NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1628 8.1727 122.0490 56.2822 34.1117 174.0090 2 V 4.5810 8.1585 127.0917 60.7334 32.3233 174.5298 3 F 4.4203 9.3145 127.9585 57.4076 40.2450 174.6642 4 E 4.2139 9.1188 122.9911 55.5812 30.8773 176.7025 5 R 3.3486 8.9679 125.5167 60.4728 30.0232 179.5245 6 C 4.3555 8.3620 115.2340 59.5885 37.1049 175.6951 7 E 3.9026 8.3576 121.3584 59.1962 29.1851 178.6527 8 L 3.5687 8.0246 120.1672 57.7886 42.0886 178.6112 9 A 3.9404 7.8690 120.7452 55.4593 18.4411 179.9362 10 R 3.9170 8.0557 116.4078 59.4875 30.1503 179.5271 11 T 3.8622 7.7904 115.7026 66.6605 68.4662 176.8234 12 L 3.8905 8.1194 121.2826 57.4652 41.5444 179.5195 13 K 3.9227 7.9944 119.7193 59.4942 31.9384 178.9466 14 R 3.9665 7.7227 117.7288 58.8897 30.0242 177.4710 15 L 4.3785 7.3842 116.1004 54.0250 41.7202 176.8354 16 G 3.8583 7.7436 106.8149 46.9750 0.0000 175.2465 17 M 3.8609 7.8028 121.4225 56.5368 32.3390 175.8215 18 D 4.3994 7.9962 117.8766 56.0666 41.0908 175.7312 19 G 3.9627 9.4073 115.8122 45.3876 0.0000 171.3236 20 Y 4.2130 8.2392 122.0128 58.5335 38.9343 176.1363 21 R 3.6521 9.0062 126.2479 57.2696 27.7936 177.1868 22 G 3.8279 8.0759 103.3145 45.7290 0.0000 174.0218 23 I 4.1289 7.5919 121.9116 59.0908 38.2802 175.9249 24 S 4.6402 8.3342 120.2190 57.6551 64.0538 174.8537 25 L 4.2253 8.8988 123.3749 58.6213 41.7308 179.3643 26 A 4.1666 8.1556 120.0865 55.2883 18.3245 179.2429 27 N 4.4453 8.1419 114.9669 56.2413 38.5825 177.7202 28 W 4.2227 8.0295 119.9698 59.9492 29.1637 178.3529 29 M 4.1853 8.4414 118.7874 58.5440 31.5521 177.9261 30 C 3.1635 8.0749 118.6257 59.0854 44.5880 175.3437 31 L 3.9788 8.0932 121.6161 58.2980 41.7329 178.8263 32 A 4.1624 8.3226 120.7409 54.8989 18.2541 179.4533 33 K 2.8201 8.1103 118.1379 59.3524 32.0585 179.1030 34 W 4.3877 7.6242 116.8390 59.0704 29.0798 178.3274 35 E 4.3513 8.2265 118.5895 58.5573 29.0762 177.6484 36 S 4.5207 7.8303 109.3708 56.5559 64.7051 174.4551 37 G 3.2556 8.2386 108.9315 46.9826 0.0000 173.4342 38 Y 3.6744 7.6791 113.4981 58.6146 35.0788 168.4787 39 N 5.3017 7.6857 119.0439 51.9748 39.8922 175.6980 40 T 4.0264 8.8115 116.9291 64.0155 69.1853 176.1139 41 R 4.3187 8.1055 119.4522 56.3351 30.8574 176.4700 42 A 4.2056 7.6026 121.4957 52.8051 19.3675 176.8772 43 T 5.0024 8.3623 117.7228 61.8878 72.9703 172.9885 44 N 4.8950 8.9140 123.8818 51.9447 41.8091 172.3455 45 Y 4.6375 8.6911 128.0554 57.3242 40.7109 173.9210 46 N 4.5245 8.6675 125.0510 51.2776 38.3905 175.4631 47 A 3.6579 8.2554 127.5448 54.6573 18.9429 179.2607 48 G 3.7203 8.0320 104.3868 48.0381 0.0000 173.8434 49 D 4.6943 7.4500 114.9812 52.1235 40.2437 176.0425 50 R 3.9857 8.1500 116.3736 56.9944 28.2973 175.8625 51 S 4.9300 7.7849 113.2195 57.2793 66.0953 173.0116 52 T 5.1000 8.8271 116.2109 61.9709 72.7017 172.7275 53 D 5.4998 8.9972 125.2369 53.2127 43.1742 175.0989 54 Y 4.9511 9.0917 120.9163 57.4168 41.7141 177.4213 55 G 4.1377 8.9744 111.6165 45.2058 0.0000 173.5551 56 I 3.9301 8.2309 116.8136 62.8964 37.8765 177.2506 57 F 4.6887 7.9585 115.5722 56.4154 39.9897 175.1443 58 Q 3.6526 7.8816 119.2155 57.1268 26.4365 174.0345 59 I 4.4269 8.2033 119.1607 61.0303 39.2762 177.0774 60 N 5.4029 9.2625 126.1596 53.6670 39.8930 175.4802 61 S 4.8642 8.9716 119.5582 59.5715 63.4373 175.1580 62 R 3.8697 8.7849 122.4386 58.5481 30.4426 177.5153 63 Y 4.1674 7.7684 114.8427 57.6923 40.4377 176.9138 64 W 4.9268 8.1352 118.6283 57.8038 31.2442 174.0108 65 C 5.6680 8.2759 112.3817 53.5379 46.5883 171.9902 66 N 5.0948 8.8630 118.9789 52.0595 40.0617 174.7496 67 D 4.8222 8.8266 123.7964 52.2905 40.5303 177.3196 68 G 4.0388 8.4862 108.3257 45.8793 0.0000 174.6460 69 K 4.4557 8.0022 116.3602 56.6346 32.9434 175.6852 70 T 4.5052 7.7384 116.6289 61.3396 69.6032 172.7423 71 P 4.2372 0.0000 0.0000 63.6362 31.9040 176.4508 72 G 3.7599 8.8261 109.2036 46.1353 0.0000 173.5025 73 A 4.1370 7.9070 121.8958 52.1049 18.9135 178.3398 74 V 3.8565 8.2737 121.6436 62.5673 33.6567 175.5105 75 N 4.1320 8.0079 116.1974 54.5510 36.6799 174.7196 76 A 4.1427 8.2895 121.6772 55.2815 19.1256 178.4632 77 C 4.5924 8.6211 111.6655 57.4584 41.0494 173.0502 78 H 3.9884 7.9710 116.1089 56.5037 26.4497 174.4644 79 L 4.8091 8.0580 117.1269 52.9043 46.4046 176.6090 80 S 4.6469 8.4066 115.9573 58.0383 63.2980 175.9926 81 C 4.1510 8.7015 124.3398 59.6094 38.3293 176.3799 82 S 3.9052 7.7724 114.6157 61.2109 61.6601 175.9198 83 A 4.1288 7.7898 122.5421 54.3926 17.8169 177.9413 84 L 4.4379 7.7830 116.3309 55.1410 41.8042 177.6319 85 L 5.2407 7.7245 116.8065 53.7229 42.2577 176.6739 86 Q 4.3973 7.7825 117.7327 55.2954 29.6083 175.9396 87 D 4.3929 8.5051 119.6387 56.9607 41.1558 176.5872 88 N 4.5972 8.0363 118.1448 53.0430 38.9976 174.5555 89 I 4.2426 8.4300 119.1668 61.0217 38.0035 176.9429 90 A 3.9386 8.3826 124.8263 56.0615 18.1836 180.1546 91 D 4.3099 8.0930 116.4319 57.3838 40.8659 178.7210 92 A 4.1022 7.9762 120.9326 55.1248 18.4227 179.7354 93 V 3.3708 8.1767 116.8516 65.9664 31.4597 178.1058 94 A 3.8320 7.9993 120.5750 55.2959 18.2166 178.8536 95 C 4.2304 8.4061 116.7990 59.6496 38.0462 175.5702 96 A 3.9312 8.2611 122.8154 55.0971 17.6065 179.7745 97 K 3.8167 7.6941 116.2994 59.4315 32.3512 179.2503 98 R 4.0694 7.6393 119.1124 59.2386 29.8706 178.6228 99 V 2.3344 7.4202 118.0214 65.6819 31.3355 177.8839 100 V 3.9222 7.5879 109.5449 62.5137 31.3721 177.8773 101 R 4.2619 7.6853 117.5310 56.9778 30.5850 176.4388 102 D 4.7184 7.3079 119.4591 52.7892 41.9582 175.4332 103 P 4.2023 0.0000 0.0000 66.1409 31.5509 178.1904 104 Q 4.0184 8.1780 116.3112 56.7854 30.0707 177.5336 105 G 3.6613 7.8767 107.0340 47.2131 0.0000 175.9265 106 I 3.8133 7.7169 121.3571 62.7373 38.0045 177.4870 107 R 4.2522 7.3111 117.2681 57.9535 30.0123 177.4714 108 A 3.9157 7.6059 120.8453 53.9890 18.7570 177.6216 109 W 4.7508 7.9803 117.1751 55.2744 30.1609 177.4171 110 V 3.7325 8.7712 123.5947 66.0786 30.8969 177.6429 111 A 4.0633 8.2947 120.0648 54.8509 18.1011 179.2586 112 W 3.9860 8.3605 126.6139 60.6397 30.5542 178.5021 113 R 3.7347 8.1560 116.7132 59.3136 29.6772 178.3287 114 N 4.3785 7.9562 115.2495 55.3766 38.7017 176.7917 115 R 4.0819 7.8217 116.5870 55.8565 31.6465 176.0158 116 C 4.5553 7.1742 114.5076 57.7459 42.8148 174.2429 117 Q 3.2263 6.6074 119.7373 57.3113 28.7155 175.5950 118 N 4.1905 8.6719 119.9391 54.0842 36.2326 173.7985 119 R 4.4942 7.2687 116.0070 54.0536 32.8470 175.7757 120 D 4.5485 8.4413 119.0532 54.2094 40.3379 175.7268 121 V 4.6038 8.1866 118.9720 61.4144 32.3269 178.5817 122 R 4.0875 8.0862 122.8734 59.1863 29.4970 178.7532 123 Q 4.0064 8.0763 116.3370 59.4093 28.3833 178.0052 124 Y 4.3368 7.7565 117.2210 59.7752 38.3799 176.5590 125 V 4.3494 7.7479 110.8224 60.4569 33.3375 175.2480 126 Q 4.0862 8.1342 121.7608 57.6753 28.9882 176.4148 127 G 3.9370 8.8888 112.3277 46.3857 0.0000 174.5261 128 C 4.4361 8.0880 115.9446 56.7243 40.6400 174.1112 129 G 3.8158 8.1962 107.1839 46.7396 0.0000 174.0239 130 V 4.0083 7.8448 117.9832 61.0839 32.0947 175.8555 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 K 8.17 4.16 0.00 1.83 1.63 0.00 1.28 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.86 1.13 7.81 2 V 8.16 4.58 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 0.95 0.00 0.00 3 F 9.31 4.42 0.00 2.85 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 E 9.12 4.21 0.00 2.03 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 5 R 8.97 3.35 0.00 1.94 1.91 0.00 3.46 0.00 0.00 3.45 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 6 C 8.36 4.36 0.00 3.14 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 7 E 8.36 3.90 0.00 2.08 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 0.00 2.55 2.38 0.00 8 L 8.02 3.57 0.00 1.38 1.40 -0.10 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.87 3.94 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 10 R 8.06 3.92 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 11 T 7.79 3.86 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 1.17 0.00 0.00 12 L 8.12 3.89 0.00 1.59 1.58 0.94 0.44 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 13 K 7.99 3.92 0.00 1.94 1.92 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.72 3.97 0.00 2.02 2.05 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.38 4.38 0.00 1.66 1.54 0.84 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.74 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 17 M 7.80 3.86 0.00 1.27 1.95 0.00 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.20 0.00 18 D 8.00 4.40 0.00 2.67 2.67 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 19 G 9.41 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 20 Y 8.24 4.21 0.00 3.34 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 21 R 9.01 3.65 0.00 1.93 1.86 0.00 3.21 0.00 0.00 2.96 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.42 0.00 22 G 8.08 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 23 I 7.59 4.13 1.86 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.59 -0.20 0.00 0.00 24 S 8.33 4.64 0.00 4.07 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 25 L 8.90 4.23 0.00 2.07 1.81 0.99 1.14 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 26 A 8.16 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.14 4.45 0.00 2.85 2.75 0.00 0.00 6.94 7.40 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 28 W 8.03 4.22 0.00 3.56 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 29 M 8.44 4.19 0.00 2.19 2.36 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 30 C 8.07 3.16 0.00 2.50 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 31 L 8.09 3.98 0.00 1.86 1.88 0.68 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.32 4.16 1.46 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 0.00 0.00 33 K 8.11 2.82 0.00 1.68 1.61 0.00 0.63 0.00 0.00 0.95 0.00 0.00 2.68 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.13 0.35 7.81 34 W 7.62 4.39 0.00 3.35 3.22 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 35 E 8.23 4.35 0.00 2.04 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 0.00 2.54 2.37 0.00 36 S 7.83 4.52 0.00 4.08 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.24 3.26 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 0.00 38 Y 7.68 3.67 0.00 3.23 3.02 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 39 N 7.69 5.30 0.00 2.83 2.81 0.00 0.00 7.01 6.88 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 40 T 8.81 4.03 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 1.43 0.00 0.00 41 R 8.11 4.32 0.00 2.03 2.04 0.00 3.19 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 42 A 7.60 4.21 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 43 T 8.36 5.00 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 0.97 0.00 0.00 44 N 8.91 4.89 0.00 2.83 2.73 0.00 0.00 6.56 6.90 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 45 Y 8.69 4.64 0.00 3.05 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 46 N 8.67 4.52 0.00 2.65 2.61 0.00 0.00 6.54 7.82 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 47 A 8.26 3.66 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 48 G 8.03 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 0.00 0.00 0.00 49 D 7.45 4.69 0.00 2.67 2.67 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 50 R 8.15 3.99 0.00 2.04 2.20 0.00 3.13 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 51 S 7.78 4.93 0.00 3.93 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 52 T 8.83 5.10 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 0.66 0.00 0.00 53 D 9.00 5.50 0.00 2.70 2.71 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 54 Y 9.09 4.95 0.00 3.00 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 55 G 8.97 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 0.00 0.00 0.00 56 I 8.23 3.93 1.69 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.85 0.06 0.00 0.00 57 F 7.96 4.69 0.00 3.20 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 58 Q 7.88 3.65 0.00 2.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.79 0.00 59 I 8.20 4.43 2.15 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.15 1.16 0.00 0.00 60 N 9.26 5.40 0.00 3.09 3.02 0.00 0.00 6.98 7.20 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 61 S 8.97 4.86 0.00 4.09 4.37 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 62 R 8.78 3.87 0.00 1.65 1.63 0.00 2.69 0.00 0.00 2.78 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 63 Y 7.77 4.17 0.00 1.75 1.66 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 64 W 8.14 4.93 0.00 3.57 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.28 5.67 0.00 3.09 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 66 N 8.86 5.09 0.00 2.84 2.69 0.00 0.00 7.07 8.04 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 67 D 8.83 4.82 0.00 2.83 2.66 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 68 G 8.49 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 0.00 0.00 0.00 69 K 8.00 4.46 0.00 1.87 1.90 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.45 7.81 70 T 7.74 4.51 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 1.17 0.00 0.00 71 P 0.00 4.24 0.00 2.01 1.96 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 72 G 8.83 3.76 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 0.00 0.00 0.00 73 A 7.91 4.14 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.27 3.86 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 0.71 0.00 0.00 0.91 0.00 0.00 75 N 8.01 4.13 0.00 2.94 2.69 0.00 0.00 7.10 8.71 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 76 A 8.29 4.14 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 77 C 8.62 4.59 0.00 3.35 3.26 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 78 H 7.97 3.99 0.00 3.30 3.39 0.00 5.80 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 79 L 8.06 4.81 0.00 1.72 1.50 0.96 0.83 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 80 S 8.41 4.65 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 81 C 8.70 4.15 0.00 2.25 1.44 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 82 S 7.77 3.91 0.00 3.84 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 83 A 7.79 4.13 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 84 L 7.78 4.44 0.00 1.94 1.82 1.06 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.72 5.24 0.00 1.79 1.71 1.11 1.16 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 86 Q 7.78 4.40 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 87 D 8.51 4.39 0.00 2.65 2.67 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 88 N 8.04 4.60 0.00 2.70 2.76 0.00 0.00 6.96 7.94 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 89 I 8.43 4.24 1.80 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.53 0.92 0.00 0.00 90 A 8.38 3.94 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 91 D 8.09 4.31 0.00 2.72 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 92 A 7.98 4.10 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 93 V 8.18 3.37 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 0.69 0.00 0.00 0.93 0.00 0.00 94 A 8.00 3.83 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 C 8.41 4.23 0.00 3.07 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.26 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.69 3.82 0.00 1.65 1.47 0.00 1.30 0.00 0.00 0.90 0.00 0.00 2.25 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.95 7.81 98 R 7.64 4.07 0.00 1.91 2.13 0.00 3.27 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.92 0.00 99 V 7.42 2.33 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 -0.27 0.00 0.00 -0.48 0.00 0.00 100 V 7.59 3.92 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 1.18 0.00 0.00 1.41 0.00 0.00 101 R 7.69 4.26 0.00 2.07 2.03 0.00 3.22 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.12 0.00 102 D 7.31 4.72 0.00 2.99 2.61 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 0.00 0.00 0.00 0.00 103 P 0.00 4.20 0.00 2.01 2.13 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 104 Q 8.18 4.02 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.81 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.88 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 0.00 106 I 7.72 3.81 1.08 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.79 -0.63 0.00 0.00 107 R 7.31 4.25 0.00 2.01 2.02 0.00 3.22 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.48 0.00 108 A 7.61 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 7.98 4.75 0.00 3.49 3.23 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 0.00 110 V 8.77 3.73 2.18 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.29 4.06 1.55 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 0.00 112 W 8.36 3.99 0.00 3.47 3.48 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 0.00 113 R 8.16 3.73 0.00 2.00 2.00 0.00 3.35 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 114 N 7.96 4.38 0.00 2.56 2.71 0.00 0.00 6.93 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 0.00 115 R 7.82 4.08 0.00 1.20 0.68 0.00 2.21 0.00 0.00 2.48 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.98 0.00 116 C 7.17 4.56 0.00 1.70 2.67 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 0.00 117 Q 6.61 3.23 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.67 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 118 N 8.67 4.19 0.00 2.80 2.82 0.00 0.00 6.88 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 0.00 119 R 7.27 4.49 0.00 1.81 1.82 0.00 3.18 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 120 D 8.44 4.55 0.00 2.65 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 0.00 121 V 8.19 4.60 2.36 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 0.96 0.00 0.00 1.05 0.00 0.00 122 R 8.09 4.09 0.00 1.92 2.01 0.00 3.16 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 123 Q 8.08 4.01 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.12 0.00 0.00 0.00 0.00 0.00 2.08 1.56 0.00 124 Y 7.76 4.34 0.00 3.19 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 0.00 125 V 7.75 4.35 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 0.95 0.00 0.00 1.03 0.00 0.00 126 Q 8.13 4.09 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.21 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 127 G 8.89 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.09 4.44 0.00 3.10 3.14 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 0.00 129 G 8.20 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 0.00 130 V 7.84 4.01 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 0.74 0.00 0.00 0.96 0.00 0.00