NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 K 4.1712 8.1733 119.9763 56.8536 34.7220 177.5808 17 D 4.3289 7.7328 119.3989 54.2129 40.9710 176.9936 18 Q 3.9084 8.7268 121.5170 59.4979 29.4865 177.7574 19 M 3.6712 7.6608 118.9283 58.2053 31.9174 178.2215 20 E 4.0715 7.7505 119.4690 59.7300 29.8389 178.8362 21 T 3.9392 8.1554 113.1234 64.9859 67.3765 176.2537 22 S 4.1839 8.4054 117.6382 62.1270 62.8881 175.7677 23 Y 4.1281 8.3513 122.3046 60.8297 38.6243 178.4582 24 V 3.5371 8.5627 120.3950 64.6246 31.2604 178.3591 25 S 4.1554 8.3225 114.0692 61.3307 62.3176 175.8773 26 L 3.9598 8.0507 123.0970 57.9101 41.7973 178.8165 27 K 3.8079 8.2381 120.3316 59.5026 31.8852 178.9521 28 T 4.0979 7.7310 110.2269 64.0409 69.1686 175.7702 29 W 4.4422 7.9637 131.7760 60.2968 30.4402 177.8558 30 I 3.1392 7.5027 117.9127 64.3051 36.4785 177.7000 31 E 4.0110 8.0444 119.3055 58.8560 30.0854 177.9378 32 D 4.8342 7.4953 118.8443 52.4298 39.0629 175.9242 33 S 4.5420 6.5889 112.1660 54.9467 66.9436 174.5392 34 L 3.9279 8.4388 122.3549 55.8198 43.4785 177.9493 35 D 4.1077 8.6021 124.8222 57.3356 40.5712 178.7688 36 L 3.7432 7.6139 119.6278 57.2628 42.1864 177.8713 37 F 4.9993 7.3275 115.7845 58.0202 40.3686 177.5795 38 K 3.8607 8.5257 120.3603 59.4892 31.6947 178.1978 39 N 4.3022 7.9727 115.8429 56.5811 38.5936 176.4749 40 D 4.6506 7.8506 117.5642 55.7202 41.4783 177.7179 41 L 4.6063 7.6200 118.5070 55.8480 43.0074 178.2428 42 L 4.0227 7.9373 119.1586 57.4744 41.4215 177.5304 43 P 4.5283 0.0000 0.0000 64.6473 31.4762 177.3414 44 L 4.3743 8.0423 119.0054 56.5906 42.1598 178.4681 45 L 4.1649 8.0142 119.4589 58.3842 41.5915 178.0387 46 Y 4.1204 8.3188 119.0900 60.6274 38.6095 176.3724 47 P 4.0091 0.0000 0.0000 65.6018 31.3288 178.1324 48 L 4.0199 7.8055 120.3533 58.0182 42.1372 178.1520 49 F 4.0282 8.9079 120.8883 61.7765 39.2325 176.9915 50 I 2.9729 7.7186 118.7666 64.6488 36.8276 178.2869 51 H 4.1021 8.1403 116.7814 58.8334 28.4953 177.9643 52 I 3.7408 7.7762 123.0609 63.6876 36.7875 177.9040 53 Y 4.0804 7.5849 120.1925 60.8403 38.6554 178.1161 54 F 4.3564 7.9612 118.7039 60.6382 38.8340 177.4630 55 D 4.3899 8.2895 118.6262 57.2531 40.7244 178.7666 56 L 3.9007 7.9289 119.4767 57.8830 41.5818 179.6819 57 I 3.6205 7.6674 119.6610 64.3834 36.8241 178.2670 58 Q 4.0832 8.4568 119.0921 58.1613 28.8898 176.9978 59 Q 4.3805 7.4827 117.0749 55.1238 29.0140 175.6045 60 N 4.2731 8.0785 116.1979 54.3216 37.4314 176.3902 61 K 4.3331 7.5255 120.5036 55.6867 28.8418 177.1451 62 T 3.8562 7.6361 120.5132 66.6288 69.1061 175.6831 63 D 4.0056 8.1240 120.1746 57.7782 40.9973 178.9641 64 E 4.1071 8.1673 118.2215 58.9359 29.5632 178.9185 65 A 4.1647 7.8737 120.5941 55.0495 18.4568 179.5776 66 K 4.1581 9.0639 119.2865 59.4921 32.2121 178.7409 67 E 3.9499 8.4046 119.8073 59.2834 29.8315 178.2606 68 F 4.2489 8.2698 120.3784 61.4872 39.4228 176.5914 69 F 3.7941 8.7148 120.0549 61.4999 38.9446 176.6568 70 E 4.0385 8.0459 116.8016 59.4792 29.3978 179.3179 71 K 3.8419 7.7148 118.0936 59.1871 32.3769 177.7304 72 Y 4.4720 7.1252 114.1321 57.5435 38.2964 177.8059 73 R 3.1358 7.6828 119.4744 58.6525 29.6843 178.8359 74 G 3.6091 7.6120 105.5818 47.1671 0.0000 173.7046 75 D 4.2699 7.2467 118.5696 55.1554 40.9933 175.6896 76 H 4.6799 7.0334 116.0422 53.9425 30.9720 173.0859 77 Y 4.5400 8.2856 121.3774 57.4628 39.6844 175.3813 78 N 4.2640 8.8739 117.3568 54.2516 36.6697 174.9017 79 K 4.4387 7.6066 115.8763 56.2050 32.7768 176.6717 80 S 4.7681 7.6998 113.6123 58.2616 63.7519 174.3256 81 E 4.6306 7.9737 119.2406 58.4328 35.0672 177.9614 82 E 3.9186 8.3764 117.7215 59.6879 29.6178 179.4537 83 I 4.2323 8.0938 119.6336 64.2761 36.9231 178.1202 84 K 4.3705 7.5654 116.3549 58.1892 32.1543 178.7265 85 Q 4.0316 7.8427 118.2351 58.2463 28.7841 177.5732 86 F 5.0504 8.0345 117.9946 59.0779 39.2070 177.4089 87 E 3.4521 8.2325 116.7114 58.6933 29.2195 178.0404 88 S 4.5965 7.9946 111.0125 58.3204 63.8682 174.4549 89 I 3.9525 7.7158 123.3810 60.4819 35.4697 174.6035 90 Y 4.7464 7.6726 119.9314 55.7237 39.3820 176.0889 91 T 4.7088 7.2822 110.4537 58.9845 73.4339 174.3635 92 V 3.4405 8.2976 121.0334 66.6017 31.3694 177.8955 93 Q 3.9325 8.0257 118.2830 59.5188 28.8953 177.8013 94 H 4.3883 7.7855 118.1688 58.3071 28.5215 177.6205 95 I 3.4353 7.2284 119.8515 64.8271 37.0157 177.8613 96 H 4.3482 7.9034 115.5934 58.8148 28.2911 177.3513 97 E 4.2673 8.3223 119.2169 57.3598 29.7077 176.0099 98 N 4.9106 7.6258 118.1656 51.8039 39.1588 175.3722 99 N 4.3856 8.9735 122.2560 56.4109 38.8223 177.2812 100 F 4.1235 8.3651 115.2805 60.0193 37.9750 177.2385 101 A 4.5134 6.4635 120.7599 54.9693 18.3489 178.8676 102 Y 3.7885 7.9778 118.1721 61.0960 38.6815 178.0854 103 T 4.0279 8.7874 116.7604 66.5208 68.7067 176.1707 104 F 4.2258 8.4904 122.2645 61.3603 39.3820 177.1860 105 K 4.2539 8.2790 117.6364 58.6224 31.8583 176.8580 106 N 4.9496 7.5589 113.9814 52.6772 39.1233 173.8817 107 S 4.8350 7.6255 113.5727 56.2642 66.5849 173.6787 108 K 4.4583 8.4029 121.3500 56.4164 32.9015 176.0115 109 Y 4.3541 9.0061 126.8330 56.9450 40.3149 173.6729 110 H 5.2484 8.2488 123.7711 54.7736 30.3225 174.3609 111 L 5.1193 9.1617 122.2680 53.2751 46.5112 175.2371 112 S 5.2775 8.4344 113.7723 57.4734 65.5005 172.6931 113 M 4.9828 8.8316 121.6088 54.4703 34.7616 174.6799 114 G 4.2510 9.0308 109.8080 45.1739 0.0000 174.9155 115 R 4.0150 8.7015 120.0010 59.3605 29.9970 178.1461 116 Y 3.8479 8.2763 118.6610 60.9352 38.7827 178.1248 117 A 4.0145 8.2311 120.9649 54.8059 18.4778 179.1441 118 F 4.1961 8.3944 119.3850 61.7920 39.5588 176.9974 119 D 4.1793 8.7058 118.7410 57.3613 40.5869 178.9590 120 L 3.9779 7.8537 119.3324 57.5688 41.5980 179.2651 121 L 3.9802 8.0880 120.2417 58.3328 42.0079 179.2115 122 I 3.5292 7.5660 119.7191 64.3199 37.0211 178.1218 123 N 4.1765 8.0185 117.3288 56.1449 38.3442 177.1199 124 F 3.6362 8.0108 121.8385 61.0840 39.3005 177.1895 125 L 3.7596 7.9675 118.4335 57.7349 41.4752 179.2195 126 E 3.8302 8.1149 118.5341 59.4833 29.2143 179.0752 127 E 3.8504 7.6417 116.8317 59.5903 29.6590 179.1095 128 R 4.0627 6.9917 113.5719 55.0790 30.1484 175.8185 129 N 4.0938 7.6622 115.8633 54.6431 38.6607 175.8829 130 L 4.4067 7.6507 115.8254 53.8319 38.3671 177.1795 131 T 4.0527 7.6364 111.8283 64.0111 69.5097 176.4527 132 Y 3.9707 7.9374 122.6405 60.7843 38.9295 177.5299 133 I 3.6768 7.8735 120.2100 64.4840 37.2839 178.1914 134 L 3.9200 7.7843 119.4175 57.5663 41.3761 179.6614 135 K 3.8525 7.6739 119.1165 59.3783 32.1422 178.7973 136 I 3.4975 7.1960 120.1145 64.2529 36.8043 177.7915 137 L 3.9466 7.9121 120.9783 58.6543 41.6902 179.0005 138 N 4.3621 7.9608 114.7873 56.0692 38.5504 177.0138 139 Q 4.1761 8.3363 118.7221 57.6079 29.4704 176.1573 140 H 4.9856 8.7503 114.2117 55.0631 31.2037 173.5432 141 L 5.1733 7.7311 118.6432 52.8696 44.2411 175.8811 142 D 4.7079 9.3797 123.5434 52.8407 42.6387 174.6795 143 I 4.8136 8.1420 127.1905 59.3446 38.8217 175.5430 144 K 4.1456 8.9119 130.4688 55.9239 33.1622 175.6498 145 V 4.6710 8.1848 128.1829 61.3924 33.0735 174.1946 146 Y 4.4074 9.1037 130.9302 57.1463 39.7763 174.4141 147 V 4.4322 8.0243 119.7537 60.5134 34.5124 176.1882 148 G 3.9565 8.6518 111.4035 45.8551 0.0000 173.2738 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 16 K 8.17 4.17 0.00 1.91 2.07 0.00 1.45 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 17 D 7.73 4.33 0.00 2.78 2.75 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 0.00 0.00 0.00 18 Q 8.73 3.91 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 19 M 7.66 3.67 0.00 1.57 1.70 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.03 0.00 20 E 7.75 4.07 0.00 2.13 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 2.51 2.62 0.00 21 T 8.16 3.94 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 1.32 0.00 0.00 22 S 8.41 4.18 0.00 4.14 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 23 Y 8.35 4.13 0.00 3.23 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 24 V 8.56 3.54 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 0.92 0.00 0.00 1.07 0.00 0.00 25 S 8.32 4.16 0.00 4.28 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.05 3.96 0.00 2.02 1.79 0.83 0.34 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 27 K 8.24 3.81 0.00 1.28 1.72 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.31 7.81 28 T 7.73 4.10 4.31 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 1.30 0.00 0.00 29 W 7.96 4.44 0.00 3.36 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 30 I 7.50 3.14 1.79 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.86 0.80 0.00 0.00 31 E 8.04 4.01 0.00 2.17 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 0.00 2.32 2.44 0.00 32 D 7.50 4.83 0.00 2.61 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 S 6.59 4.54 0.00 3.58 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 34 L 8.44 3.93 0.00 1.80 1.64 0.83 0.91 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 35 D 8.60 4.11 0.00 2.62 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.61 3.74 0.00 1.22 0.94 0.73 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 37 F 7.33 5.00 0.00 3.08 2.99 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 38 K 8.53 3.86 0.00 1.95 1.87 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.54 7.81 39 N 7.97 4.30 0.00 2.73 2.89 0.00 0.00 7.08 7.35 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 40 D 7.85 4.65 0.00 2.93 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 41 L 7.62 4.61 0.00 1.65 1.73 0.79 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.94 4.02 0.00 1.74 1.79 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.53 0.00 2.17 2.29 0.00 3.78 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 2.12 2.24 0.00 44 L 8.04 4.37 0.00 1.90 1.84 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.01 4.16 0.00 2.01 1.92 0.85 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.32 4.12 0.00 2.98 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 47 P 0.00 4.01 0.00 2.09 1.17 0.00 3.86 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.29 0.00 48 L 7.81 4.02 0.00 1.93 2.20 1.13 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.91 4.03 0.00 3.20 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 50 I 7.72 2.97 0.88 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.31 -1.26 0.00 0.00 51 H 8.14 4.10 0.00 3.50 3.40 0.00 5.82 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 52 I 7.78 3.74 1.64 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.30 -0.31 0.00 0.00 53 Y 7.58 4.08 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 F 7.96 4.36 0.00 2.96 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 55 D 8.29 4.39 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.93 3.90 0.00 1.76 1.80 0.78 0.53 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 57 I 7.67 3.62 1.85 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.42 0.83 0.00 0.00 58 Q 8.46 4.08 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 59 Q 7.48 4.38 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.07 0.00 0.00 0.00 0.00 0.00 2.31 2.60 0.00 60 N 8.08 4.27 0.00 2.83 2.92 0.00 0.00 6.91 7.16 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 61 K 7.53 4.33 0.00 1.99 1.82 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.64 1.49 7.81 62 T 7.64 3.86 4.21 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 1.23 0.00 0.00 63 D 8.12 4.01 0.00 2.68 2.75 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 0.00 0.00 0.00 64 E 8.17 4.11 0.00 2.15 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 2.41 2.38 0.00 65 A 7.87 4.16 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 66 K 9.06 4.16 0.00 2.00 1.90 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.69 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.57 7.81 67 E 8.40 3.95 0.00 2.31 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 0.00 2.39 2.36 0.00 68 F 8.27 4.25 0.00 3.29 3.30 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 69 F 8.71 3.79 0.00 3.09 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 70 E 8.05 4.04 0.00 2.16 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 2.70 2.56 0.00 71 K 7.71 3.84 0.00 1.65 1.06 0.00 0.88 0.00 0.00 1.34 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.76 1.17 7.81 72 Y 7.13 4.47 0.00 2.72 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 73 R 7.68 3.14 0.00 1.62 1.85 0.00 2.95 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.44 0.00 74 G 7.61 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.25 4.27 0.00 2.37 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 H 7.03 4.68 0.00 2.96 2.99 0.00 5.64 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 77 Y 8.29 4.54 0.00 2.98 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 78 N 8.87 4.26 0.00 2.86 2.89 0.00 0.00 6.81 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.61 4.44 0.00 1.57 1.53 0.00 0.87 0.00 0.00 1.46 0.00 0.00 2.83 0.00 0.00 2.18 0.00 0.00 0.00 0.00 1.43 1.04 7.81 80 S 7.70 4.77 0.00 3.96 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 81 E 7.97 4.63 0.00 1.96 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 2.27 2.30 0.00 82 E 8.38 3.92 0.00 2.12 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 2.42 2.41 0.00 83 I 8.09 4.23 2.15 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.98 1.06 0.00 0.00 84 K 7.57 4.37 0.00 1.81 1.89 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.25 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.51 7.81 85 Q 7.84 4.03 0.00 1.46 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.93 0.00 0.00 0.00 0.00 0.00 2.03 2.25 0.00 86 F 8.03 5.05 0.00 3.59 3.18 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 0.00 0.00 0.00 0.00 87 E 8.23 3.45 0.00 2.24 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 2.61 2.35 0.00 88 S 7.99 4.60 0.00 3.97 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 89 I 7.72 3.95 2.36 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.99 0.92 0.00 0.00 90 Y 7.67 4.75 0.00 2.91 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 91 T 7.28 4.71 4.19 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 1.37 0.00 0.00 92 V 8.30 3.44 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 1.03 0.00 0.00 0.89 0.00 0.00 93 Q 8.03 3.93 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.65 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 94 H 7.79 4.39 0.00 3.28 3.13 0.00 5.69 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 95 I 7.23 3.44 1.79 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.32 0.47 0.00 0.00 96 H 7.90 4.35 0.00 3.26 3.30 0.00 5.65 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 97 E 8.32 4.27 0.00 2.19 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 0.00 2.48 2.32 0.00 98 N 7.63 4.91 0.00 2.37 2.19 0.00 0.00 6.88 6.73 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 99 N 8.97 4.39 0.00 2.82 2.98 0.00 0.00 6.84 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 0.00 100 F 8.37 4.12 0.00 3.37 3.40 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 0.00 101 A 6.46 4.51 1.15 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 0.00 0.00 102 Y 7.98 3.79 0.00 3.28 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 0.00 103 T 8.79 4.03 4.48 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 1.34 0.00 0.00 104 F 8.49 4.23 0.00 3.70 3.51 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 0.00 105 K 8.28 4.25 0.00 1.92 1.74 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.52 1.46 7.81 106 N 7.56 4.95 0.00 2.60 2.65 0.00 0.00 6.79 7.54 0.00 0.00 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 S 7.63 4.84 0.00 3.89 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 0.00 108 K 8.40 4.46 0.00 1.59 1.64 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.36 7.81 109 Y 9.01 4.35 0.00 2.79 2.78 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 0.00 0.00 0.00 110 H 8.25 5.25 0.00 2.90 3.19 0.00 5.89 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 9.16 5.12 0.00 1.64 1.65 1.09 0.75 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 0.00 112 S 8.43 5.28 0.00 3.86 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 0.00 113 M 8.83 4.98 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 114 G 9.03 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 0.00 0.00 0.00 0.00 115 R 8.70 4.01 0.00 1.99 2.05 0.00 3.17 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.78 0.00 116 Y 8.28 3.85 0.00 3.10 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 0.00 117 A 8.23 4.01 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.39 4.20 0.00 3.26 3.34 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 0.00 119 D 8.71 4.18 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.85 3.98 0.00 2.00 2.07 0.74 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.09 3.98 0.00 1.88 1.82 0.97 1.01 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 0.00 122 I 7.57 3.53 1.51 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 -0.34 0.73 0.00 0.00 123 N 8.02 4.18 0.00 2.72 2.97 0.00 0.00 6.69 7.44 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 0.00 124 F 8.01 3.64 0.00 2.27 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 0.00 125 L 7.97 3.76 0.00 1.77 1.64 0.91 0.96 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 0.00 126 E 8.11 3.83 0.00 1.88 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 2.24 2.39 0.00 127 E 7.64 3.85 0.00 1.86 1.82 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 2.24 2.31 0.00 128 R 6.99 4.06 0.00 1.29 1.64 0.00 2.21 0.00 0.00 2.58 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.16 0.00 129 N 7.66 4.09 0.00 2.74 2.78 0.00 0.00 7.13 7.42 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 0.00 130 L 7.65 4.41 0.00 1.68 1.64 0.89 0.57 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 0.00 131 T 7.64 4.05 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 132 Y 7.94 3.97 0.00 3.12 3.04 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 0.00 133 I 7.87 3.68 2.06 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.62 0.95 0.00 0.00 134 L 7.78 3.92 0.00 1.83 1.67 0.86 0.49 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 0.00 135 K 7.67 3.85 0.00 1.84 1.75 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.39 7.81 136 I 7.20 3.50 1.80 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.55 0.78 0.00 0.00 137 L 7.91 3.95 0.00 1.90 1.86 0.97 0.70 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 0.00 138 N 7.96 4.36 0.00 2.70 2.83 0.00 0.00 7.16 7.36 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 0.00 139 Q 8.34 4.18 0.00 1.90 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 140 H 8.75 4.99 0.00 2.94 3.16 0.00 5.57 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.73 5.17 0.00 1.69 1.64 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 142 D 9.38 4.71 0.00 2.47 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 0.00 0.00 0.00 0.00 143 I 8.14 4.81 1.90 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.83 0.97 0.00 0.00 144 K 8.91 4.15 0.00 1.88 1.73 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.42 7.81 145 V 8.18 4.67 1.80 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 0.63 0.00 0.00 0.14 0.00 0.00 146 Y 9.10 4.41 0.00 3.11 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 0.00 147 V 8.02 4.43 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 0.69 0.00 0.00 0.75 0.00 0.00 148 G 8.65 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00