NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.3756 8.3049 120.3238 54.5545 33.2268 176.7783 3 L 4.3982 8.4546 123.2804 52.1359 44.6496 175.1491 4 T 4.2647 9.6848 113.3690 61.0668 71.7668 175.2735 5 A 4.0564 8.5255 123.5456 54.2477 18.5764 178.7229 6 E 4.3309 7.9148 115.3667 58.0254 30.7877 177.8755 7 E 3.8657 7.9094 119.0914 59.2375 29.5413 179.1933 8 K 3.8093 8.1715 118.2355 59.7306 32.0949 178.9252 9 A 3.9748 7.9871 119.8243 55.1929 18.2752 179.2468 10 A 3.9662 8.0803 119.3730 55.2407 18.2693 180.1631 11 V 3.4004 7.8372 116.5490 66.5270 31.5865 178.3493 12 T 4.1088 8.3602 116.0617 66.7585 68.0379 176.7727 13 G 3.7270 8.3534 107.0672 47.6727 0.0000 175.3742 14 F 4.3927 8.2964 122.9977 60.9838 39.6014 177.0756 15 W 4.2890 9.1685 128.5400 60.5032 30.2763 177.7976 16 G 4.0221 7.9827 104.3826 46.8866 0.0000 173.9605 17 K 4.2043 7.5442 118.3858 56.3453 33.0676 176.9994 18 V 3.4050 7.3035 119.9855 62.2828 32.0579 176.4639 19 K 4.2126 7.7791 126.7197 54.5627 31.0693 177.0794 20 V 3.4515 7.8054 117.2748 64.2548 31.6760 177.4523 21 D 4.3459 7.9387 117.9617 57.6077 40.8179 178.6108 22 E 3.9901 7.9724 118.4431 59.0737 29.5857 179.2857 23 V 3.6670 7.6511 118.4214 65.7020 31.5132 178.3078 24 G 3.5725 8.3452 105.4759 47.8739 0.0000 175.3732 25 A 3.9992 8.0140 123.9776 54.6857 18.2635 179.4325 26 E 3.8149 8.1610 117.3049 59.1901 29.8003 178.6917 27 A 3.9704 8.3577 121.1910 55.1921 18.5975 179.3040 28 L 3.9627 7.9562 118.9335 58.3613 42.2315 178.8400 29 G 3.6701 7.8381 104.9823 48.3716 0.0000 175.5344 30 R 3.8902 8.8714 121.1751 58.3055 30.1135 178.7524 31 L 4.0408 8.0122 120.0671 58.6021 41.8314 179.3250 32 L 4.0046 7.5190 116.7835 57.3940 41.5210 179.5768 33 V 3.6513 7.3096 117.2167 66.0495 31.6745 178.0715 34 V 3.6206 7.9787 116.8033 64.2370 32.6781 175.4030 35 Y 4.1115 7.6758 117.4359 54.3520 37.9494 174.0618 36 P 4.4082 0.0000 0.0000 64.8615 31.4735 177.7329 37 W 4.4104 8.2181 115.4319 59.5659 28.0587 178.2060 38 T 4.2927 7.5444 110.5591 64.5945 68.1362 176.4462 39 Q 4.1954 8.1872 121.3354 58.9627 28.4339 178.5126 40 R 3.7824 7.5719 118.8397 59.8485 30.0736 178.0979 41 F 4.3045 7.9131 114.6892 58.7982 38.9726 175.4677 42 F 5.0562 8.7501 119.0847 56.9785 40.1771 177.2972 43 E 4.1047 8.6464 122.6817 59.7711 29.5957 178.4652 44 H 4.6676 8.5577 111.7683 56.0442 28.3717 175.5424 45 F 4.3933 8.2459 117.0102 57.5557 39.7608 176.5676 46 G 3.8539 7.7057 106.1179 43.7246 0.0000 172.3051 47 D 4.4232 8.6255 118.9536 55.3721 41.3255 177.4320 48 L 4.8758 8.3769 125.4172 54.7066 43.2663 177.6979 49 S 4.3733 8.8247 113.1021 59.1071 63.5850 173.8835 50 S 4.5475 7.5518 115.3730 56.1424 67.0394 175.0794 51 A 3.9285 8.4708 123.4932 55.6685 18.0783 179.5055 52 D 4.3029 8.1319 116.4161 57.4435 40.6718 178.8382 53 A 3.9800 7.6749 119.9785 55.1364 18.5322 179.6123 54 V 3.6522 7.9372 116.7621 66.5802 31.4565 178.2865 55 M 4.0721 8.2696 117.3769 57.7093 31.8546 177.4993 56 N 4.9190 7.9389 113.9085 51.8866 39.5224 174.4769 57 N 4.3281 7.6655 120.7697 53.3712 39.1705 175.2119 58 A 4.0576 8.7299 129.0304 55.1503 18.3800 178.8505 59 K 4.0241 8.2107 117.7821 59.4543 32.3926 179.0569 60 V 3.6097 8.3828 118.7155 65.7770 31.4588 178.2529 61 K 3.9906 8.1232 117.9203 59.0773 31.8456 179.0740 62 A 4.0306 8.1437 121.1008 55.5877 18.2644 179.2503 63 H 4.3272 8.9567 117.2797 59.2266 29.9703 177.2469 64 G 3.9485 8.2083 107.6725 48.1773 0.0000 175.1290 65 K 3.9137 8.0255 122.0272 59.1007 32.0955 178.9314 66 K 4.0582 7.7886 118.5948 59.3981 32.0232 179.5322 67 V 3.6745 8.0997 118.7670 66.1518 31.4772 178.1814 68 L 4.7003 8.3879 118.7683 57.8670 41.4958 179.1423 69 D 4.5560 8.8423 119.8337 57.4180 40.6885 178.9141 70 S 4.1317 8.1020 114.4651 61.8128 62.8969 175.8236 71 F 4.1151 8.3359 120.8550 60.6027 38.4536 177.4098 72 S 4.1113 9.0579 115.8099 62.0984 63.1566 176.5482 73 N 4.5547 8.4419 119.3823 56.6574 38.7680 176.7760 74 G 3.9930 8.3281 107.5389 48.6394 0.0000 175.1033 75 M 4.0285 7.8287 119.7515 57.9298 31.9999 178.3110 76 K 4.2893 7.9767 116.1108 57.1489 33.1147 176.4479 77 H 5.0240 8.6743 117.8542 55.1616 29.8789 175.6708 78 L 4.0943 8.1660 120.8640 57.8123 41.8975 178.9278 79 D 4.4412 8.1237 117.6571 56.3989 41.5641 175.9629 80 D 5.0177 7.9919 117.5604 52.8323 41.5691 176.6013 81 L 4.1231 7.8861 123.1525 58.1770 41.9725 178.5129 82 K 3.8285 8.3043 117.4141 60.5437 32.0924 178.1880 83 G 3.7038 8.0984 104.8621 48.0833 0.0000 175.4589 84 T 3.7554 7.6049 117.1530 65.5705 68.5875 175.7515 85 F 4.4612 7.9167 116.8477 57.4020 39.2952 177.5347 86 A 3.9719 7.5171 121.5906 55.6738 18.2149 179.8609 87 Q 3.8896 7.9218 116.3345 59.2885 29.4084 178.6889 88 L 4.2388 7.8686 119.4344 57.6159 41.5817 179.2311 89 S 4.2459 8.9266 115.5782 60.7579 62.1564 175.7887 90 E 3.8950 8.2113 122.0916 58.6372 29.3447 178.4571 91 L 3.9389 8.1834 120.9393 58.6029 42.2276 178.7986 92 H 4.2514 8.2548 116.0925 59.6366 28.6367 176.4987 93 C 4.6881 7.9570 120.6010 61.0535 27.4750 174.6984 94 D 4.6879 7.5290 119.2446 55.2731 40.3798 176.6750 95 K 4.6297 7.8640 119.8287 57.9520 37.7860 177.5181 96 L 4.1542 8.1480 117.9216 55.9054 42.3025 176.8420 97 H 4.1845 7.7210 115.2291 56.6184 26.6527 175.2873 98 V 3.7644 7.5315 117.2444 61.6306 32.6544 174.7791 99 D 4.2746 8.5759 127.3731 53.1453 41.9460 174.8329 100 P 3.3638 0.0000 0.0000 65.9641 30.6124 177.8875 101 E 3.8538 8.3711 118.9478 59.5911 29.3851 178.6487 102 N 4.3558 8.2554 116.1856 55.5391 38.4593 177.4343 103 F 4.4415 7.4240 119.7895 60.7011 39.0715 177.4364 104 K 3.9665 8.2692 117.4824 59.5972 31.8199 179.1705 105 L 3.8711 7.5406 118.8943 57.7327 41.5529 179.2385 106 L 4.1259 8.0232 120.3929 58.0727 42.0150 178.9551 107 G 3.8898 8.3910 105.7318 48.2737 0.0000 175.3670 108 N 4.4414 8.2916 119.1407 55.8430 38.5613 177.6963 109 V 3.6563 8.3478 120.1550 65.8477 31.5080 177.7910 110 L 3.8417 8.3437 120.4405 58.2775 42.0859 179.1718 111 V 3.4664 7.9259 118.1129 65.8978 31.4076 178.1089 112 V 3.6068 8.2585 118.5810 65.9381 31.2839 178.2514 113 V 3.4646 7.7947 118.0667 65.8185 31.2104 178.0109 114 L 3.7918 7.9939 118.9370 57.4476 41.1752 179.3580 115 A 3.9855 7.3833 120.3944 55.1592 18.1302 179.7304 116 R 3.7786 7.5693 116.0625 59.8586 30.2476 178.2274 117 H 4.3848 8.3204 115.2389 58.0697 28.8725 175.7278 118 H 4.8594 7.9172 115.1999 53.7569 31.8822 174.7259 119 G 3.9010 8.4011 109.9455 46.3643 0.0000 176.7023 120 S 4.4386 8.8225 116.6992 60.3658 63.2119 175.3372 121 E 4.1375 7.9771 122.3854 59.0662 29.6113 177.0641 122 F 4.4375 8.4001 122.8359 56.7126 37.9871 175.4784 123 T 4.0255 7.4413 115.4429 60.2314 71.1127 173.1797 124 P 4.0892 0.0000 0.0000 66.1152 31.0635 178.9498 125 L 3.9393 7.6705 116.8552 57.7532 41.6500 179.4105 126 L 3.8984 7.7788 118.9737 57.4819 41.4797 179.1381 127 Q 3.4146 7.9520 119.6485 59.1549 28.8865 178.1143 128 A 4.0525 7.9049 121.5266 55.4544 17.8334 179.5172 129 E 3.8067 7.8268 116.4829 59.7325 29.5342 179.7038 130 F 4.1777 8.2520 117.6229 60.4006 38.8994 177.7559 131 Q 4.1122 8.7676 118.6883 58.7723 28.5184 178.7162 132 K 4.1656 8.0075 118.8935 58.9613 32.7972 179.5338 133 V 3.5248 7.3836 119.6573 66.1990 31.5583 178.2134 134 V 3.7391 8.1282 112.0107 64.3010 31.3331 178.1862 135 A 4.1049 8.0873 120.6551 55.4270 18.2506 179.9138 136 G 3.5483 8.1298 103.9741 48.0167 0.0000 176.0672 137 V 3.1751 8.2455 120.8231 65.3529 31.4795 178.0011 138 A 3.8445 8.3252 121.0410 55.1959 18.3061 179.3682 139 N 4.3477 8.5357 115.1917 56.4182 38.3690 177.5745 140 A 3.9907 7.4692 120.8428 55.0174 18.7804 179.4170 141 L 3.7901 7.4389 117.3397 57.5213 41.4245 179.5130 142 A 4.6212 8.1552 120.9199 55.1595 18.2409 178.7964 143 H 3.8673 8.1011 116.9226 59.8578 29.6297 176.9624 144 R 3.9251 7.3865 117.5777 58.2003 30.0643 177.4614 145 Y 4.5460 8.1101 116.6975 58.9002 37.9719 175.1897 146 H 4.6319 8.1425 122.8184 55.8452 29.2537 173.7666 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 2 M 8.30 4.38 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 3 L 8.45 4.40 0.00 1.66 1.70 0.79 0.48 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 4 T 9.68 4.26 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 1.24 0.00 0.00 5 A 8.53 4.06 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 6 E 7.91 4.33 0.00 2.19 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 0.00 2.27 2.36 0.00 7 E 7.91 3.87 0.00 2.17 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 2.34 2.33 0.00 8 K 8.17 3.81 0.00 1.83 1.87 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.46 7.81 9 A 7.99 3.97 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 10 A 8.08 3.97 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 11 V 7.84 3.40 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 0.82 0.00 0.00 0.27 0.00 0.00 12 T 8.36 4.11 4.29 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 1.28 0.00 0.00 13 G 8.35 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.30 4.39 0.00 3.38 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.17 4.29 0.00 3.90 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 16 G 7.98 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 0.00 0.00 0.00 17 K 7.54 4.20 0.00 1.40 1.64 0.00 1.54 0.00 0.00 1.51 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.23 7.81 18 V 7.30 3.41 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 0.00 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 19 K 7.78 4.21 0.00 1.62 1.58 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.26 7.81 20 V 7.81 3.45 2.17 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 0.68 0.00 0.00 1.01 0.00 0.00 21 D 7.94 4.35 0.00 2.64 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 22 E 7.97 3.99 0.00 1.88 1.89 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 2.35 2.30 0.00 23 V 7.65 3.67 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 0.82 0.00 0.00 0.73 0.00 0.00 24 G 8.35 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.01 4.00 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 26 E 8.16 3.81 0.00 2.22 1.93 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 2.26 2.29 0.00 27 A 8.36 3.97 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 28 L 7.96 3.96 0.00 1.77 1.60 0.82 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.84 3.67 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 0.00 0.00 0.00 30 R 8.87 3.89 0.00 1.80 1.97 0.00 3.11 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 31 L 8.01 4.04 0.00 1.87 1.90 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.52 4.00 0.00 1.74 1.65 0.64 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.31 3.65 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 0.72 0.00 0.00 0.95 0.00 0.00 34 V 7.98 3.62 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 -0.15 0.00 0.00 0.80 0.00 0.00 35 Y 7.68 4.11 0.00 2.48 1.43 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 36 P 0.00 4.41 0.00 2.25 2.12 0.00 3.62 0.00 0.00 3.75 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 37 W 8.22 4.41 0.00 3.56 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.54 4.29 4.40 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 1.00 0.00 0.00 39 Q 8.19 4.20 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 40 R 7.57 3.78 0.00 1.77 1.85 0.00 3.14 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.58 0.00 41 F 7.91 4.30 0.00 2.61 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 42 F 8.75 5.06 0.00 2.75 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 0.00 0.00 0.00 0.00 43 E 8.65 4.10 0.00 2.14 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 2.46 2.60 0.00 44 H 8.56 4.67 0.00 3.29 3.44 0.00 5.50 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.25 4.39 0.00 3.16 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 46 G 7.71 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 47 D 8.63 4.42 0.00 2.67 2.65 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 48 L 8.38 4.88 0.00 1.72 1.57 1.01 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.82 4.37 0.00 3.97 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 0.00 50 S 7.55 4.55 0.00 4.10 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 51 A 8.47 3.93 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 52 D 8.13 4.30 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.67 3.98 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 54 V 7.94 3.65 2.17 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 0.99 0.00 0.00 0.96 0.00 0.00 55 M 8.27 4.07 0.00 1.97 2.09 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 2.60 2.86 0.00 56 N 7.94 4.92 0.00 2.77 2.84 0.00 0.00 6.96 7.62 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 57 N 7.67 4.33 0.00 2.92 2.85 0.00 0.00 7.03 8.60 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 58 A 8.73 4.06 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 59 K 8.21 4.02 0.00 1.90 2.15 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.59 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.03 1.68 7.81 60 V 8.38 3.61 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 0.83 0.00 0.00 61 K 8.12 3.99 0.00 2.07 1.84 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.45 7.81 62 A 8.14 4.03 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 63 H 8.96 4.33 0.00 3.58 3.45 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 64 G 8.21 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.03 3.91 0.00 1.89 2.04 0.00 1.85 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.74 7.81 66 K 7.79 4.06 0.00 1.99 1.88 0.00 1.85 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.66 7.81 67 V 8.10 3.67 2.39 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 1.37 0.00 0.00 1.01 0.00 0.00 68 L 8.39 4.70 0.00 1.85 1.88 1.03 0.95 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 69 D 8.84 4.56 0.00 2.78 2.79 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 70 S 8.10 4.13 0.00 3.97 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 71 F 8.34 4.12 0.00 3.58 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 72 S 9.06 4.11 0.00 4.18 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 0.00 73 N 8.44 4.55 0.00 3.02 2.85 0.00 0.00 7.07 7.23 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 74 G 8.33 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 0.00 0.00 0.00 0.00 75 M 7.83 4.03 0.00 1.74 2.12 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 2.42 0.00 76 K 7.98 4.29 0.00 1.83 1.68 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.63 7.81 77 H 8.67 5.02 0.00 3.04 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.17 4.09 0.00 1.60 1.71 0.87 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.12 4.44 0.00 2.66 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 7.99 5.02 0.00 2.72 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.89 4.12 0.00 1.74 1.76 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.30 3.83 0.00 1.70 1.79 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.33 1.39 7.81 83 G 8.10 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 0.00 0.00 0.00 84 T 7.60 3.76 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 0.77 0.00 0.00 85 F 7.92 4.46 0.00 3.11 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 86 A 7.52 3.97 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 87 Q 7.92 3.89 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 88 L 7.87 4.24 0.00 2.03 1.85 0.99 0.85 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 89 S 8.93 4.25 0.00 4.02 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 90 E 8.21 3.89 0.00 2.14 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 0.00 2.25 2.42 0.00 91 L 8.18 3.94 0.00 1.77 1.72 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.25 4.25 0.00 3.35 3.56 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.96 4.69 0.00 2.59 1.93 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 94 D 7.53 4.69 0.00 2.82 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 95 K 7.86 4.63 0.00 1.63 1.98 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.42 7.81 96 L 8.15 4.15 0.00 1.90 1.78 0.84 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.72 4.18 0.00 3.45 3.45 0.00 5.65 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.53 3.76 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 0.30 0.00 0.00 0.33 0.00 0.00 99 D 8.58 4.27 0.00 2.65 2.45 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 0.00 100 P 0.00 3.36 0.00 2.30 2.47 0.00 3.38 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 101 E 8.37 3.85 0.00 2.08 2.01 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 2.29 2.40 0.00 102 N 8.26 4.36 0.00 2.55 2.77 0.00 0.00 6.99 8.17 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 0.00 103 F 7.42 4.44 0.00 3.17 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 0.00 104 K 8.27 3.97 0.00 2.02 1.91 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.60 7.81 105 L 7.54 3.87 0.00 1.68 1.35 0.72 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.02 4.13 0.00 1.87 1.82 1.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.39 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 0.00 108 N 8.29 4.44 0.00 2.99 2.95 0.00 0.00 6.71 7.23 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 0.00 109 V 8.35 3.66 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 1.07 0.00 0.00 1.17 0.00 0.00 110 L 8.34 3.84 0.00 1.82 1.77 -0.14 0.70 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 0.00 111 V 7.93 3.47 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 1.21 0.00 0.00 1.11 0.00 0.00 112 V 8.26 3.61 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 0.91 0.00 0.00 1.02 0.00 0.00 113 V 7.79 3.46 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 1.00 0.00 0.00 0.90 0.00 0.00 114 L 7.99 3.79 0.00 0.79 0.80 0.60 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.38 3.99 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 0.00 116 R 7.57 3.78 0.00 1.74 1.89 0.00 3.20 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 117 H 8.32 4.38 0.00 3.10 3.05 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 7.92 4.86 0.00 3.48 3.50 0.00 5.96 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.40 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 0.00 120 S 8.82 4.44 0.00 4.03 4.05 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 0.00 121 E 7.98 4.14 0.00 2.08 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 0.00 2.52 2.64 0.00 122 F 8.40 4.44 0.00 2.98 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 0.00 123 T 7.44 4.03 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 1.30 0.00 0.00 124 P 0.00 4.09 0.00 2.11 2.11 0.00 3.53 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 125 L 7.67 3.94 0.00 1.61 1.65 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.78 3.90 0.00 1.42 1.52 0.98 0.56 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 0.00 127 Q 7.95 3.41 0.00 1.27 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 128 A 7.90 4.05 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 0.00 129 E 7.83 3.81 0.00 2.01 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 2.51 2.39 0.00 130 F 8.25 4.18 0.00 3.39 3.25 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 0.00 131 Q 8.77 4.11 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 132 K 8.01 4.17 0.00 1.94 2.06 0.00 1.29 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.50 7.81 133 V 7.38 3.52 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 1.05 0.00 0.00 0.82 0.00 0.00 134 V 8.13 3.74 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.11 0.00 0.00 135 A 8.09 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 0.00 136 G 8.13 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 0.00 137 V 8.25 3.18 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 0.23 0.00 0.00 0.78 0.00 0.00 138 A 8.33 3.84 1.48 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 0.00 0.00 139 N 8.54 4.35 0.00 2.92 2.89 0.00 0.00 6.93 7.67 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 0.00 140 A 7.47 3.99 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 0.00 141 L 7.44 3.79 0.00 0.37 0.20 0.10 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.16 4.62 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 0.00 0.00 143 H 8.10 3.87 0.00 3.44 3.46 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.39 3.93 0.00 1.45 1.80 0.00 3.37 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.88 0.00 145 Y 8.11 4.55 0.00 2.96 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 0.00 146 H 8.14 4.63 0.00 3.04 3.14 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00