NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2892 8.1233 122.4639 51.8119 20.6162 175.1998 2 D 5.2577 8.2943 119.8035 52.1162 43.3785 174.6483 3 F 4.9362 10.1948 122.2260 55.6740 44.0743 173.2776 4 E 5.0572 8.8603 119.0065 54.6055 32.7349 175.6698 5 V 4.5416 8.4050 123.0365 61.5553 34.6055 173.9465 6 H 5.4026 9.4149 125.3190 54.7096 31.5655 173.8746 7 M 4.7721 8.7310 121.2718 53.6820 33.9812 175.0679 8 L 5.1657 8.3163 123.2589 52.8937 45.6940 177.6946 9 N 4.4633 9.6405 119.7970 55.8606 39.7599 175.8762 10 K 4.9808 7.8707 116.4148 54.9196 36.5686 175.6486 11 G 4.0641 9.2217 111.5913 44.4448 0.0000 172.3516 12 K 3.8866 8.3566 119.3358 59.7595 32.1067 178.5192 13 D 4.5745 7.9682 115.1630 54.4387 41.6502 175.3438 14 G 3.8618 7.9092 105.0256 44.0934 0.0000 173.2455 15 A 4.6912 8.4501 123.5506 52.7044 19.9142 177.1064 16 M 3.2196 9.0123 119.1459 56.1779 29.5768 176.2764 17 V 4.6417 8.3953 113.7533 59.3735 36.8113 174.5108 18 F 5.1807 8.8929 120.2754 56.0909 41.1762 175.5109 19 E 4.8157 9.4418 122.2109 53.9897 32.9078 173.6239 20 P 4.8785 0.0000 0.0000 62.6510 32.2474 176.3902 21 A 4.5650 8.7831 122.1364 53.5658 19.9437 177.2103 22 S 5.1154 7.9049 109.1870 56.5567 66.2114 173.5703 23 L 4.5543 8.7149 124.4175 53.3671 45.7817 174.1465 24 K 4.8013 8.4598 127.1155 54.9681 33.7785 175.3816 25 V 4.3143 8.9434 119.7441 59.4438 36.1007 174.2718 26 A 4.9334 9.2964 123.3439 49.4738 21.7878 175.0462 27 P 4.3502 0.0000 0.0000 64.4783 31.6413 177.3922 28 G 4.0302 9.0552 112.4754 45.1129 0.0000 173.3903 29 D 4.8649 8.2701 119.7211 54.6374 42.5315 175.2635 30 T 5.1394 8.8457 117.0311 61.8803 71.5688 173.5325 31 V 4.8985 9.2578 125.7261 61.3728 35.0028 174.1256 32 T 4.8413 8.6292 124.3713 61.8811 70.8965 173.3207 33 F 5.0104 9.8444 127.5551 56.6274 40.8254 174.9383 34 I 4.7439 9.1619 125.3228 58.8021 39.8874 173.3720 35 P 4.7207 0.0000 0.0000 62.7250 30.6090 176.5279 36 T 4.1416 8.7527 123.2304 65.8797 68.8711 175.2907 37 D 4.9713 7.9481 118.7329 52.2002 43.2845 176.1815 38 K 4.3185 8.2341 120.3934 57.1730 32.7762 177.8203 39 G 3.8974 9.7919 109.9725 45.5042 0.0000 173.1232 40 H 4.9935 7.7236 116.2954 54.1477 31.5587 172.6311 41 N 5.3361 8.0509 116.8918 52.1753 40.8231 172.9285 42 V 4.8841 8.4808 116.9168 60.4610 35.0060 174.1790 43 E 5.0012 8.9792 123.7601 54.5875 33.4266 174.3169 44 T 4.1377 7.7678 116.1243 61.5186 70.0005 174.0274 45 I 3.9045 8.7496 125.7564 60.1729 38.6438 175.8206 46 K 3.8722 8.5271 126.1324 58.3078 32.2090 177.3693 47 G 3.9794 8.9775 111.1123 45.9707 0.0000 173.1629 48 M 4.7853 8.0379 119.8425 54.7501 32.9431 175.2319 49 I 4.4425 7.3237 110.0204 58.0582 41.0520 173.2739 50 P 4.3554 0.0000 0.0000 61.9511 31.9936 175.5018 51 D 4.5503 8.2243 120.2386 55.8378 41.1612 176.7228 52 G 4.0109 8.9959 111.7037 45.3674 0.0000 173.8069 53 A 4.3962 7.3602 121.0679 51.9230 19.1382 176.4081 54 E 4.6023 8.5646 119.3625 54.5234 31.3046 176.4751 55 A 4.2851 8.3470 125.5675 52.1590 19.4917 176.3210 56 F 5.1523 7.8653 113.4009 55.6148 42.0877 173.9332 57 K 4.8355 8.4524 121.0397 55.5560 34.4034 175.5852 58 S 4.1332 8.4488 123.2548 57.0941 64.5715 174.2244 59 K 4.2709 9.0730 120.4363 55.4421 32.7468 177.1310 60 I 3.8921 7.9725 122.4295 63.1665 37.3956 176.5078 61 N 4.5142 8.7418 120.8088 53.2804 37.0143 174.0153 62 E 4.4019 7.6369 119.2228 54.9372 30.7015 175.2829 63 N 4.7988 8.7474 123.1880 53.4805 39.3535 173.6882 64 Y 4.5958 9.5864 126.8238 55.7870 40.8160 174.0307 65 K 4.9491 8.0672 128.6797 54.7845 33.8359 175.7088 66 V 4.0396 8.9786 126.8614 59.9808 34.6732 174.4682 67 T 4.7244 8.0290 120.3449 62.0164 69.9636 174.0693 68 F 4.1688 9.1714 127.2215 57.2781 39.6927 176.1109 69 T 4.1271 8.8563 114.1634 63.4515 69.9042 174.8741 70 A 4.2641 7.9610 125.8540 50.1268 19.1270 175.5665 71 P 4.6220 0.0000 0.0000 62.7883 32.5128 176.3152 72 G 3.7507 7.4943 105.3980 44.1561 0.0000 171.8593 73 V 4.7528 7.8773 119.8744 61.4575 33.4142 175.4807 74 Y 4.7666 8.9749 125.3704 56.2146 40.5218 174.7780 75 G 4.3307 9.3189 112.8784 45.0926 0.0000 172.9332 76 V 5.0384 8.3695 118.1181 59.3660 35.5668 174.7748 77 K 5.1418 8.9191 121.7723 55.7031 36.8471 174.1246 78 C 5.0142 8.9135 120.9965 57.6683 32.5945 173.8191 79 T 3.8765 9.4187 125.0423 66.5065 68.4395 173.7909 80 P 4.3160 0.0000 0.0000 65.5875 31.6336 176.7489 81 H 4.9671 7.9605 113.8169 55.4992 29.2748 175.6943 82 Y 4.3661 8.1529 124.4289 60.8285 38.6650 178.8859 83 G 3.4503 8.1309 106.9370 48.4266 0.0000 173.7727 84 M 4.2109 8.0771 117.0465 55.3604 32.2706 176.7006 85 G 3.8024 8.3507 107.4795 45.8637 0.0000 174.0316 86 M 4.7224 8.1768 121.0881 54.1715 31.8626 175.3482 87 V 5.1081 8.4205 117.1825 59.9261 36.5356 174.1096 88 G 4.1241 8.5811 108.8444 45.1472 0.0000 171.5775 89 V 4.9246 9.2378 119.5954 60.8467 35.2254 174.2446 90 V 4.5463 8.5947 127.3114 61.1937 33.9175 173.7099 91 Q 4.6826 9.0408 130.6947 54.7495 30.9274 174.3400 92 V 4.2972 9.0251 127.7420 62.6669 32.9368 176.2474 93 G 4.0297 9.1278 116.7452 44.8393 0.0000 171.2760 94 D 4.4918 8.3372 117.5059 54.0947 42.3164 176.4299 95 A 3.7183 8.5546 122.3678 52.3113 15.7480 175.9231 96 P 4.2312 0.0000 0.0000 62.4154 32.1423 178.3396 97 A 3.9768 8.6698 126.6189 54.3950 18.8400 177.3778 98 N 4.7532 7.9441 111.8605 52.8050 38.2390 176.4018 99 L 3.8866 7.7138 122.9929 58.9928 41.7841 179.0447 100 E 4.0697 8.0724 116.3673 59.2475 29.9232 178.7080 101 A 4.1226 7.8930 120.4951 55.1187 18.4377 179.9004 102 V 3.7228 7.8534 110.8909 64.1492 31.3495 178.9150 103 K 4.1458 7.6107 116.8097 58.7929 31.9421 178.7437 104 G 3.7914 7.5104 102.7416 44.5592 0.0000 174.1265 105 A 4.1221 6.9900 123.9951 52.1029 18.9995 177.0320 106 K 4.3790 8.4189 121.1024 55.6463 33.1309 176.2559 107 N 5.1752 8.3115 119.8747 49.5523 42.9089 172.8708 108 P 4.2405 0.0000 0.0000 62.7269 33.0195 176.8946 109 K 3.7798 8.6178 120.8733 60.2096 31.8846 179.0966 110 K 4.1564 7.9801 117.5391 59.1807 31.9754 179.2051 111 A 3.9933 7.7787 120.7938 55.1322 18.4087 179.1865 112 Q 3.9092 8.3951 118.5349 59.3744 28.9602 178.3130 113 E 3.9658 8.2826 119.5245 59.7243 29.4782 179.7066 114 R 4.0146 7.8578 117.8522 59.0782 30.0679 179.0975 115 L 4.0227 8.1798 119.0191 57.7995 41.5809 179.2676 116 D 4.3212 8.3874 118.8377 57.0607 40.7136 178.6231 117 A 3.9381 7.8394 121.2294 55.2102 17.9656 179.5439 118 A 3.9680 8.1985 119.4022 55.3223 18.5500 179.8862 119 L 3.7625 8.2968 117.5575 57.8074 41.6470 179.5677 120 A 4.1750 8.0678 120.6006 55.1230 18.1422 179.4576 121 A 4.0335 7.8721 117.7975 54.4377 18.5133 178.9046 122 L 4.2824 7.3244 115.6801 54.9593 41.9689 177.5298 123 G 3.8629 8.0856 107.1525 45.9217 0.0000 173.4748 124 N 4.5347 7.7982 122.0595 52.9867 38.7507 174.8866 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 8.12 4.29 1.14 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 2 D 8.29 5.26 0.00 2.49 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 3 F 10.19 4.94 0.00 2.87 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 4 E 8.86 5.06 0.00 1.83 1.78 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 2.14 2.24 0.00 5 V 8.41 4.54 1.78 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 1.42 0.00 0.00 0.82 0.00 0.00 6 H 9.41 5.40 0.00 3.14 3.22 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 8.73 4.77 0.00 1.62 1.87 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 1.62 2.01 0.00 8 L 8.32 5.17 0.00 1.52 1.48 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 9 N 9.64 4.46 0.00 2.70 2.86 0.00 0.00 6.88 7.25 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 10 K 7.87 4.98 0.00 1.68 1.65 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.42 7.81 11 G 9.22 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.36 3.89 0.00 1.72 1.88 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.43 7.81 13 D 7.97 4.57 0.00 2.74 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 14 G 7.91 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 15 A 8.45 4.69 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 16 M 9.01 3.22 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 17 V 8.40 4.64 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 0.86 0.00 0.00 0.98 0.00 0.00 18 F 8.89 5.18 0.00 2.95 3.06 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 19 E 9.44 4.82 0.00 1.89 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 2.26 2.29 0.00 20 P 0.00 4.88 0.00 2.28 2.08 0.00 3.83 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 21 A 8.78 4.57 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 22 S 7.90 5.12 0.00 3.80 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 23 L 8.71 4.55 0.00 1.64 1.30 0.65 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.46 4.80 0.00 1.71 1.59 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.69 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.37 7.81 25 V 8.94 4.31 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 -0.12 0.00 0.00 0.73 0.00 0.00 26 A 9.30 4.93 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 27 P 0.00 4.35 0.00 2.09 2.08 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 28 G 9.06 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 0.00 0.00 0.00 29 D 8.27 4.86 0.00 2.84 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 30 T 8.85 5.14 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 1.19 0.00 0.00 31 V 9.26 4.90 2.29 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 0.31 0.00 0.00 0.98 0.00 0.00 32 T 8.63 4.84 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 33 F 9.84 5.01 0.00 3.24 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 34 I 9.16 4.74 1.76 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 1.41 1.01 0.97 0.00 0.00 35 P 0.00 4.72 0.00 2.00 2.12 0.00 3.75 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 36 T 8.75 4.14 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 1.23 0.00 0.00 37 D 7.95 4.97 0.00 2.75 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 38 K 8.23 4.32 0.00 1.72 1.72 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 39 G 9.79 3.90 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 0.00 0.00 0.00 40 H 7.72 4.99 0.00 3.15 3.09 0.00 5.61 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.05 5.34 0.00 2.75 2.88 0.00 0.00 5.42 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 42 V 8.48 4.88 2.04 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 0.59 0.00 0.00 0.35 0.00 0.00 43 E 8.98 5.00 0.00 1.88 1.57 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 1.98 2.24 0.00 44 T 7.77 4.14 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 0.23 0.00 0.00 45 I 8.75 3.90 1.77 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 0.84 0.34 0.90 0.00 0.00 46 K 8.53 3.87 0.00 1.71 1.75 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.40 7.81 47 G 8.98 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 48 M 8.04 4.79 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 49 I 7.32 4.44 1.71 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 1.33 0.57 0.88 0.00 0.00 50 P 0.00 4.36 0.00 2.08 1.93 0.00 2.67 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 51 D 8.22 4.55 0.00 2.65 2.60 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 52 G 9.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.36 4.40 1.45 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 0.00 0.00 0.00 54 E 8.56 4.60 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 55 A 8.35 4.29 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 56 F 7.87 5.15 0.00 3.07 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 57 K 8.45 4.84 0.00 1.66 1.65 0.00 1.97 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.35 7.81 58 S 8.45 4.13 0.00 3.58 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 59 K 9.07 4.27 0.00 1.88 1.76 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.57 7.81 60 I 7.97 3.89 1.86 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 1.39 0.71 0.86 0.00 0.00 61 N 8.74 4.51 0.00 2.94 3.04 0.00 0.00 6.91 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 62 E 7.64 4.40 0.00 2.00 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 2.42 2.35 0.00 63 N 8.75 4.80 0.00 2.70 2.81 0.00 0.00 6.79 7.46 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 64 Y 9.59 4.60 0.00 3.08 3.07 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 65 K 8.07 4.95 0.00 1.66 1.45 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.17 1.31 7.81 66 V 8.98 4.04 1.08 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 0.55 0.00 0.00 -0.36 0.00 0.00 67 T 8.03 4.72 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 68 F 9.17 4.17 0.00 2.93 2.86 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 69 T 8.86 4.13 4.30 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 1.22 0.00 0.00 70 A 7.96 4.26 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 71 P 0.00 4.62 0.00 2.23 2.12 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 72 G 7.49 3.75 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 0.00 0.00 0.00 73 V 7.88 4.75 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 0.82 0.00 0.00 0.91 0.00 0.00 74 Y 8.97 4.77 0.00 2.95 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 75 G 9.32 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 0.00 0.00 0.00 0.00 76 V 8.37 5.04 1.74 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 0.74 0.00 0.00 0.55 0.00 0.00 77 K 8.92 5.14 0.00 1.65 1.63 0.00 0.77 0.00 0.00 0.61 0.00 0.00 2.39 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.99 1.14 7.81 78 C 8.91 5.01 0.00 3.12 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 79 T 9.42 3.88 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 1.18 0.00 0.00 80 P 0.00 4.32 0.00 1.88 2.09 0.00 3.72 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 1.81 1.90 0.00 81 H 7.96 4.97 0.00 3.30 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 8.15 4.37 0.00 3.08 2.99 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 83 G 8.13 3.45 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 0.00 0.00 0.00 0.00 84 M 8.08 4.21 0.00 2.04 2.27 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.55 0.00 85 G 8.35 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 86 M 8.18 4.72 0.00 2.37 2.15 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.34 0.00 87 V 8.42 5.11 2.19 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 0.98 0.00 0.00 1.08 0.00 0.00 88 G 8.58 4.12 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 0.00 0.00 0.00 89 V 9.24 4.92 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 0.91 0.00 0.00 0.92 0.00 0.00 90 V 8.59 4.55 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.92 0.00 0.00 91 Q 9.04 4.68 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 92 V 9.03 4.30 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 1.02 0.00 0.00 0.64 0.00 0.00 93 G 9.13 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 0.00 0.00 0.00 94 D 8.34 4.49 0.00 2.68 2.60 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 95 A 8.55 3.72 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 96 P 0.00 4.23 0.00 2.21 2.21 0.00 3.69 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 97 A 8.67 3.98 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 98 N 7.94 4.75 0.00 2.85 2.97 0.00 0.00 5.91 6.67 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 99 L 7.71 3.89 0.00 1.80 1.73 0.91 0.98 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 0.00 100 E 8.07 4.07 0.00 1.94 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 2.30 2.42 0.00 101 A 7.89 4.12 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 0.00 102 V 7.85 3.72 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 1.06 0.00 0.00 0.93 0.00 0.00 103 K 7.61 4.15 0.00 1.99 1.86 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.44 7.81 104 G 7.51 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 0.00 105 A 6.99 4.12 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 0.00 106 K 8.42 4.38 0.00 1.77 1.76 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.40 7.81 107 N 8.31 5.18 0.00 2.65 2.65 0.00 0.00 7.10 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.24 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.30 0.00 109 K 8.62 3.78 0.00 1.85 1.85 0.00 1.59 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.50 1.69 7.81 110 K 7.98 4.16 0.00 1.95 1.83 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.48 7.81 111 A 7.78 3.99 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 0.00 112 Q 8.40 3.91 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 113 E 8.28 3.97 0.00 2.20 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 2.33 2.62 0.00 114 R 7.86 4.01 0.00 1.85 2.02 0.00 3.28 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 115 L 8.18 4.02 0.00 1.84 1.73 0.99 0.92 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 0.00 116 D 8.39 4.32 0.00 2.69 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 0.00 117 A 7.84 3.94 1.36 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 0.00 0.00 118 A 8.20 3.97 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 0.00 119 L 8.30 3.76 0.00 1.69 1.72 0.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.07 4.17 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 0.00 121 A 7.87 4.03 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 122 L 7.32 4.28 0.00 1.73 1.70 0.89 0.87 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 0.00 123 G 8.09 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 0.00 124 N 7.80 4.53 0.00 2.93 2.70 0.00 0.00 6.70 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