NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1759 8.1727 122.0499 56.3025 34.1668 174.0423 2 V 4.5572 8.1413 126.5085 60.8570 32.1940 174.6895 3 F 4.3932 9.9958 129.0733 57.4054 40.2409 175.0699 4 E 4.2637 8.9956 121.1237 55.9937 30.7485 177.5970 5 R 3.3279 8.9281 122.4830 60.2887 30.0414 179.7158 6 C 4.3557 8.0552 115.2276 59.4001 38.7789 175.4865 7 E 3.8868 8.1644 120.9134 59.2814 29.1816 178.5282 8 L 3.6090 8.0670 120.0646 57.8045 42.0778 178.6056 9 A 3.9348 7.8935 120.7389 55.4378 18.3510 179.9270 10 R 3.9199 8.1703 116.5153 59.4620 30.1678 179.4663 11 T 3.8611 7.9088 115.6664 66.6865 68.4823 176.6965 12 L 3.8588 8.1191 121.2650 57.5047 41.5564 179.5383 13 K 3.9207 8.0822 119.6186 59.6510 31.9604 179.1991 14 R 4.0193 7.9050 117.0808 58.6736 29.9792 177.9959 15 L 4.4138 7.4351 116.4915 54.2490 41.6945 177.1748 16 G 3.8925 7.7679 106.8956 46.5009 0.0000 175.0876 17 M 3.9270 7.8437 121.5037 56.7753 32.2420 175.8425 18 D 4.4664 8.0370 118.2810 55.6531 41.3336 175.8901 19 G 3.9665 9.4480 115.6905 45.4977 0.0000 171.6296 20 Y 4.2624 8.2413 122.1517 58.6126 38.9815 176.1140 21 R 3.5010 9.0810 126.1667 57.2347 27.8563 177.1940 22 G 3.8368 8.2308 103.5254 45.5932 0.0000 174.0073 23 I 4.1330 7.5432 121.9153 59.2924 38.2885 175.8872 24 S 4.6724 8.3305 120.8200 57.9259 65.0496 174.9497 25 L 4.2796 8.7664 123.1221 58.2587 41.3330 179.8793 26 A 4.1525 8.1315 120.1068 55.3213 18.3834 179.3034 27 N 4.4765 8.0890 115.1526 56.3047 38.6141 177.7240 28 W 4.3096 8.0465 119.9578 59.9849 29.0278 178.5291 29 M 4.1705 8.6059 119.0482 58.5731 31.5070 177.9628 30 C 3.3196 8.3078 118.7473 59.0785 44.6844 175.2777 31 L 3.9744 8.1351 121.7106 58.3141 41.7163 178.9095 32 A 4.1252 8.2596 120.6361 54.8495 18.2972 179.3611 33 K 2.7530 8.1575 118.3617 59.3748 31.9927 179.0828 34 W 4.3694 7.5328 116.9351 59.1216 29.0582 178.3713 35 E 4.3292 8.3084 118.7613 58.6586 29.4215 177.7348 36 S 4.5143 7.8285 109.3870 56.4489 64.7253 174.4267 37 G 3.7135 8.4081 108.8609 46.9143 0.0000 173.3133 38 Y 3.6505 7.0998 111.3887 58.7306 35.6045 168.7092 39 N 5.3395 7.7624 119.3779 51.8027 40.4014 175.4467 40 T 3.9242 8.8331 117.2205 64.1680 69.0689 175.7366 41 R 4.3232 8.2050 120.1889 56.1870 30.6242 175.9475 42 A 4.3279 7.6889 120.5444 53.3367 19.2419 176.8224 43 T 5.0562 8.3815 111.3803 60.0103 72.5004 173.0406 44 N 4.8946 8.7959 121.6035 52.3330 42.6429 172.3355 45 Y 4.7008 8.7531 127.8900 57.1390 40.8338 173.8109 46 N 4.7296 8.6221 124.9847 51.2819 38.7277 175.4499 47 A 3.5824 8.2772 127.8141 54.7416 18.9725 179.1946 48 G 3.7067 8.0890 104.2775 48.1129 0.0000 173.9237 49 D 4.7176 7.6380 115.3443 52.1059 40.0773 176.1564 50 R 3.9655 8.2127 116.7207 57.1322 28.1441 175.8336 51 S 4.9594 7.7737 112.5488 57.1798 66.1930 172.8930 52 T 5.1334 8.9048 116.5143 61.9592 72.5059 172.7104 53 D 5.5477 8.9674 125.0769 53.1530 43.2708 175.0607 54 Y 5.0300 9.1432 120.9496 57.5073 41.5751 177.3128 55 G 4.4430 9.1977 111.9701 46.3018 0.0000 173.5085 56 I 3.6842 8.3009 117.4594 63.3921 37.9956 177.5234 57 F 4.7415 7.9928 115.7480 56.3709 39.8176 175.2212 58 Q 3.6553 7.9091 119.0453 57.1151 26.4971 174.0820 59 I 4.4449 8.1101 118.9099 61.0379 39.3178 176.9061 60 N 5.5063 9.2109 125.7574 53.3362 40.1977 175.3440 61 S 4.9618 8.9778 118.9315 59.1036 63.5945 175.1552 62 R 3.8109 8.7858 122.7709 58.9532 30.4015 177.5770 63 Y 4.1438 7.6901 114.8503 57.7435 39.9138 176.5958 64 W 4.8399 8.2774 117.8615 57.7233 31.7148 173.5790 65 C 5.6109 8.3213 112.5979 53.5237 45.8118 171.7825 66 N 5.1518 8.9124 119.2626 52.1185 40.0429 174.8259 67 D 4.8174 8.9500 123.9221 52.4683 40.5500 176.8092 68 G 4.1236 8.5642 109.5177 45.4624 0.0000 174.6293 69 K 4.4470 7.9683 115.5076 56.6317 33.0910 175.7158 70 T 4.5013 7.7225 116.8801 61.4313 69.6455 172.9169 71 P 4.3176 0.0000 0.0000 63.3874 31.9558 175.9309 72 G 3.8471 8.6264 107.3188 46.4207 0.0000 173.9101 73 A 4.2484 7.9266 121.1720 51.7598 19.1052 178.3952 74 V 3.9154 8.0400 120.1068 62.1350 33.6958 175.4948 75 N 4.1810 8.0266 116.7979 54.4716 36.9102 174.9908 76 A 4.0185 7.9114 121.0928 55.2267 19.0257 178.5062 77 C 4.5575 8.6695 111.7404 57.3971 41.1136 173.0279 78 H 4.0283 7.8475 116.4631 56.2849 26.3461 174.5929 79 L 4.7359 8.1832 117.5551 52.8863 46.5005 176.4957 80 S 4.5515 8.5130 116.8032 58.2007 63.2116 175.8912 81 C 4.0518 8.8698 125.4283 59.8346 38.5989 176.5325 82 S 3.8930 7.7957 115.3947 61.3142 62.1134 176.4112 83 A 4.2154 7.8824 123.4165 54.2959 18.2053 178.4350 84 L 4.5043 7.8347 116.3379 54.8295 41.6652 177.5201 85 L 5.0234 7.4634 117.7856 54.5243 42.2837 176.7178 86 Q 4.3511 7.7528 117.8205 55.4543 29.4872 175.9851 87 D 4.4439 8.5100 119.6852 57.0050 41.1935 176.9030 88 N 4.6099 8.0654 117.9796 53.1875 39.5680 174.7666 89 I 4.3001 8.3552 118.0507 60.9020 38.1232 177.1048 90 A 3.9380 8.2413 124.8505 55.9400 18.1903 180.0656 91 D 4.3084 8.0822 116.5461 57.2646 40.8844 178.6126 92 A 4.0920 7.9865 120.9272 55.2147 18.3746 179.6844 93 V 3.3728 8.1875 116.8338 65.9940 31.7005 178.0397 94 A 3.8321 7.9836 120.5135 55.3613 18.1719 178.8556 95 C 4.2448 8.3906 116.7493 59.6292 39.0133 175.5948 96 A 3.9185 8.2856 122.8654 54.9920 17.6268 179.6756 97 K 3.7294 7.7541 116.4053 59.5198 32.4367 179.1190 98 R 4.0696 7.8226 118.6293 59.3222 29.9794 178.5907 99 V 2.4847 7.4973 117.9918 65.7655 31.2007 177.8633 100 V 3.9684 7.4242 108.1354 62.4052 31.6381 177.8806 101 R 4.1845 7.6788 117.5527 57.2605 30.5269 176.5441 102 D 4.7150 7.3365 118.7976 52.9145 41.7695 175.4490 103 P 4.2581 0.0000 0.0000 66.0183 31.7463 178.3545 104 Q 4.0348 8.1784 116.5084 56.6686 30.0897 177.4071 105 G 3.6340 7.8029 107.3022 46.5403 0.0000 175.8803 106 I 3.9169 7.6950 121.3325 62.5710 38.0354 177.5625 107 R 4.2580 7.4142 117.6189 58.2701 30.0342 177.4062 108 A 3.9114 7.6344 120.9884 54.2901 18.6652 177.6579 109 W 4.7595 8.1796 116.4098 55.5717 29.8225 177.6429 110 V 3.7822 8.7900 118.0231 64.5114 30.9308 178.2666 111 A 4.0869 8.3285 120.0147 54.9469 18.0956 179.3226 112 W 4.0007 8.3702 126.5220 60.6500 30.5469 178.4940 113 R 3.8759 8.1049 116.7061 59.3351 29.6813 178.3478 114 N 4.3792 8.0961 115.2224 55.5940 38.6747 176.8442 115 R 4.1135 7.8726 116.8507 56.0045 31.5212 176.1692 116 C 4.5776 7.1890 114.2106 57.8993 42.7650 174.2318 117 Q 3.1560 6.6732 119.4910 57.0874 28.7813 175.3504 118 N 4.2237 8.6801 120.0446 54.2759 36.2058 173.9357 119 R 4.5906 7.2848 115.0588 53.9269 33.8165 174.9368 120 D 4.5001 8.5779 119.2926 54.5120 41.1947 176.7657 121 V 4.5676 8.3170 119.1863 61.1316 32.5405 177.5612 122 R 4.0727 8.0411 118.7014 59.2334 28.5409 178.5459 123 Q 3.9278 8.0834 118.1082 59.7031 28.0144 178.3995 124 Y 4.3723 7.5833 116.8875 59.8560 38.2120 177.0779 125 V 4.3918 7.7223 111.0532 60.5488 33.1571 175.5807 126 Q 4.1388 7.5623 118.4240 57.4630 28.6582 177.0814 127 G 3.9350 8.9014 109.1127 46.0287 0.0000 174.4906 128 C 4.4207 7.9909 115.7028 56.8989 40.6707 174.4829 129 G 3.8875 8.3453 107.2758 46.0936 0.0000 174.0062 130 V 4.0052 7.7572 117.9800 61.1085 32.0427 175.7127 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 4.18 0.00 1.87 1.63 0.00 1.30 0.00 0.00 1.11 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.13 7.81 2 V 8.14 4.56 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 0.95 0.00 0.00 3 F 10.00 4.39 0.00 2.81 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 4 E 9.00 4.26 0.00 1.95 1.86 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 2.33 2.24 0.00 5 R 8.93 3.33 0.00 1.94 1.95 0.00 3.42 0.00 0.00 3.48 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 6 C 8.06 4.36 0.00 3.00 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 8.16 3.89 0.00 2.05 2.25 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 2.59 2.42 0.00 8 L 8.07 3.61 0.00 1.36 1.36 -0.13 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.89 3.93 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 10 R 8.17 3.92 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.91 3.86 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 1.20 0.00 0.00 12 L 8.12 3.86 0.00 1.57 1.56 0.91 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.08 3.92 0.00 1.92 1.95 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.49 7.81 14 R 7.90 4.02 0.00 1.81 1.97 0.00 3.36 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.00 15 L 7.44 4.41 0.00 1.65 1.56 0.85 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.77 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 17 M 7.84 3.93 0.00 1.25 1.94 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 2.02 2.21 0.00 18 D 8.04 4.47 0.00 2.68 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 9.45 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 20 Y 8.24 4.26 0.00 3.36 3.17 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 21 R 9.08 3.50 0.00 1.97 1.88 0.00 3.33 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.42 0.00 22 G 8.23 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 23 I 7.54 4.13 1.80 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.70 -0.25 0.00 0.00 24 S 8.33 4.67 0.00 4.12 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 8.77 4.28 0.00 1.85 1.88 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.13 4.15 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.09 4.48 0.00 2.80 2.78 0.00 0.00 7.00 7.57 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 28 W 8.05 4.31 0.00 3.57 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 29 M 8.61 4.17 0.00 2.13 2.37 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 30 C 8.31 3.32 0.00 2.82 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 31 L 8.14 3.97 0.00 1.88 1.89 0.55 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.26 4.13 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 33 K 8.16 2.75 0.00 1.49 1.17 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.42 1.20 7.81 34 W 7.53 4.37 0.00 3.34 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 8.31 4.33 0.00 2.02 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 2.56 2.41 0.00 36 S 7.83 4.51 0.00 4.09 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 37 G 8.41 3.71 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 0.00 0.00 0.00 38 Y 7.10 3.65 0.00 3.28 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 39 N 7.76 5.34 0.00 2.73 2.84 0.00 0.00 7.01 7.13 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 40 T 8.83 3.92 4.42 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 1.44 0.00 0.00 41 R 8.21 4.32 0.00 1.88 2.04 0.00 3.28 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 42 A 7.69 4.33 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 43 T 8.38 5.06 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 1.27 0.00 0.00 44 N 8.80 4.89 0.00 2.89 2.75 0.00 0.00 6.87 6.87 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 45 Y 8.75 4.70 0.00 3.04 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 46 N 8.62 4.73 0.00 2.66 2.61 0.00 0.00 6.54 6.83 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 47 A 8.28 3.58 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 48 G 8.09 3.71 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 0.00 0.00 0.00 49 D 7.64 4.72 0.00 2.71 2.70 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 50 R 8.21 3.97 0.00 2.03 2.19 0.00 3.14 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 51 S 7.77 4.96 0.00 3.93 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 52 T 8.90 5.13 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 0.66 0.00 0.00 53 D 8.97 5.55 0.00 2.73 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 54 Y 9.14 5.03 0.00 2.98 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 9.20 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 56 I 8.30 3.68 1.66 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.71 0.08 0.00 0.00 57 F 7.99 4.74 0.00 3.18 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 58 Q 7.91 3.66 0.00 2.54 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.80 0.00 59 I 8.11 4.44 2.14 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.19 1.12 0.00 0.00 60 N 9.21 5.51 0.00 3.10 3.04 0.00 0.00 6.97 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 61 S 8.98 4.96 0.00 4.07 4.43 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 3.81 0.00 1.59 1.31 0.00 2.70 0.00 0.00 2.81 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 63 Y 7.69 4.14 0.00 1.98 1.67 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 64 W 8.28 4.84 0.00 3.55 3.20 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 65 C 8.32 5.61 0.00 3.15 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 66 N 8.91 5.15 0.00 2.83 2.69 0.00 0.00 7.07 9.03 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 67 D 8.95 4.82 0.00 2.83 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 68 G 8.56 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 69 K 7.97 4.45 0.00 1.91 1.91 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.45 7.81 70 T 7.72 4.50 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 71 P 0.00 4.32 0.00 2.01 1.96 0.00 3.83 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 8.63 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 0.00 0.00 0.00 73 A 7.93 4.25 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 74 V 8.04 3.92 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 0.67 0.00 0.00 0.84 0.00 0.00 75 N 8.03 4.18 0.00 2.91 2.68 0.00 0.00 7.12 8.13 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 76 A 7.91 4.02 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 77 C 8.67 4.56 0.00 3.29 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 78 H 7.85 4.03 0.00 3.30 3.36 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.18 4.74 0.00 1.71 1.51 1.00 0.83 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 80 S 8.51 4.55 0.00 3.83 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 81 C 8.87 4.05 0.00 2.23 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 82 S 7.80 3.89 0.00 4.02 4.09 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 0.00 0.00 0.00 83 A 7.88 4.22 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 7.83 4.50 0.00 1.91 1.81 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.46 5.02 0.00 1.80 1.72 1.13 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.75 4.35 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 D 8.51 4.44 0.00 2.64 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 8.07 4.61 0.00 2.69 2.73 0.00 0.00 6.90 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 8.36 4.30 1.76 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 1.57 0.91 0.97 0.00 0.00 90 A 8.24 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 91 D 8.08 4.31 0.00 2.71 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 92 A 7.99 4.09 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 93 V 8.19 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 0.80 0.00 0.00 0.90 0.00 0.00 94 A 7.98 3.83 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 95 C 8.39 4.24 0.00 3.06 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 96 A 8.29 3.92 0.90 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 97 K 7.75 3.73 0.00 1.63 1.48 0.00 1.32 0.00 0.00 0.94 0.00 0.00 2.30 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 0.95 7.81 98 R 7.82 4.07 0.00 2.01 2.12 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.90 0.00 99 V 7.50 2.48 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 -0.25 0.00 0.00 -0.64 0.00 0.00 100 V 7.42 3.97 2.13 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 1.03 0.00 0.00 1.43 0.00 0.00 101 R 7.68 4.18 0.00 2.06 2.04 0.00 3.23 0.00 0.00 3.38 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.09 0.00 102 D 7.34 4.72 0.00 3.04 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 0.00 103 P 0.00 4.26 0.00 2.02 2.11 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 104 Q 8.18 4.03 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.90 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.80 3.63 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 0.00 0.00 0.00 106 I 7.70 3.92 1.04 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.89 -0.70 0.00 0.00 107 R 7.41 4.26 0.00 2.03 2.05 0.00 3.26 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.48 0.00 108 A 7.63 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.18 4.76 0.00 3.53 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 8.79 3.78 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 0.98 0.00 0.00 1.02 0.00 0.00 111 A 8.33 4.09 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.37 4.00 0.00 3.46 3.47 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 0.00 113 R 8.10 3.88 0.00 2.01 2.00 0.00 3.35 0.00 0.00 3.32 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 8.10 4.38 0.00 2.58 2.74 0.00 0.00 6.96 6.94 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 0.00 115 R 7.87 4.11 0.00 1.48 1.02 0.00 2.21 0.00 0.00 2.42 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.26 0.00 116 C 7.19 4.58 0.00 1.67 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 0.00 117 Q 6.67 3.16 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.80 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 118 N 8.68 4.22 0.00 2.80 2.82 0.00 0.00 6.79 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 7.28 4.59 0.00 1.81 1.76 0.00 3.28 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 120 D 8.58 4.50 0.00 2.63 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 0.00 121 V 8.32 4.57 2.42 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 1.19 0.00 0.00 1.07 0.00 0.00 122 R 8.04 4.07 0.00 2.03 2.23 0.00 2.79 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 123 Q 8.08 3.93 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.93 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 124 Y 7.58 4.37 0.00 3.10 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 7.72 4.39 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 1.01 0.00 0.00 1.05 0.00 0.00 126 Q 7.56 4.14 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.54 2.31 0.00 127 G 8.90 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 7.99 4.42 0.00 3.06 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 8.35 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 0.00 130 V 7.76 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 0.79 0.00 0.00 0.96 0.00 0.00