NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3075 8.3049 118.1942 53.4811 33.3094 176.3786 2 L 3.3491 7.6403 119.3618 55.2589 40.8382 170.0682 3 T 4.2055 8.0899 112.4962 62.8273 75.1133 173.4613 4 D 4.7602 7.3513 127.9365 50.0746 40.6167 174.0407 5 P 4.3655 0.0000 0.0000 65.3380 31.3474 177.7601 6 I 3.6519 7.3267 118.3046 63.4187 35.9088 177.5314 7 A 3.9373 10.6000 121.4398 56.1899 18.7999 179.6182 8 D 4.5034 8.6128 116.6826 57.9805 41.4475 178.4080 9 M 4.0669 8.5149 119.4569 58.1688 32.3505 177.8193 10 L 4.0037 7.9260 118.9155 58.1353 41.6819 179.9952 11 T 3.8510 9.2829 115.9579 66.4759 68.3500 177.0340 12 R 3.8505 7.6461 119.3649 59.4288 30.2848 178.8880 13 I 3.6020 8.2414 119.8430 64.7577 36.9193 178.3876 14 R 3.8363 7.6289 117.8555 59.0071 29.5952 178.0537 15 N 4.4465 7.8913 115.9747 56.1457 38.9242 177.1670 16 A 4.0325 8.7270 123.6201 55.4936 18.7889 178.1394 17 T 4.7354 8.3769 114.3056 59.9675 68.8590 177.4449 18 R 3.3450 8.9010 113.3912 57.8429 30.1850 177.2310 19 V 3.3321 7.1685 109.7169 62.3315 32.6769 175.3183 20 Y 3.1513 7.4410 116.3942 58.0451 34.2195 168.4253 21 K 4.4478 8.2582 121.4228 54.2967 35.3168 175.7062 22 E 3.8461 8.8319 120.9551 59.2832 28.8643 177.2413 23 S 4.9507 8.4527 109.1298 57.2854 67.8188 173.8960 24 T 4.5733 8.2921 114.9878 60.9023 70.7752 172.9583 25 D 5.8334 8.4795 121.2917 53.4551 42.8253 175.8696 26 V 4.0325 8.1777 123.0217 60.6045 33.2139 174.1045 27 P 4.5723 0.0000 0.0000 62.1545 31.9078 176.1066 28 A 4.1588 8.3060 125.5662 51.6463 19.6256 176.6395 29 S 5.3727 8.7633 122.9812 57.5279 64.0635 176.1991 30 R 3.6316 7.7516 127.3754 60.0485 29.1003 177.2540 31 F 3.8742 8.3253 119.7548 61.4643 39.5572 177.9584 32 K 3.9061 8.2245 117.9775 59.5342 31.8278 178.5156 33 E 3.4986 8.2466 118.7959 59.8863 29.5506 179.4952 34 E 3.7747 7.8437 117.5607 59.6852 29.3056 179.5714 35 I 3.5031 7.0782 118.3964 64.6495 37.0061 177.9772 36 L 3.7091 7.8906 118.4723 59.0451 41.4118 179.6579 37 R 3.5239 8.8842 114.9235 59.7132 29.7553 178.1916 38 I 3.7550 7.9160 118.3955 65.4021 37.3914 177.3515 39 L 3.8632 9.6830 118.6533 59.4215 41.6724 178.9885 40 A 4.1650 9.5573 120.5535 55.3529 18.6568 179.5226 41 R 3.9511 8.4779 115.8754 58.5903 30.1635 176.9939 42 E 4.6715 7.6394 116.0082 56.3666 30.8086 176.1075 43 G 3.7905 8.0261 105.3787 46.5383 0.0000 175.6588 44 F 4.7592 7.6216 120.8599 59.0845 39.5344 176.5292 45 I 4.7175 7.5871 110.5904 59.2059 40.1554 174.6404 46 K 4.1097 9.0660 124.6261 57.7232 31.5747 177.2716 47 G 4.0997 7.3922 104.1474 46.3334 0.0000 170.1210 48 Y 5.9712 8.1892 116.9346 55.5140 41.6934 173.9711 49 E 4.8734 8.7226 115.6355 55.6750 31.5062 176.7186 50 R 4.4335 8.9483 122.4314 57.5209 31.1616 176.3778 51 V 4.2708 7.8519 111.3146 61.9449 34.9073 173.5321 52 D 4.7161 8.4222 119.7496 55.0518 41.5031 175.7049 53 V 4.1565 9.4766 129.1766 61.1962 30.3891 174.7661 54 D 4.3673 8.3807 128.6518 54.8606 36.9914 176.0382 55 G 3.8699 8.3482 103.9843 45.8442 0.0000 173.9641 56 K 4.2570 7.4764 119.8964 53.8399 31.8655 173.8577 57 P 5.0824 0.0000 0.0000 61.8717 30.4180 176.2308 58 Y 4.5382 8.0889 133.3393 58.5322 38.3268 176.3357 59 L 4.3808 9.0069 126.7156 55.0984 46.2309 175.7645 60 R 4.3135 9.0459 125.3545 55.6813 29.4629 174.5162 61 V 4.3701 8.4035 122.9916 61.9493 32.4374 174.1978 62 Y 4.6356 10.0379 127.3103 57.7164 39.1062 177.1049 63 L 4.4944 8.3200 123.4077 56.8053 44.3527 176.1324 64 K 5.0073 7.5094 125.9515 57.9608 34.5083 174.5383 65 Y 4.6515 8.7244 125.6179 56.1256 41.1194 174.8089 66 G 4.2038 8.7120 107.5588 44.3678 0.0000 171.0973 67 P 4.7182 0.0000 0.0000 61.7324 33.8706 175.6704 68 R 4.4264 8.1069 119.0712 56.9525 30.5832 174.4965 69 R 4.6247 7.9650 115.1754 55.8073 34.1455 173.8505 70 Q 4.5615 8.5297 117.1062 55.3061 31.7493 176.8643 71 G 3.8356 8.5523 107.4105 43.8414 0.0000 171.3277 72 P 4.2422 0.0000 0.0000 63.4543 32.2737 175.7392 73 D 4.3048 8.5126 118.5391 55.0630 39.4484 173.0030 74 P 4.5799 0.0000 0.0000 61.9259 31.0276 177.2998 75 R 4.3344 7.4609 116.7871 54.5661 32.0433 174.8338 76 P 4.7697 0.0000 0.0000 61.3814 31.9696 175.1817 77 E 4.1670 8.8749 124.5340 56.0300 30.4726 175.9124 78 Q 4.0920 8.9636 126.2424 56.8822 29.2834 177.3400 79 V 4.0019 8.3735 119.7619 64.6544 32.6679 177.0461 80 I 4.3558 7.0584 120.6354 59.3730 35.6240 174.9905 81 H 3.9404 7.9838 119.3024 58.4090 29.4514 175.3432 82 H 4.0417 7.4709 115.5619 55.0660 33.8451 172.9227 83 I 4.4814 8.0595 125.6742 59.5959 40.6069 173.6525 84 R 4.6053 8.4400 130.0447 54.1604 32.7496 175.1861 85 R 3.9102 8.6746 126.0288 57.9599 30.8672 174.6635 86 I 4.1068 8.6581 121.9977 61.5618 39.5970 175.9345 87 S 4.1996 6.3532 130.4139 59.5574 63.9846 174.2529 88 K 4.7563 8.7743 127.3991 54.3528 33.4739 176.6586 89 P 4.3515 0.0000 0.0000 65.2869 31.5051 178.1113 90 G 3.5959 7.6959 107.0001 47.5110 0.0000 174.3012 91 R 4.3813 7.6362 126.6464 53.8880 29.9349 174.5284 92 R 4.9947 8.2886 123.6512 54.8789 31.3364 176.2964 93 V 4.4991 7.8720 121.5899 61.2979 34.2496 173.7301 94 Y 5.1024 8.5865 123.7280 56.2529 41.7652 175.0887 95 V 4.5198 8.7091 116.4594 59.6971 35.0893 175.6043 96 G 4.0060 9.8793 115.4699 46.4707 0.0000 175.8908 97 V 3.3283 8.8019 120.5269 62.6144 34.3960 176.3639 98 K 4.0469 8.0750 122.8912 58.7215 32.5928 178.2744 99 E 4.1274 7.8944 117.5486 58.6769 29.6551 177.5541 100 I 3.6709 7.6461 119.1936 61.2602 37.6792 173.3609 101 P 4.7739 0.0000 0.0000 61.2038 33.5022 174.6239 102 R 4.3338 8.1146 117.7010 54.2264 30.9560 176.7211 103 V 3.5224 8.3003 123.9458 63.0618 31.8290 175.8256 104 R 3.6055 8.9291 130.2814 57.6951 27.9311 175.9170 105 R 3.5893 8.6315 107.9503 57.4680 27.8163 178.4639 106 G 4.0073 8.3514 106.2734 45.5692 0.0000 175.3557 107 L 4.0549 7.7010 121.1883 57.3288 42.6543 176.7479 108 G 4.5042 8.5161 107.8463 45.1764 0.0000 172.8367 109 I 5.1611 9.0103 119.3623 58.2667 42.5912 175.9500 110 A 5.0362 8.5578 126.9162 50.0912 20.9671 175.3082 111 I 4.4561 8.9272 122.6239 61.9806 38.5287 175.3382 112 L 4.7054 7.9011 123.7979 55.7563 44.3034 173.3216 113 S 4.6324 8.0709 115.6751 57.5970 64.6737 172.2574 114 T 4.4146 8.5061 114.4108 61.8402 69.1079 173.0745 115 S 4.2210 8.7934 121.4520 60.6932 63.2824 175.1289 116 K 4.4099 7.5590 119.3843 54.7526 34.6763 175.2178 117 G 3.9421 8.8555 115.2641 44.7060 0.0000 172.8237 118 V 4.3205 8.1914 119.2456 60.7457 33.1432 174.1266 119 L 5.0567 8.1451 130.4216 54.9774 43.8376 175.3784 120 T 5.4210 9.2820 108.3935 59.4052 71.3742 175.2910 121 D 4.4720 8.8812 121.5232 55.8101 39.3437 178.3734 122 R 4.4645 8.4227 116.9801 56.5894 33.0221 177.8280 123 E 3.9701 8.2737 117.3061 59.4336 29.0624 179.1745 124 A 3.8795 7.9127 120.3545 55.0095 18.0035 178.9967 125 R 3.8184 7.9925 116.7629 59.8036 29.8316 177.8953 126 K 3.7960 9.4297 118.3914 59.9439 32.2728 177.8843 127 L 4.2611 8.4789 120.5501 55.5531 42.4756 173.7417 128 G 3.7961 9.9275 113.0424 44.4350 0.0000 172.5993 129 V 4.3342 7.8254 121.9605 58.6483 39.8952 175.1572 130 G 4.0374 9.0573 109.7135 43.1995 0.0000 172.9647 131 G 4.2278 7.9246 105.6890 44.9660 0.0000 170.5224 132 E 4.2924 8.0035 120.7692 55.7511 30.7609 176.9107 133 L 4.3347 8.3909 130.2979 54.7637 40.8085 176.7711 134 I 3.9845 8.6301 125.2005 61.5611 37.9600 175.3089 135 C 5.2587 7.8157 114.2738 58.1028 33.2631 171.3315 136 E 5.2061 8.5600 115.1296 55.0460 32.6408 174.6981 137 V 4.7513 8.8939 119.7079 60.9622 36.3040 175.0659 138 W 4.2986 8.1889 119.1934 57.4965 28.6919 174.3129 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 4.31 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 7.64 3.35 0.00 1.86 1.73 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.09 4.21 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 1.20 0.00 0.00 4 D 7.35 4.76 0.00 2.73 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 5 P 0.00 4.37 0.00 2.09 2.14 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 6 I 7.33 3.65 2.37 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.62 0.95 0.00 0.00 7 A 10.60 3.94 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 8 D 8.61 4.50 0.00 2.78 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 9 M 8.51 4.07 0.00 2.25 2.01 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 10 L 7.93 4.00 0.00 1.66 1.65 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 11 T 9.28 3.85 4.41 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 1.19 0.00 0.00 12 R 7.65 3.85 0.00 2.00 1.95 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.98 0.00 13 I 8.24 3.60 1.78 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 1.56 1.35 0.82 0.00 0.00 14 R 7.63 3.84 0.00 2.03 2.09 0.00 3.20 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 15 N 7.89 4.45 0.00 2.90 2.80 0.00 0.00 6.72 8.70 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 16 A 8.73 4.03 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 17 T 8.38 4.74 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 1.14 0.00 0.00 18 R 8.90 3.34 0.00 1.94 1.78 0.00 3.16 0.00 0.00 3.24 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 19 V 7.17 3.33 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 0.57 0.00 0.00 0.95 0.00 0.00 20 Y 7.44 3.15 0.00 2.93 2.30 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 21 K 8.26 4.45 0.00 1.75 1.96 0.00 1.84 0.00 0.00 1.79 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.39 7.81 22 E 8.83 3.85 0.00 2.13 1.77 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 2.46 2.50 0.00 23 S 8.45 4.95 0.00 3.76 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 24 T 8.29 4.57 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 1.17 0.00 0.00 25 D 8.48 5.83 0.00 2.37 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 26 V 8.18 4.03 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 0.92 0.00 0.00 0.96 0.00 0.00 27 P 0.00 4.57 0.00 1.88 1.65 0.00 3.76 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 2.07 2.34 0.00 28 A 8.31 4.16 1.28 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 0.00 0.00 29 S 8.76 5.37 0.00 3.98 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 30 R 7.75 3.63 0.00 1.94 1.90 0.00 3.30 0.00 0.00 3.29 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 31 F 8.33 3.87 0.00 3.15 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.22 3.91 0.00 2.14 1.79 0.00 1.88 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.54 7.81 33 E 8.25 3.50 0.00 1.90 1.72 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 2.19 2.64 0.00 34 E 7.84 3.77 0.00 1.53 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 0.00 2.35 2.20 0.00 35 I 7.08 3.50 1.73 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.99 0.81 0.00 0.00 36 L 7.89 3.71 0.00 1.45 1.44 0.63 0.81 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 37 R 8.88 3.52 0.00 1.73 1.92 0.00 3.13 0.00 0.00 3.15 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 38 I 7.92 3.75 1.95 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 1.37 1.13 0.93 0.00 0.00 39 L 9.68 3.86 0.00 1.78 1.76 0.72 1.03 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 40 A 9.56 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 41 R 8.48 3.95 0.00 1.82 2.31 0.00 3.24 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 42 E 7.64 4.67 0.00 1.99 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 2.37 2.47 0.00 43 G 8.03 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 44 F 7.62 4.76 0.00 3.40 3.01 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 45 I 7.59 4.72 2.28 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.40 0.89 0.00 0.00 46 K 9.07 4.11 0.00 1.82 1.95 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.69 7.81 47 G 7.39 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 48 Y 8.19 5.97 0.00 2.96 2.97 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 49 E 8.72 4.87 0.00 2.02 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 2.44 2.22 0.00 50 R 8.95 4.43 0.00 1.77 2.00 0.00 3.24 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 51 V 7.85 4.27 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 0.82 0.00 0.00 1.11 0.00 0.00 52 D 8.42 4.72 0.00 2.61 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 9.48 4.16 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 0.82 0.00 0.00 0.94 0.00 0.00 54 D 8.38 4.37 0.00 3.01 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 55 G 8.35 3.87 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 0.00 56 K 7.48 4.26 0.00 2.28 1.69 0.00 1.98 0.00 0.00 1.90 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.56 7.81 57 P 0.00 5.08 0.00 2.20 2.22 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 58 Y 8.09 4.54 0.00 2.96 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 59 L 9.01 4.38 0.00 1.74 1.61 0.91 1.14 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 60 R 9.05 4.31 0.00 1.85 1.21 0.00 2.91 0.00 0.00 3.15 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 61 V 8.40 4.37 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 0.95 0.00 0.00 0.93 0.00 0.00 62 Y 10.04 4.64 0.00 3.25 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 63 L 8.32 4.49 0.00 2.09 1.45 0.70 0.82 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 64 K 7.51 5.01 0.00 1.91 1.90 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.27 7.81 65 Y 8.72 4.65 0.00 2.80 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 66 G 8.71 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.72 0.00 2.12 2.23 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 68 R 8.11 4.43 0.00 1.73 1.90 0.00 3.33 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 69 R 7.97 4.62 0.00 1.77 1.78 0.00 3.23 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 70 Q 8.53 4.56 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 71 G 8.55 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 72 P 0.00 4.24 0.00 2.06 2.00 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 73 D 8.51 4.30 0.00 2.79 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 74 P 0.00 4.58 0.00 2.19 2.07 0.00 3.80 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 1.96 1.97 0.00 75 R 7.46 4.33 0.00 2.13 1.77 0.00 3.67 0.00 0.00 3.41 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 76 P 0.00 4.77 0.00 1.90 2.03 0.00 2.71 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.24 0.00 77 E 8.87 4.17 0.00 2.12 1.92 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 2.50 2.44 0.00 78 Q 8.96 4.09 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.67 0.00 0.00 0.00 0.00 0.00 2.64 2.41 0.00 79 V 8.37 4.00 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 0.99 0.00 0.00 1.03 0.00 0.00 80 I 7.06 4.36 1.67 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.71 0.53 0.00 0.00 81 H 7.98 3.94 0.00 2.57 3.16 0.00 5.94 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 82 H 7.47 4.04 0.00 2.12 1.31 0.00 5.74 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.06 4.48 1.58 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.74 0.72 0.00 0.00 84 R 8.44 4.61 0.00 1.87 1.87 0.00 3.18 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 85 R 8.67 3.91 0.00 1.84 1.80 0.00 3.26 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.82 0.00 86 I 8.66 4.11 2.22 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.06 0.89 0.00 0.00 87 S 6.35 4.20 0.00 3.80 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.77 4.76 0.00 1.76 1.70 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.51 7.81 89 P 0.00 4.35 0.00 2.16 2.17 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 90 G 7.70 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 0.00 0.00 0.00 91 R 7.64 4.38 0.00 1.84 1.83 0.00 3.18 0.00 0.00 3.34 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 92 R 8.29 4.99 0.00 2.14 1.86 0.00 3.67 0.00 0.00 3.94 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 93 V 7.87 4.50 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 0.99 0.00 0.00 0.90 0.00 0.00 94 Y 8.59 5.10 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 95 V 8.71 4.52 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 0.80 0.00 0.00 1.05 0.00 0.00 96 G 9.88 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 97 V 8.80 3.33 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 0.86 0.00 0.00 0.94 0.00 0.00 98 K 8.07 4.05 0.00 1.77 1.96 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.51 7.81 99 E 7.89 4.13 0.00 1.99 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 2.36 2.30 0.00 100 I 7.65 3.67 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 0.97 0.00 0.00 101 P 0.00 4.77 0.00 2.15 2.04 0.00 3.74 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 1.90 1.96 0.00 102 R 8.11 4.33 0.00 1.76 1.96 0.00 3.24 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 103 V 8.30 3.52 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 1.13 0.00 0.00 1.06 0.00 0.00 104 R 8.93 3.61 0.00 1.75 1.76 0.00 2.85 0.00 0.00 2.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.45 0.00 105 R 8.63 3.59 0.00 1.94 1.97 0.00 3.44 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 106 G 8.35 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 0.00 107 L 7.70 4.05 0.00 1.61 1.98 0.91 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.52 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.01 5.16 2.10 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 1.20 1.69 1.28 0.00 0.00 110 A 8.56 5.04 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 0.00 111 I 8.93 4.46 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.63 0.85 0.00 0.00 112 L 7.90 4.71 0.00 1.95 1.75 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.07 4.63 0.00 4.20 3.87 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 0.00 114 T 8.51 4.41 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 1.31 0.00 0.00 115 S 8.79 4.22 0.00 4.04 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.56 4.41 0.00 1.73 1.74 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.41 7.81 117 G 8.86 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 0.00 118 V 8.19 4.32 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 0.80 0.00 0.00 0.89 0.00 0.00 119 L 8.15 5.06 0.00 1.88 1.74 0.96 0.44 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 0.00 120 T 9.28 5.42 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 1.32 0.00 0.00 121 D 8.88 4.47 0.00 2.88 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 0.00 122 R 8.42 4.46 0.00 1.85 1.95 0.00 3.13 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 123 E 8.27 3.97 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 124 A 7.91 3.88 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 0.00 125 R 7.99 3.82 0.00 2.12 2.02 0.00 3.21 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 126 K 9.43 3.80 0.00 1.86 2.04 0.00 1.88 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 127 L 8.48 4.26 0.00 1.77 1.85 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 128 G 9.93 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 0.00 129 V 7.83 4.33 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 0.85 0.00 0.00 0.95 0.00 0.00 130 G 9.06 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 0.00 131 G 7.92 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 0.00 132 E 8.00 4.29 0.00 1.84 1.77 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 2.12 1.63 0.00 133 L 8.39 4.33 0.00 1.77 1.50 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.63 3.98 1.95 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.66 0.97 0.00 0.00 135 C 7.82 5.26 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 0.00 136 E 8.56 5.21 0.00 2.19 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 2.25 2.31 0.00 137 V 8.89 4.75 1.63 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 0.50 0.00 0.00 0.79 0.00 0.00 138 W 8.19 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