NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.2681 8.3144 120.1355 56.2225 33.5089 176.6958 12 R 3.8626 8.7011 121.3260 56.8230 31.5009 174.3464 13 Q 4.4411 9.0179 122.9842 55.6006 32.1442 173.8017 14 V 4.4816 8.2573 115.7346 59.5278 35.0865 175.7542 15 A 5.2674 8.3998 122.3262 51.6032 20.3563 176.2102 16 S 4.9286 8.1547 110.8702 56.6435 63.9899 172.7883 17 G 4.3675 8.5708 114.7502 44.6736 0.0000 170.0757 18 R 5.1413 9.5755 118.2167 54.1705 34.1207 175.2373 19 A 4.9086 8.8586 125.4330 50.6681 21.0489 175.0606 20 Y 4.9648 9.0161 121.0953 57.6705 39.8940 175.2256 21 I 4.5739 9.4525 127.4265 60.1724 39.1039 174.5005 22 H 5.0076 9.3755 128.1237 53.2069 30.0364 170.2635 23 A 4.7355 8.1627 122.9232 50.9537 20.2528 176.6090 24 S 4.9410 8.5895 119.2750 57.5607 66.0891 174.1969 25 Y 4.2602 9.0143 115.4410 59.5992 38.0771 175.9636 26 N 4.9506 7.2871 115.2029 52.1579 39.7669 173.9302 27 N 4.6015 7.2499 114.1893 53.5659 41.7037 172.6535 28 T 4.9754 7.9116 120.8045 62.0398 71.2306 173.4103 29 I 4.9278 8.3994 125.6826 59.5278 41.9562 173.8677 30 V 5.6223 8.9246 122.1956 58.9595 34.7886 174.2917 31 T 5.0086 8.7457 119.8762 60.3618 70.2140 172.4087 32 I 5.1243 8.5136 129.7567 60.0532 39.1804 174.9219 33 T 5.1893 9.0708 117.1841 59.7225 72.7079 174.1149 34 D 4.8197 8.4479 121.1891 52.5166 41.1868 174.9590 35 P 4.3398 0.0000 0.0000 65.1992 31.5325 176.6107 36 D 4.6294 8.8426 117.2485 53.9272 41.0483 177.2954 37 G 4.1579 8.1561 107.7878 45.2264 0.0000 173.1571 38 N 4.7485 8.0874 117.5166 50.9782 39.7416 172.9505 39 P 4.6773 0.0000 0.0000 63.6263 32.1436 174.9546 40 I 4.3988 8.6755 121.6576 62.5821 39.6249 176.1257 41 T 4.4895 7.5032 114.0220 60.7450 70.5155 171.8981 42 W 5.3853 8.2180 124.9883 55.1058 31.7527 174.1164 43 S 4.3536 9.0837 112.5635 57.8625 65.9574 173.7611 44 S 4.9805 8.4212 118.2606 56.5368 65.8929 174.7589 45 G 3.9682 9.0239 109.5264 48.8618 0.0000 176.2754 46 G 3.6500 7.7738 107.2796 47.2652 0.0000 175.0249 47 V 3.5822 7.7488 119.2630 65.4983 31.4944 176.3083 48 I 4.1476 6.9490 119.2874 59.5428 38.3279 175.8369 49 G 3.9171 8.7440 110.1922 49.4010 0.0000 173.8495 50 Y 4.6219 7.4369 116.3307 57.7275 38.3117 175.5811 51 K 4.8073 8.2545 124.2048 55.8588 36.4092 177.7831 52 G 4.0078 8.3718 113.1775 46.7431 0.0000 177.8387 53 S 4.2256 8.8044 119.1453 60.5874 63.1863 175.5041 54 R 3.9341 7.8170 119.6482 58.2580 30.0679 178.1126 55 K 4.2306 7.8335 116.3191 58.1085 31.9587 179.0736 56 G 3.6180 8.4525 109.1430 49.1202 0.0000 173.7256 57 T 3.8393 7.2176 114.7685 58.4282 69.2868 171.9160 58 P 4.2833 0.0000 0.0000 66.3544 31.0114 177.8227 59 Y 4.2982 8.0900 118.7473 60.7245 38.6240 177.6579 60 A 4.0026 8.3344 120.7634 55.8391 18.1994 179.5609 61 A 3.8388 7.4331 116.3293 55.3945 18.9132 178.9233 62 Q 3.9186 7.9197 117.6051 60.0163 29.0490 179.2543 63 L 3.9931 7.4670 118.6909 57.3214 41.3652 178.8601 64 A 4.1332 8.3976 120.1752 53.6004 18.4003 178.7730 65 A 4.1803 8.1028 119.6168 54.0159 19.7202 179.4246 66 L 3.9580 7.6276 117.0305 57.8443 41.8347 178.9250 67 D 4.1393 8.0492 117.8260 57.0973 41.0982 177.9911 68 A 3.8557 7.5032 120.7743 55.1813 18.4112 179.0421 69 A 3.8662 8.4209 119.1791 55.3454 18.4278 179.3326 70 K 3.7276 8.8896 118.7080 59.9326 31.9744 178.7299 71 K 3.8962 7.7666 116.5615 59.6173 32.1831 178.8846 72 A 4.0744 7.9377 120.8460 55.2391 17.9182 179.4323 73 M 4.0776 8.7528 117.4038 58.7004 31.8885 178.8131 74 A 4.0185 8.1545 119.2626 54.5824 18.4964 178.1650 75 Y 4.3291 8.2032 113.9119 56.9299 39.7902 175.1874 76 G 3.5538 9.3138 109.3945 46.0301 0.0000 172.4990 77 M 4.8647 7.5162 118.3120 54.4771 34.9624 173.7265 78 Q 4.6317 8.6972 119.4790 55.8892 33.1572 174.3390 79 S 5.3380 7.9118 112.7863 56.7932 66.3915 172.7689 80 V 5.3987 8.5315 114.6938 59.4687 36.2541 173.9090 81 D 4.8121 8.6463 124.1963 53.5739 42.8326 175.3413 82 V 4.6566 8.5983 123.2098 61.6206 33.8091 174.7738 83 I 5.0568 8.2207 126.8548 59.9555 41.3216 174.4633 84 V 4.8594 9.1483 120.5621 59.9378 34.7940 175.8436 85 R 4.4987 9.4584 123.5828 58.7034 33.7058 174.4536 86 G 4.6183 7.2737 109.8536 44.9161 0.0000 172.4921 87 T 4.5209 7.9105 112.8849 62.5391 70.5589 174.6286 88 G 3.7957 7.8563 110.8494 44.8987 0.0000 173.4402 89 A 3.8614 7.8438 122.9468 55.6109 18.7583 179.2337 90 G 3.9359 7.8219 100.3215 45.1542 0.0000 175.2492 91 R 3.7444 7.5222 119.6198 57.7822 30.8459 176.2130 92 E 4.1678 7.9328 118.7566 59.0737 29.9886 177.6181 93 Q 3.9826 8.1956 117.3597 59.6006 28.6133 178.4129 94 A 3.9351 7.5905 120.4374 56.5555 18.2732 179.1909 95 I 3.5767 7.9614 115.6268 63.9583 37.3263 178.5400 96 R 3.8525 8.3110 117.7872 59.6675 30.1093 178.8860 97 A 3.9842 7.9771 119.0049 55.2109 18.4761 179.0602 98 L 4.0445 7.8321 116.4936 58.3014 41.6345 179.6409 99 Q 4.1129 8.0123 117.4544 58.4798 29.8634 177.1705 100 A 4.5996 7.5445 122.6999 50.9152 16.3047 177.2858 101 S 4.5665 7.8369 111.2632 56.8943 67.9537 175.6357 102 G 4.1251 7.5362 109.7411 46.0686 0.0000 174.7736 103 L 4.2948 7.5104 118.5395 54.5233 42.3964 175.8544 104 Q 4.4981 8.5961 123.1942 54.5863 30.9179 174.9415 105 V 4.4589 8.3539 120.8066 60.5256 31.2978 176.3573 106 K 4.2754 8.6206 126.6170 58.6413 32.9069 178.1144 107 S 4.5311 7.5668 110.4051 57.6709 65.4843 175.6066 108 I 4.7510 8.5639 125.4079 60.1909 38.6689 175.3249 109 V 4.4032 8.3438 124.5950 61.5814 35.5167 172.9580 110 D 5.0790 8.7788 127.3456 52.5201 41.4243 176.3280 111 D 4.9085 8.3274 131.3962 53.4421 39.3059 176.7256 112 T 4.4015 7.7216 116.0731 62.1499 69.9043 174.7552 113 P 4.4422 0.0000 0.0000 62.1178 32.0440 175.9442 114 V 4.4304 8.1451 122.7176 58.7246 33.7087 173.6818 115 P 4.3777 0.0000 0.0000 62.9288 32.6208 176.2589 116 H 4.6886 8.3178 118.0652 55.3095 28.0769 175.2986 117 N 4.2071 7.8404 116.9907 53.7392 36.2301 174.6103 118 G 3.3859 8.4068 110.7228 47.0457 0.0000 172.9635 119 C 4.5871 8.7848 114.3790 57.8689 30.9698 173.3715 120 R 4.2369 8.1124 121.3002 55.3595 30.5063 174.4983 121 P 4.5923 0.0000 0.0000 61.5417 32.5475 176.3082 122 K 4.0567 8.8204 120.3792 57.5123 32.8370 179.4830 123 K 4.6096 8.1012 125.5961 59.2047 32.4977 177.1308 124 K 3.9284 8.3770 119.7366 59.6664 32.0136 178.3102 125 F 4.5170 8.5403 115.6158 59.4697 39.5373 177.1227 126 R 3.9749 8.1775 120.1002 59.5755 30.2779 180.6530 127 K 4.4429 7.9348 115.3089 58.5495 32.3785 175.1022 128 A 4.4219 7.7540 121.7211 50.8445 19.2826 177.0360 129 S 4.3591 8.5786 116.6027 58.7253 62.4904 173.7156 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 11 K 8.31 4.27 0.00 1.78 1.69 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.45 7.81 12 R 8.70 3.86 0.00 1.87 1.86 0.00 3.29 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 13 Q 9.02 4.44 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.53 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 14 V 8.26 4.48 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.96 0.00 0.00 15 A 8.40 5.27 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 16 S 8.15 4.93 0.00 3.87 3.77 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 17 G 8.57 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 0.00 0.00 0.00 18 R 9.58 5.14 0.00 1.49 1.44 0.00 2.84 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 19 A 8.86 4.91 1.20 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 20 Y 9.02 4.96 0.00 3.06 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 9.45 4.57 1.91 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 1.13 0.59 0.94 0.00 0.00 22 H 9.38 5.01 0.00 3.21 3.23 0.00 5.64 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 23 A 8.16 4.74 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 24 S 8.59 4.94 0.00 4.07 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 9.01 4.26 0.00 3.00 3.10 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 26 N 7.29 4.95 0.00 2.69 2.86 0.00 0.00 6.76 7.88 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 27 N 7.25 4.60 0.00 2.79 2.63 0.00 0.00 7.58 7.22 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 28 T 7.91 4.98 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 nan 0.00 0.00 29 I 8.40 4.93 1.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.57 0.95 0.00 0.00 30 V 8.92 5.62 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 1.03 0.00 0.00 31 T 8.75 5.01 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 32 I 8.51 5.12 2.10 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 1.30 0.48 0.98 0.00 0.00 33 T 9.07 5.19 4.46 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 1.37 0.00 0.00 34 D 8.45 4.82 0.00 2.97 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.34 0.00 2.07 2.15 0.00 3.68 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 2.03 2.31 0.00 36 D 8.84 4.63 0.00 2.72 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 37 G 8.16 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.09 4.75 0.00 2.97 2.76 0.00 0.00 7.05 8.03 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 39 P 0.00 4.68 0.00 2.07 2.05 0.00 3.63 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 2.13 0.00 40 I 8.68 4.40 1.85 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 1.23 0.89 0.79 0.00 0.00 41 T 7.50 4.49 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 1.05 0.00 0.00 42 W 8.22 5.39 0.00 3.47 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 43 S 9.08 4.35 0.00 3.79 3.62 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 44 S 8.42 4.98 0.00 4.31 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.02 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 46 G 7.77 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.75 3.58 2.23 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 0.57 0.00 0.00 0.65 0.00 0.00 48 I 6.95 4.15 1.75 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.82 0.71 0.00 0.00 49 G 8.74 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 0.00 0.00 0.00 50 Y 7.44 4.62 0.00 3.14 2.94 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 51 K 8.25 4.81 0.00 1.73 1.66 0.00 1.90 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.47 7.81 52 G 8.37 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 S 8.80 4.23 0.00 3.98 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 54 R 7.82 3.93 0.00 1.56 1.25 0.00 2.68 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 55 K 7.83 4.23 0.00 2.10 2.09 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.68 1.50 7.81 56 G 8.45 3.62 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 0.00 0.00 0.00 57 T 7.22 3.84 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 1.29 0.00 0.00 58 P 0.00 4.28 0.00 2.35 2.34 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.07 0.00 59 Y 8.09 4.30 0.00 3.10 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 60 A 8.33 4.00 1.60 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 61 A 7.43 3.84 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 62 Q 7.92 3.92 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 63 L 7.47 3.99 0.00 1.51 1.49 0.50 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.40 4.13 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 65 A 8.10 4.18 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 66 L 7.63 3.96 0.00 1.64 1.68 0.88 1.01 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 67 D 8.05 4.14 0.00 2.70 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 7.50 3.86 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 69 A 8.42 3.87 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 70 K 8.89 3.73 0.00 1.68 1.82 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.51 7.81 71 K 7.77 3.90 0.00 1.86 1.72 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.53 7.81 72 A 7.94 4.07 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 73 M 8.75 4.08 0.00 2.04 2.26 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 2.79 2.58 0.00 74 A 8.15 4.02 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 75 Y 8.20 4.33 0.00 3.05 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 9.31 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 M 7.52 4.86 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 78 Q 8.70 4.63 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.53 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 79 S 7.91 5.34 0.00 3.90 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 80 V 8.53 5.40 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.91 0.00 0.00 81 D 8.65 4.81 0.00 2.50 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 82 V 8.60 4.66 2.12 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 0.93 0.00 0.00 0.90 0.00 0.00 83 I 8.22 5.06 1.41 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.66 1.05 0.00 0.00 84 V 9.15 4.86 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 0.73 0.00 0.00 1.02 0.00 0.00 85 R 9.46 4.50 0.00 1.62 1.73 0.00 3.09 0.00 0.00 3.11 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.65 0.00 86 G 7.27 4.62 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 0.00 0.00 0.00 87 T 7.91 4.52 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 1.21 0.00 0.00 88 G 7.86 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 89 A 7.84 3.86 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 90 G 7.82 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 91 R 7.52 3.74 0.00 1.86 1.93 0.00 3.24 0.00 0.00 3.13 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 92 E 7.93 4.17 0.00 2.11 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 2.34 2.44 0.00 93 Q 8.20 3.98 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 94 A 7.59 3.94 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 95 I 7.96 3.58 2.01 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 1.63 0.51 0.90 0.00 0.00 96 R 8.31 3.85 0.00 1.89 2.01 0.00 3.13 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 97 A 7.98 3.98 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 98 L 7.83 4.04 0.00 1.83 1.76 0.91 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.01 4.11 0.00 2.39 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.16 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 100 A 7.54 4.60 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 0.00 101 S 7.84 4.57 0.00 3.92 4.15 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 0.00 102 G 7.54 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 0.00 0.00 0.00 103 L 7.51 4.29 0.00 1.84 1.60 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.60 4.50 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 105 V 8.35 4.46 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 0.73 0.00 0.00 0.92 0.00 0.00 106 K 8.62 4.28 0.00 1.71 1.85 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.37 7.81 107 S 7.57 4.53 0.00 3.81 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 0.00 108 I 8.56 4.75 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 1.22 0.45 0.90 0.00 0.00 109 V 8.34 4.40 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 0.68 0.00 0.00 0.97 0.00 0.00 110 D 8.78 5.08 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.33 4.91 0.00 2.73 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 T 7.72 4.40 4.36 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 1.22 0.00 0.00 113 P 0.00 4.44 0.00 2.17 2.06 0.00 3.70 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 114 V 8.15 4.43 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 0.84 0.00 0.00 0.96 0.00 0.00 115 P 0.00 4.38 0.00 2.30 2.08 0.00 3.77 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 2.00 2.00 0.00 116 H 8.32 4.69 0.00 3.17 3.28 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 7.84 4.21 0.00 2.91 2.94 0.00 0.00 7.18 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.41 3.39 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 0.00 119 C 8.78 4.59 0.00 2.97 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 0.00 120 R 8.11 4.24 0.00 1.77 1.82 0.00 3.23 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 121 P 0.00 4.59 0.00 2.15 2.06 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 122 K 8.82 4.06 0.00 1.62 1.63 0.00 1.55 0.00 0.00 1.47 0.00 0.00 2.66 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.29 7.81 123 K 8.10 4.61 0.00 1.81 1.74 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.50 7.81 124 K 8.38 3.93 0.00 1.84 1.82 0.00 2.35 0.00 0.00 2.13 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.76 1.58 7.81 125 F 8.54 4.52 0.00 2.97 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 0.00 126 R 8.18 3.97 0.00 1.88 2.08 0.00 3.12 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 127 K 7.93 4.44 0.00 1.85 2.00 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.79 1.60 7.81 128 A 7.75 4.42 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 0.00 129 S 8.58 4.36 0.00 3.84 3.74 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