8261 56.4717 29.1993 176.0081 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 A 8.26 4.38 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 2 T 7.90 4.60 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 1.29 0.00 0.00 3 K 8.42 5.32 0.00 1.86 1.72 0.00 1.71 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.53 1.48 7.81 4 A 9.01 5.39 1.17 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 5 V 9.17 4.96 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 0.81 0.00 0.00 0.91 0.00 0.00 6 A 8.94 4.81 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 7 V 8.43 4.37 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 0.97 0.00 0.00 0.91 0.00 0.00 8 L 9.12 4.70 0.00 1.79 1.60 1.03 0.77 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 9 K 8.68 4.96 0.00 1.64 1.65 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.49 7.81 10 G 8.01 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 0.00 0.00 0.00 0.00 11 D 8.46 4.84 0.00 2.78 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 12 G 7.14 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.38 0.00 2.18 2.18 0.00 3.76 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 1.97 1.94 0.00 14 V 7.81 4.66 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 0.57 0.00 0.00 0.92 0.00 0.00 15 Q 8.23 4.79 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 16 G 8.49 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.21 5.03 1.80 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 1.19 0.98 0.80 0.00 0.00 18 I 8.67 4.68 1.78 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.31 0.53 0.00 0.00 19 N 8.71 5.01 0.00 1.44 1.42 0.00 0.00 6.44 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 20 F 8.80 5.44 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 21 E 9.56 5.23 0.00 2.50 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 2.32 2.55 0.00 22 Q 9.12 4.77 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 23 K 8.97 4.22 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.50 7.81 24 E 7.76 4.80 0.00 1.99 1.81 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 0.00 2.29 2.26 0.00 25 S 8.90 4.12 0.00 3.83 3.93 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 26 N 8.09 4.94 0.00 2.81 2.83 0.00 0.00 5.96 7.00 0.00 0.00 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 G 8.06 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 28 P 0.00 4.54 0.00 2.24 2.10 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 29 V 8.93 4.52 2.24 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 1.20 0.00 0.00 1.05 0.00 0.00 30 K 9.13 4.83 0.00 1.96 1.87 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.76 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.43 1.47 7.81 31 V 9.10 4.85 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 0.38 0.00 0.00 1.11 0.00 0.00 32 W 9.23 5.59 0.00 3.33 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 33 G 7.57 3.84 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 0.00 0.00 0.00 34 S 7.77 5.09 0.00 3.85 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.77 5.01 1.76 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.77 0.85 0.00 0.00 36 K 8.59 5.48 0.00 1.78 1.85 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.17 7.81 37 G 9.07 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.47 4.30 0.00 1.64 1.38 0.77 0.42 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 39 T 8.00 4.60 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 1.24 0.00 0.00 40 E 8.63 3.95 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 41 G 8.81 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 42 L 8.11 4.72 0.00 1.52 1.61 0.93 0.96 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 43 H 9.19 4.82 0.00 3.02 3.31 0.00 5.63 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 44 G 8.87 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 0.00 0.00 0.00 45 F 9.68 5.73 0.00 2.98 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 46 H 8.80 5.17 0.00 3.16 2.90 0.00 5.62 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.74 4.59 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 0.90 0.00 0.00 0.86 0.00 0.00 48 H 9.35 4.99 0.00 3.10 3.62 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 9.15 3.77 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 1.47 1.84 0.00 50 F 8.31 4.91 0.00 3.05 2.91 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 51 G 8.54 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 0.00 0.00 0.00 52 D 8.16 4.76 0.00 2.65 2.77 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 53 N 8.40 5.26 0.00 2.78 2.74 0.00 0.00 6.83 7.05 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 54 T 8.49 3.79 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 1.28 0.00 0.00 55 A 8.07 4.51 1.27 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 0.00 0.00 56 G 7.77 3.84 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 0.00 0.00 0.00 57 C 8.73 4.34 0.00 2.98 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 58 T 7.94 3.79 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 59 S 8.08 4.24 0.00 4.17 4.14 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 0.00 0.00 0.00 60 A 7.64 4.51 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.71 4.47 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 0.00 0.00 0.00 62 P 0.00 4.70 0.00 2.09 2.25 0.00 3.90 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 63 H 8.50 4.34 0.00 2.68 3.10 0.00 5.72 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 64 F 9.02 4.24 0.00 2.99 2.96 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 65 N 7.98 4.74 0.00 2.40 2.47 0.00 0.00 7.26 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.19 0.00 2.09 2.00 0.00 2.89 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.25 0.00 67 L 7.66 4.35 0.00 1.65 1.65 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.12 3.85 0.00 3.85 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 69 R 7.22 4.53 0.00 1.48 2.12 0.00 3.11 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 70 K 8.59 4.40 0.00 1.69 1.73 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.37 7.81 71 H 8.00 4.52 0.00 2.99 3.13 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.11 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 0.00 0.00 0.00 73 G 8.50 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 74 P 0.00 4.36 0.00 2.23 2.37 0.00 3.77 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 2.02 2.05 0.00 75 K 7.82 4.43 0.00 1.76 1.87 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.45 7.81 76 D 7.72 4.67 0.00 2.78 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 77 E 8.68 3.91 0.00 1.90 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 2.28 2.34 0.00 78 E 7.81 4.32 0.00 1.92 1.84 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 2.21 2.30 0.00 79 R 7.57 4.68 0.00 1.92 1.74 0.00 2.71 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 80 H 8.27 4.49 0.00 3.39 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.18 3.51 1.62 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 0.86 0.00 0.00 0.48 0.00 0.00 82 G 8.44 3.84 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 0.00 0.00 0.00 83 D 8.05 5.01 0.00 2.64 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 84 L 8.45 4.43 0.00 1.64 1.85 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.53 4.08 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 0.00 0.00 0.00 86 N 8.68 5.66 0.00 2.61 2.72 0.00 0.00 6.53 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 87 V 8.58 4.48 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 0.06 0.00 0.00 0.72 0.00 0.00 88 T 8.49 5.04 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 89 A 8.91 4.90 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 90 D 8.31 4.78 0.00 2.93 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 91 K 8.50 4.45 0.00 1.76 1.94 0.00 1.78 0.00 0.00 0.61 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.44 7.81 92 D 8.62 4.71 0.00 2.83 2.65 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 93 G 8.51 4.22 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 0.00 94 V 7.46 4.84 2.35 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 0.92 0.00 0.00 0.91 0.00 0.00 95 A 9.41 4.72 1.13 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 0.00 0.00 96 D 8.56 4.97 0.00 2.56 2.65 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 97 V 8.09 3.51 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 0.84 0.00 0.00 0.58 0.00 0.00 98 S 8.36 5.05 0.00 3.90 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 99 I 9.06 4.79 2.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.70 1.03 0.00 0.00 100 E 8.76 5.11 0.00 1.96 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 2.23 2.41 0.00 101 D 9.51 5.12 0.00 2.86 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 0.00 102 S 8.88 4.75 0.00 3.90 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 0.00 103 V 7.89 3.99 2.22 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 0.79 0.00 0.00 0.95 0.00 0.00 104 I 7.69 4.22 1.90 0.00 0.00 1.00 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 0.79 1.01 0.00 0.00 105 S 8.31 4.62 0.00 3.83 3.73 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 0.00 106 L 8.57 4.54 0.00 1.79 1.62 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.73 4.53 0.00 3.83 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.58 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.80 4.38 0.00 2.66 2.75 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 0.00 0.00 0.00 110 H 8.23 4.93 0.00 3.29 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 7.89 4.42 0.00 3.87 3.70 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 0.00 112 I 8.48 3.59 1.52 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.39 0.82 0.00 0.00 113 I 7.03 3.58 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.86 0.83 0.00 0.00 114 G 9.44 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 0.00 115 R 7.37 4.77 0.00 1.52 1.82 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.21 0.00 116 T 7.95 4.93 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 1.18 0.00 0.00 117 L 8.73 4.65 0.00 1.81 1.55 0.41 1.15 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 0.00 118 V 8.47 5.03 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 0.70 0.00 0.00 0.76 0.00 0.00 119 V 8.74 5.00 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 0.69 0.00 0.00 0.94 0.00 0.00 120 H 9.22 5.06 0.00 3.26 3.51 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.29 4.16 0.00 2.09 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 0.00 2.36 2.33 0.00 122 K 8.58 4.60 0.00 1.75 1.71 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.41 7.81 123 A 8.26 4.42 1.25 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 0.00 0.00 124 D 9.10 4.78 0.00 2.75 2.79 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 0.00 125 D 9.40 4.48 0.00 2.91 2.91 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 0.00 126 L 9.66 3.56 0.00 1.87 1.81 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.71 3.97 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 0.00 0.00 0.00 128 K 7.75 4.53 0.00 1.88 1.81 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.35 7.81 129 G 7.59 3.70 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 0.00 0.00 0.00 130 G 8.88 3.97 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 0.00 0.00 0.00 131 N 7.42 5.10 0.00 2.76 2.77 0.00 0.00 6.12 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 0.00 132 E 8.87 4.07 0.00 2.01 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 2.41 2.32 0.00 133 E 8.29 3.95 0.00 1.97 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 2.40 2.31 0.00 134 S 8.88 4.16 0.00 4.12 4.03 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 0.00 135 T 7.49 4.41 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 0.00 136 E 7.90 4.42 0.00 1.87 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 2.11 2.23 0.00 137 T 8.13 4.16 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 138 G 8.29 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 0.00 139 N 8.15 4.33 0.00 3.00 2.91 0.00 0.00 6.89 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 0.00 140 A 7.00 4.36 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 0.00 141 G 7.33 3.58 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 0.00 0.00 0.00 142 S 8.03 4.48 0.00 3.98 4.05 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 0.00 143 R 8.38 4.40 0.00 1.70 1.88 0.00 3.22 0.00 0.00 3.25 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 144 L 8.58 4.27 0.00 1.68 1.72 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.74 4.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 C 9.20 5.41 0.00 2.99 3.11 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 0.00 147 G 8.52 4.58 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 0.00 0.00 0.00 148 V 8.43 4.25 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 0.78 0.00 0.00 1.01 0.00 0.00 149 I 8.97 4.30 1.84 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 0.63 0.00 0.00 150 G 8.96 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.25 4.52 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 1.25 0.54 0.96 0.00 0.00 152 A 8.48 4.52 1.23 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 0.00 153 Q 8.45 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00