NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3252 8.3449 121.7118 56.1151 30.2530 174.0939 6 T 4.6598 8.0980 119.8073 60.7403 72.1436 171.9009 7 M 4.1765 8.8897 126.4156 55.3063 33.1418 175.4468 8 K 3.9624 8.7108 128.7892 56.8213 33.1593 176.6615 9 G 3.8673 8.9086 115.3678 46.2207 0.0000 173.0697 10 L 4.0324 8.0939 121.3641 54.8131 42.6633 175.9806 11 D 4.7775 9.0527 126.3298 52.2579 40.7405 176.3023 12 I 3.9116 8.2960 127.7592 63.7030 38.6833 178.1000 13 Q 4.0711 8.3600 119.4562 58.6615 28.5746 177.7848 14 K 4.2259 7.9570 114.9617 57.0698 32.0513 177.6015 15 V 4.5999 7.5721 111.3824 60.9324 32.0067 176.1470 16 A 4.2965 7.4206 123.3566 52.8775 18.9086 176.7039 17 G 3.7627 8.3359 106.7994 43.6243 0.0000 172.8619 18 T 4.5239 7.9803 116.4125 63.3260 68.8593 174.5587 19 W 5.2711 8.4421 124.2950 55.1551 33.7041 174.1509 20 Y 4.7460 9.4029 118.4983 56.2753 41.2343 175.4039 21 S 4.7357 9.2037 120.6890 58.7500 62.5802 173.7036 22 L 4.6251 9.4021 129.0341 57.1670 43.4223 176.1942 23 A 5.1257 7.6423 118.2168 50.8947 22.7273 175.0035 24 M 5.3911 8.8917 115.9670 54.1138 35.3760 173.7693 25 A 5.2273 9.1398 120.2614 50.8591 23.3170 175.0708 26 A 5.1635 8.7428 120.8575 50.2268 22.6293 177.5786 27 S 4.7497 8.9565 114.9136 59.8371 64.1424 174.2838 28 D 4.8842 7.9140 120.0449 51.8499 43.2518 175.8421 29 I 3.7118 8.7354 128.0582 64.6946 37.2186 178.1379 30 S 4.1473 7.8785 112.4847 61.1616 62.9458 175.7536 31 L 4.1626 8.3040 121.5656 56.9100 41.4394 178.4460 32 L 4.6914 7.9185 115.2270 54.0045 43.8377 176.5018 33 D 4.1810 8.1037 118.2089 55.1916 41.8622 174.6910 34 A 4.0036 8.6976 129.1743 51.7669 18.2454 178.5599 35 Q 4.1027 8.4105 118.7829 58.8028 28.9288 178.3653 36 S 4.3556 7.9471 110.7902 59.7842 63.4600 174.2044 37 A 4.0549 7.6019 124.5251 51.7658 18.6384 176.7548 38 P 4.2895 0.0000 0.0000 65.1705 31.5715 177.3630 39 L 4.5916 7.6171 115.8301 54.3725 41.9435 177.6332 40 R 4.1801 7.3588 121.5060 54.9298 28.2592 175.4354 41 V 4.5947 7.2214 112.8715 59.0308 35.8759 174.6344 42 Y 4.6949 8.7099 121.0465 55.9856 40.5435 175.3537 43 V 4.0455 8.6035 125.9311 63.4621 31.7923 175.2066 44 E 4.3821 9.5064 127.9271 58.0582 31.2580 175.6848 45 E 5.0923 7.8371 117.9857 54.9353 33.6512 173.3766 46 L 5.0422 9.0509 125.1610 52.9923 44.7936 175.6360 47 K 4.9120 9.2077 124.4869 53.5609 34.1517 173.9669 48 P 4.8823 0.0000 0.0000 62.8077 32.3617 176.2093 49 T 4.5490 8.7319 112.6907 59.8353 70.4825 174.0373 50 P 4.2105 0.0000 0.0000 65.9443 31.2460 177.1652 51 E 4.0827 8.0963 115.9288 57.0744 29.5260 177.3045 52 G 3.9382 8.4265 107.7344 45.4114 0.0000 173.2441 53 D 4.9709 8.0126 120.4124 53.0671 43.4878 175.1057 54 L 4.7423 8.6280 120.7532 53.5864 45.4024 174.3943 55 E 4.9188 9.0163 128.2725 54.9336 31.3194 174.2836 56 I 4.7836 8.9928 127.7252 59.0498 40.8922 173.5027 57 L 5.1897 8.9782 132.2493 53.3956 44.2871 175.0459 58 L 5.2440 9.2394 125.3629 54.7465 44.8652 174.3699 59 Q 5.3016 9.2301 118.1208 54.1360 31.7395 175.0814 60 K 4.9873 9.1431 123.7411 54.4181 36.2353 174.7503 61 W 4.5898 9.1540 135.0000 57.4738 30.7997 173.7230 62 E 4.6499 9.0813 125.1584 57.4511 31.6182 176.4911 63 N 4.8133 6.9707 116.4029 51.8795 38.7533 175.0948 64 G 3.9057 8.3135 105.8663 45.1579 0.0000 170.4017 65 E 4.0249 6.6069 116.4328 54.3528 32.7826 173.7453 66 C 4.7293 8.0662 119.4817 55.1495 42.3288 172.8277 67 A 4.4106 8.9326 128.9766 51.4599 19.8658 175.4352 68 Q 5.0715 8.4939 120.1932 54.2587 31.4610 174.9514 69 K 4.7601 9.3767 125.1785 54.3812 36.2933 174.8554 70 K 5.0348 8.6685 124.0235 54.6999 34.7625 175.1113 71 I 4.6296 8.7671 127.4097 59.5501 41.0400 174.3229 72 I 4.6670 8.4573 126.8361 59.8365 38.5691 174.7171 73 A 4.8179 9.3324 131.0880 50.3337 20.9796 175.5007 74 E 4.9622 9.4449 123.6765 55.3172 31.0335 176.8275 75 K 4.3430 9.2575 124.0175 57.4013 33.7165 176.1054 76 T 4.7859 7.5404 110.8094 59.9847 71.4363 173.4509 77 K 4.0280 8.7825 118.9838 58.2703 32.7216 176.9812 78 I 4.2543 7.3756 121.0677 58.7870 37.8013 174.7490 79 P 3.9821 0.0000 0.0000 65.1061 31.4593 177.0780 80 A 4.5808 7.8203 118.5789 51.7850 19.2453 175.7274 81 V 4.9212 7.1801 116.6359 61.3418 33.9602 174.9741 82 F 5.0305 9.1578 124.8688 55.7358 43.8136 173.6092 83 K 5.2596 9.4065 121.0436 55.0233 34.2892 175.7197 84 I 4.8517 8.4809 116.6386 59.2983 41.5811 173.6271 85 D 5.2457 8.3738 121.2428 51.4770 40.4342 173.9235 86 A 4.5196 8.9559 122.8766 51.7721 22.8279 176.7458 87 L 3.7782 9.1545 118.8344 55.9019 39.1272 174.9736 88 N 4.2717 8.4611 111.6226 54.0353 36.2326 173.8170 89 E 4.7908 8.1225 118.2255 54.8820 31.9025 175.8897 90 N 5.9717 8.7259 116.2198 51.3351 39.5529 173.4541 91 K 5.1503 7.9401 120.1893 55.1350 36.4700 174.5644 92 V 5.0025 8.8668 125.6088 61.1028 34.6566 173.9680 93 L 5.3259 9.4034 127.6511 52.9857 44.8632 175.5099 94 V 4.3179 9.2289 124.7474 62.1300 32.1085 176.4128 95 L 4.3535 9.1431 129.4720 57.3281 42.4459 176.8788 96 D 4.4327 7.6530 114.6574 54.5397 44.3569 175.0307 97 T 3.9183 8.0301 114.6730 61.4423 69.9178 172.6349 98 D 4.5547 7.1523 125.0898 52.6343 40.2306 177.4646 99 Y 4.1481 7.7346 122.3460 59.1570 37.5060 171.0095 100 K 4.2209 8.8125 118.0804 58.4455 32.6814 176.7328 101 K 4.6715 9.5816 117.7483 57.4830 34.0863 175.6161 102 Y 5.9175 7.9720 115.3840 55.5576 42.4696 173.0112 103 L 4.5400 8.8456 120.1904 53.7505 46.0737 173.8517 104 L 5.4791 9.1951 126.5816 53.0475 44.6987 175.5027 105 F 5.4408 8.6591 116.8745 55.9659 41.9779 172.4526 106 C 5.3180 9.5157 116.1968 55.5838 45.7307 173.1029 107 M 5.3976 9.0190 120.7887 54.1647 35.4839 174.3350 108 E 5.1071 8.6606 119.6646 55.8343 34.4487 173.7910 109 N 5.0504 9.1700 123.2510 51.7886 39.5851 175.3961 110 S 4.0970 9.4775 123.1577 61.3994 63.0700 176.1319 111 A 4.1475 8.1094 123.3335 54.8593 18.1678 177.6459 112 E 4.7370 8.3438 116.3716 54.0903 31.1542 173.1334 113 P 4.2963 0.0000 0.0000 65.2569 32.0651 178.5503 114 E 3.9885 8.3518 115.7202 59.2277 29.3671 177.9586 115 Q 4.6723 7.5126 115.4486 55.4348 29.1394 176.1929 116 S 4.6537 8.0193 110.3364 58.3827 67.3758 173.7126 117 L 4.5007 7.9016 123.0867 55.2720 42.9173 175.9389 118 V 4.9086 8.9143 125.9138 60.1965 34.5178 174.0019 119 C 5.3320 9.4275 121.5549 55.2129 39.2834 172.9922 120 Q 4.8056 8.6051 119.3095 54.2328 33.4061 173.7014 121 C 4.6028 8.4449 122.1417 57.7176 33.6081 172.5546 122 L 5.4870 8.9759 126.8784 53.3465 44.1979 176.1395 123 V 5.3884 9.0971 114.7528 59.8870 35.3846 177.0861 124 R 3.6740 9.1827 123.0085 58.4581 30.3262 177.3673 125 T 4.5953 7.7738 106.9163 58.9618 71.7972 172.4889 126 P 4.1101 0.0000 0.0000 62.4202 30.3522 175.3470 127 E 4.7084 7.3623 116.6451 54.7545 33.4463 176.5849 128 V 3.7997 8.2493 121.0360 61.2498 32.4057 175.6296 129 D 4.7864 8.4782 124.0368 52.4240 42.7669 176.1441 130 D 4.4139 8.5711 128.2112 56.8546 40.9026 178.3856 131 E 3.7917 8.0988 119.6325 59.0883 29.7293 178.2114 132 A 3.3350 7.9818 120.7727 55.2779 18.4273 179.6870 133 L 3.9983 7.9747 117.2067 57.6632 41.4573 179.3235 134 E 3.8482 8.4680 119.7308 59.3008 29.6361 178.8244 135 K 3.8463 8.3428 118.7572 59.5161 32.2239 178.9595 136 F 4.3129 8.3671 120.7238 61.6627 39.1044 176.9577 137 D 4.1679 7.8908 117.0424 57.1301 40.8285 178.7104 138 K 4.0593 7.8790 118.8302 59.2889 31.8512 179.0868 139 A 4.0218 7.8488 120.0192 54.8093 18.2679 178.6788 140 L 4.3286 7.0080 114.5813 54.5439 41.9144 178.0098 141 K 3.9798 7.8435 120.7313 58.7547 32.9247 177.6825 142 A 4.5915 7.8585 119.9834 51.4654 19.2825 175.7148 143 L 4.7504 7.4701 116.9453 53.2281 45.2193 175.3445 144 P 4.5302 0.0000 0.0000 61.9119 30.3052 175.6702 145 M 4.6307 7.4802 118.5014 56.3165 32.9939 176.5376 146 H 4.8020 8.9807 119.9990 55.6732 30.4986 174.4557 147 I 4.6482 7.4047 118.9189 59.6042 41.4993 173.5131 148 R 5.1850 8.5534 126.8655 54.5015 33.9371 174.4854 149 L 4.8772 9.0631 122.8196 52.8205 45.8394 175.6855 150 S 4.7876 8.1734 116.1059 56.6291 65.8386 173.4795 151 F 4.8839 8.7835 122.0349 56.3618 41.0806 175.0110 152 N 4.9548 8.6421 117.0076 51.4429 40.4016 174.8025 153 P 4.2566 0.0000 0.0000 65.9824 31.3147 178.9848 154 T 3.8593 7.9590 114.1118 67.0991 68.4967 176.4529 155 Q 4.0807 8.0178 118.6485 58.4154 28.5177 178.7055 156 L 4.0728 7.9303 120.3332 57.7585 41.7972 178.8302 157 E 4.1872 8.2357 117.7935 59.1582 29.4764 179.0312 158 E 3.9589 7.8934 117.7097 59.9788 29.7537 176.4551 159 Q 3.3310 8.5221 116.8564 55.0259 28.2673 173.0133 160 C 4.1225 7.0587 124.5064 56.7934 44.7716 173.9085 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 5 Q 8.34 4.33 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 6 T 8.10 4.66 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 1.22 0.00 0.00 7 M 8.89 4.18 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 8 K 8.71 3.96 0.00 1.82 1.72 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 9 G 8.91 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 10 L 8.09 4.03 0.00 1.66 1.66 1.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 11 D 9.05 4.78 0.00 2.71 2.44 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 12 I 8.30 3.91 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.08 1.01 0.00 0.00 13 Q 8.36 4.07 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.34 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 14 K 7.96 4.23 0.00 1.31 1.45 0.00 0.79 0.00 0.00 1.31 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.27 1.28 7.81 15 V 7.57 4.60 2.15 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 0.87 0.00 0.00 0.98 0.00 0.00 16 A 7.42 4.30 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 17 G 8.34 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.98 4.52 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 0.89 0.00 0.00 19 W 8.44 5.27 0.00 3.01 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 20 Y 9.40 4.75 0.00 3.01 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 21 S 9.20 4.74 0.00 4.14 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 22 L 9.40 4.63 0.00 1.83 1.78 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.64 5.13 1.04 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 24 M 8.89 5.39 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.68 0.00 25 A 9.14 5.23 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 26 A 8.74 5.16 1.22 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 0.00 0.00 27 S 8.96 4.75 0.00 3.97 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 28 D 7.91 4.88 0.00 2.65 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.74 3.71 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.42 0.91 0.00 0.00 30 S 7.88 4.15 0.00 3.99 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 31 L 8.30 4.16 0.00 1.78 1.76 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.92 4.69 0.00 1.56 1.66 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.10 4.18 0.00 2.77 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 34 A 8.70 4.00 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 35 Q 8.41 4.10 0.00 1.67 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.19 0.00 0.00 0.00 0.00 0.00 2.30 2.01 0.00 36 S 7.95 4.36 0.00 4.06 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.60 4.05 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 38 P 0.00 4.29 0.00 2.21 2.22 0.00 3.88 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 39 L 7.62 4.59 0.00 1.77 1.69 0.98 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.36 4.18 0.00 1.76 2.03 0.00 3.29 0.00 0.00 3.48 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.54 0.00 41 V 7.22 4.59 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 0.79 0.00 0.00 0.98 0.00 0.00 42 Y 8.71 4.69 0.00 2.95 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 43 V 8.60 4.05 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 0.72 0.00 0.00 1.01 0.00 0.00 44 E 9.51 4.38 0.00 2.01 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 2.21 2.24 0.00 45 E 7.84 5.09 0.00 1.98 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 2.29 2.40 0.00 46 L 9.05 5.04 0.00 1.84 1.56 0.66 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 47 K 9.21 4.91 0.00 1.58 1.70 0.00 1.65 0.00 0.00 1.90 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.33 7.81 48 P 0.00 4.88 0.00 2.09 2.04 0.00 3.77 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 2.00 2.13 0.00 49 T 8.73 4.55 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 1.20 0.00 0.00 50 P 0.00 4.21 0.00 2.20 2.24 0.00 3.76 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 1.99 2.00 0.00 51 E 8.10 4.08 0.00 2.00 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 0.00 2.32 2.26 0.00 52 G 8.43 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 53 D 8.01 4.97 0.00 2.66 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 54 L 8.63 4.74 0.00 1.18 0.86 0.73 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.02 4.92 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 56 I 8.99 4.78 1.65 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.39 0.78 0.00 0.00 57 L 8.98 5.19 0.00 1.73 1.59 0.95 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 58 L 9.24 5.24 0.00 1.89 1.73 0.95 0.70 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 59 Q 9.23 5.30 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.98 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 60 K 9.14 4.99 0.00 1.86 1.63 0.00 1.59 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.53 7.81 61 W 9.15 4.59 0.00 3.43 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 62 E 9.08 4.65 0.00 1.87 1.90 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 2.29 2.24 0.00 63 N 6.97 4.81 0.00 2.62 2.55 0.00 0.00 6.96 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 64 G 8.31 3.91 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 0.00 0.00 0.00 65 E 6.61 4.02 0.00 1.83 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 2.10 1.97 0.00 66 C 8.07 4.73 0.00 2.88 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 67 A 8.93 4.41 1.19 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 0.00 0.00 0.00 0.00 0.00 68 Q 8.49 5.07 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.67 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 69 K 9.38 4.76 0.00 1.62 1.63 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.51 7.81 70 K 8.67 5.03 0.00 1.71 1.64 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.40 7.81 71 I 8.77 4.63 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.67 0.88 0.00 0.00 72 I 8.46 4.67 1.87 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 1.26 0.80 0.91 0.00 0.00 73 A 9.33 4.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 9.44 4.96 0.00 2.06 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 2.34 2.29 0.00 75 K 9.26 4.34 0.00 1.65 2.17 0.00 1.55 0.00 0.00 2.04 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.65 1.38 7.81 76 T 7.54 4.79 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 1.13 0.00 0.00 77 K 8.78 4.03 0.00 1.73 1.87 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.37 7.81 78 I 7.38 4.25 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.39 0.86 0.00 0.00 79 P 0.00 3.98 0.00 2.02 2.12 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 80 A 7.82 4.58 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 81 V 7.18 4.92 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 0.79 0.00 0.00 0.90 0.00 0.00 82 F 9.16 5.03 0.00 3.03 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 83 K 9.41 5.26 0.00 1.70 1.73 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.38 7.81 84 I 8.48 4.85 1.89 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 1.16 1.13 0.98 0.00 0.00 85 D 8.37 5.25 0.00 2.64 2.57 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 86 A 8.96 4.52 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 87 L 9.15 3.78 0.00 1.83 1.79 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.46 4.27 0.00 2.89 2.92 0.00 0.00 7.02 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.12 4.79 0.00 2.12 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 90 N 8.73 5.97 0.00 2.75 2.98 0.00 0.00 6.27 6.66 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 91 K 7.94 5.15 0.00 1.83 1.66 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.46 7.81 92 V 8.87 5.00 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 0.93 0.00 0.00 0.96 0.00 0.00 93 L 9.40 5.33 0.00 1.60 1.59 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 94 V 9.23 4.32 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 0.94 0.00 0.00 1.08 0.00 0.00 95 L 9.14 4.35 0.00 1.75 1.76 1.04 1.04 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 96 D 7.65 4.43 0.00 2.81 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 97 T 8.03 3.92 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 0.43 0.00 0.00 98 D 7.15 4.55 0.00 2.97 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 99 Y 7.73 4.15 0.00 3.23 3.35 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 0.00 100 K 8.81 4.22 0.00 1.79 1.92 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.65 7.81 101 K 9.58 4.67 0.00 1.88 2.36 0.00 1.98 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.60 1.49 7.81 102 Y 7.97 5.92 0.00 3.27 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 0.00 103 L 8.85 4.54 0.00 0.72 0.68 0.23 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 104 L 9.20 5.48 0.00 1.71 1.72 1.12 0.89 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 0.00 105 F 8.66 5.44 0.00 3.23 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 0.00 106 C 9.52 5.32 0.00 2.87 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 0.00 107 M 9.02 5.40 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.63 0.00 108 E 8.66 5.11 0.00 2.04 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 2.18 2.21 0.00 109 N 9.17 5.05 0.00 2.92 2.69 0.00 0.00 7.29 7.84 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 0.00 110 S 9.48 4.10 0.00 3.99 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.11 4.15 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 0.00 112 E 8.34 4.74 0.00 2.01 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 113 P 0.00 4.30 0.00 2.21 2.27 0.00 3.67 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 2.12 2.13 0.00 114 E 8.35 3.99 0.00 2.15 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 2.32 2.41 0.00 115 Q 7.51 4.67 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 116 S 8.02 4.65 0.00 3.85 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 7.90 4.50 0.00 1.96 1.53 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.91 4.91 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 0.83 0.00 0.00 0.89 0.00 0.00 119 C 9.43 5.33 0.00 2.90 3.12 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 0.00 120 Q 8.61 4.81 0.00 1.09 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.71 0.00 0.00 0.00 0.00 0.00 2.12 1.93 0.00 121 C 8.44 4.60 0.00 1.61 2.20 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 0.00 122 L 8.98 5.49 0.00 1.51 1.81 0.65 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.10 5.39 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 0.92 0.00 0.00 1.24 0.00 0.00 124 R 9.18 3.67 0.00 1.52 1.67 0.00 2.60 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.48 0.00 125 T 7.77 4.60 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 1.18 0.00 0.00 126 P 0.00 4.11 0.00 1.85 1.01 0.00 3.49 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 127 E 7.36 4.71 0.00 1.91 1.83 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 2.14 2.18 0.00 128 V 8.25 3.80 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 0.69 0.00 0.00 0.94 0.00 0.00 129 D 8.48 4.79 0.00 2.82 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 0.00 130 D 8.57 4.41 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.10 3.79 0.00 2.01 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 0.00 2.26 2.34 0.00 132 A 7.98 3.34 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 0.00 133 L 7.97 4.00 0.00 1.88 1.76 0.98 0.65 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 0.00 134 E 8.47 3.85 0.00 2.29 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 2.28 2.38 0.00 135 K 8.34 3.85 0.00 1.81 1.81 0.00 1.52 0.00 0.00 1.39 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.48 7.81 136 F 8.37 4.31 0.00 3.12 3.21 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 0.00 0.00 0.00 0.00 137 D 7.89 4.17 0.00 2.82 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 0.00 138 K 7.88 4.06 0.00 1.89 1.83 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.42 7.81 139 A 7.85 4.02 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 0.00 140 L 7.01 4.33 0.00 1.45 1.42 0.32 -0.02 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 0.00 141 K 7.84 3.98 0.00 1.83 2.00 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.34 7.81 142 A 7.86 4.59 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 0.00 143 L 7.47 4.75 0.00 1.52 1.50 0.89 1.04 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 0.00 144 P 0.00 4.53 0.00 2.24 2.21 0.00 3.66 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 2.04 1.97 0.00 145 M 7.48 4.63 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 146 H 8.98 4.80 0.00 3.10 3.32 0.00 5.84 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.40 4.65 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.29 0.97 0.00 0.00 148 R 8.55 5.18 0.00 1.64 1.76 0.00 3.14 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 149 L 9.06 4.88 0.00 1.19 1.09 1.00 0.85 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 0.00 150 S 8.17 4.79 0.00 3.73 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 0.00 151 F 8.78 4.88 0.00 3.06 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 0.00 152 N 8.64 4.95 0.00 2.85 2.76 0.00 0.00 6.83 8.07 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 0.00 153 P 0.00 4.26 0.00 2.14 2.20 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 154 T 7.96 3.86 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 155 Q 8.02 4.08 0.00 2.44 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.24 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 156 L 7.93 4.07 0.00 1.71 1.66 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 157 E 8.24 4.19 0.00 1.91 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 2.26 2.45 0.00 158 E 7.89 3.96 0.00 2.12 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 2.32 2.37 0.00 159 Q 8.52 3.33 0.00 2.03 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.64 2.45 0.00 160 C 7.06 4.12 0.00 2.05 2.87 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