NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7691 8.4093 119.2091 53.2780 39.2473 172.8951 4 K 4.5960 7.7105 119.2560 53.1975 36.1463 174.9074 5 P 4.5688 0.0000 0.0000 62.9699 32.9251 177.0150 6 I 4.7102 7.9700 118.4450 60.0508 40.8425 173.9659 7 V 4.5852 8.4091 126.1318 60.9410 34.1980 174.5043 8 L 4.8598 8.4025 125.2144 52.9370 44.7337 175.8947 9 S 4.7680 8.1321 115.6365 56.3933 66.3647 173.2972 10 T 3.7047 8.2962 111.0408 61.9458 69.5983 175.0271 11 W 3.4658 7.8814 125.0199 55.8070 28.5399 175.0573 12 N 4.3710 8.4674 115.6962 56.3698 37.9431 177.2914 13 F 4.4008 7.6621 114.9673 58.7540 37.9686 177.3469 14 G 3.8156 7.8973 108.3152 46.9512 0.0000 175.8211 15 L 3.9739 7.5070 120.6406 58.3078 41.8563 178.9410 16 H 4.4520 7.8790 115.4051 58.6485 28.7437 177.5132 17 A 4.0898 8.0111 122.3288 55.3742 18.1872 179.4355 18 N 4.4083 8.5937 115.2423 56.3080 38.5140 177.8848 19 V 3.6878 7.6624 119.9809 65.9962 31.2991 177.9669 20 E 4.0124 8.2601 117.6536 59.4349 29.4399 178.9555 21 A 4.3728 8.1563 120.8197 55.0946 18.4289 179.5338 22 W 4.2235 8.6610 126.7321 60.2978 30.4915 178.3236 23 K 4.0311 7.7664 117.6923 59.0972 31.6635 179.1531 24 V 3.7024 7.2734 118.8084 65.8966 31.6481 178.0800 25 L 3.7709 7.7247 118.9087 57.6947 41.1888 179.7842 26 S 3.5342 7.3153 112.5875 60.3895 62.9927 174.9842 27 K 4.1864 7.7475 118.6835 55.8468 31.7979 176.5110 28 G 3.7157 7.8063 106.7734 46.4550 0.0000 174.7990 29 G 3.8378 7.5633 108.2127 44.0581 0.0000 175.0118 30 K 4.1462 8.2827 118.8493 55.6305 33.7332 178.1584 31 A 3.9860 8.6676 125.4875 55.3187 18.2859 179.6233 32 L 3.8856 7.9144 118.1008 58.6997 42.0894 178.9517 33 D 4.4130 8.0862 117.8858 56.8720 40.7422 178.4847 34 A 3.9803 7.9924 121.4938 55.4641 18.5943 180.2170 35 V 3.6247 8.1209 111.1546 64.2257 31.5940 178.6233 36 E 3.9325 8.0902 118.8251 59.2777 29.7378 178.9246 37 K 4.0765 8.3871 118.9214 59.3439 31.8732 179.3614 38 G 3.8324 8.1960 105.1457 48.2836 0.0000 175.9420 39 V 3.8774 7.8334 115.2761 63.5876 31.4676 178.7276 40 R 4.1404 7.9953 118.0230 59.2418 29.7599 178.4118 41 L 3.9500 7.5611 118.8506 58.4630 41.8116 179.4359 42 V 3.5757 7.6747 116.0457 65.9569 31.9733 177.3196 43 E 4.0983 8.2317 118.4176 59.5542 29.0389 179.0908 44 D 4.7329 8.3189 118.5084 55.8774 41.1342 175.9603 45 D 4.5230 7.7163 119.7709 52.6218 40.2677 174.8346 46 P 4.2079 0.0000 0.0000 64.8315 31.2476 178.7214 47 T 3.7305 8.0607 115.3820 65.4587 68.7703 174.0457 48 E 4.1661 7.9411 123.1916 54.7066 28.7226 175.5681 49 R 4.3820 8.3481 122.4774 55.6629 30.1185 178.0041 50 S 4.6253 7.7864 111.7255 57.8771 63.7506 174.1901 51 V 4.3949 7.2607 119.9952 62.3732 35.7007 175.8062 52 G 3.7269 8.3400 114.4730 46.7142 0.0000 174.6006 53 Y 4.5153 9.2019 126.6990 58.5318 38.9593 176.4477 54 G 3.8472 8.4551 115.5013 45.9294 0.0000 173.4383 55 G 3.7713 7.3743 106.8736 46.5139 0.0000 173.9046 56 R 4.2510 8.2193 123.8229 55.1769 30.5848 175.1562 57 P 4.5718 0.0000 0.0000 62.0897 32.8728 175.2145 58 D 4.5209 8.7412 120.8454 52.2836 40.2637 177.3305 59 R 3.9289 8.3392 114.7655 58.7760 29.4010 176.9748 60 D 4.9119 8.3439 116.8587 54.0202 40.9621 177.0304 61 G 2.0587 7.6357 107.3856 44.7603 0.0000 173.9045 62 R 4.0402 7.8697 119.6204 54.9734 31.0064 175.4569 63 V 4.3094 8.0135 122.6714 62.1168 32.4998 175.1360 64 T 4.7766 8.3215 123.8132 61.8451 71.7113 173.2208 65 L 4.8648 9.0057 126.4038 53.0279 44.9841 175.2808 66 D 5.3445 8.3363 120.1148 52.8848 44.6753 174.7594 67 A 4.7431 8.8330 121.8052 51.5981 23.0904 174.8831 68 C 5.2271 8.4047 113.1655 57.1773 32.9745 172.9565 69 I 4.7764 8.7745 119.4226 59.9006 41.7026 173.6160 70 M 5.2604 8.4454 126.0011 54.7583 35.1029 173.9910 71 D 4.9390 8.3863 127.2689 52.0406 41.9839 175.7755 72 E 4.2146 8.6285 115.7951 58.0428 30.5979 175.7078 73 N 5.0587 8.2832 119.2706 53.7599 39.2259 174.1405 74 Y 3.3465 8.0600 109.8578 58.8302 36.2121 169.7515 75 N 4.9806 7.8901 117.4741 52.6796 39.9323 174.4202 76 I 5.2177 8.2923 115.5432 59.5434 41.3080 174.5852 77 G 4.3492 8.8571 109.3993 45.3672 0.0000 172.0042 78 S 5.2651 8.9308 118.2920 56.9424 68.0645 173.5085 79 V 5.5723 8.9847 114.6191 58.6890 35.8101 174.6072 80 A 4.7121 8.1061 123.8044 50.8412 22.8810 175.2410 81 C 4.1921 8.9245 120.3053 60.7116 30.4539 172.1255 82 M 4.7444 8.2856 120.3522 53.7952 34.6027 174.3919 83 E 4.8357 8.3175 123.9444 56.0480 32.3028 176.9414 84 H 4.7651 8.3809 114.8240 56.3515 27.0977 174.4880 85 I 4.6599 6.9700 119.3289 58.9443 38.2885 175.4134 86 K 4.0005 8.8878 127.4339 58.8453 32.0105 176.5445 87 N 5.6031 7.9800 116.2783 49.4182 38.1834 172.8180 88 P 4.1671 0.0000 0.0000 65.7363 31.4445 178.4148 89 I 3.6673 8.1988 118.4093 64.0969 37.7780 178.0825 90 S 4.3604 7.9283 115.4017 61.3638 62.6053 176.8022 91 V 3.1749 7.5112 120.5330 65.5698 31.2952 177.7669 92 A 3.9821 8.2886 120.9908 55.1637 18.1677 179.5214 93 R 3.8789 8.3348 117.3228 59.6357 30.1277 178.6489 94 A 4.1469 8.5566 120.8814 54.9679 18.4746 179.6705 95 V 3.3019 8.1803 117.1421 66.2936 31.3476 177.8751 96 M 4.0909 7.8499 116.3276 58.9441 32.2686 177.6978 97 E 4.2735 8.3632 116.7659 57.6640 29.9768 177.4699 98 K 4.5639 8.5447 116.3064 56.0394 33.6490 175.5764 99 T 4.6379 7.4980 108.1807 58.8274 71.3911 171.9309 100 P 4.4947 0.0000 0.0000 63.2850 31.0954 174.9679 101 H 5.0626 8.0897 115.8506 54.4776 32.1725 173.1299 102 V 4.4083 8.0622 117.0349 63.2503 34.1664 174.6478 103 M 5.2243 7.8244 118.8811 54.4202 35.2623 173.6552 104 L 4.8758 8.8196 125.5884 53.0318 45.3569 175.9860 105 V 4.6950 8.0713 114.9366 59.7409 35.5793 177.6438 106 G 3.8840 8.8639 109.8988 46.2150 0.0000 175.7889 107 D 4.4679 9.0091 119.3920 57.7411 40.8471 178.7066 108 G 3.8959 8.2566 105.0747 47.8271 0.0000 175.3733 109 A 4.0505 7.8008 122.3626 54.8822 18.3643 179.4577 110 L 3.8513 7.8473 118.3368 58.3412 42.3129 178.4796 111 E 3.9697 8.6468 118.9334 59.6250 29.5363 179.3354 112 F 4.2377 8.4433 119.9314 61.2636 39.5139 176.6349 113 A 3.6778 8.2237 120.7136 55.4368 18.1373 179.6662 114 L 4.2005 8.2555 117.7496 57.9083 41.4770 179.7821 115 S 4.2870 7.9437 112.7973 60.4210 63.0584 175.3870 116 Q 4.3416 7.4893 120.3175 55.4355 28.7551 176.2837 117 G 3.8410 7.8847 108.6800 45.0188 0.0000 174.3338 118 F 4.1060 7.8440 118.0386 57.1525 39.5061 174.8555 119 K 4.4924 8.3579 122.5410 54.8216 33.6114 175.9871 120 K 4.5302 8.4022 124.1941 55.9050 33.1232 175.4924 121 E 4.7557 9.3856 126.0816 54.5382 34.4330 174.1216 122 N 4.9689 8.5798 119.8818 52.5649 39.6092 174.6429 123 L 4.4998 8.6056 125.8184 54.8834 42.5378 175.9827 124 L 4.3960 7.7315 122.0065 54.1478 42.3446 176.7481 125 T 4.2815 8.2482 116.9412 60.9782 71.1804 174.9989 126 A 3.9797 8.6351 124.3615 55.5853 18.2110 179.7184 127 E 3.8564 8.1130 116.9026 59.8488 29.7529 179.2849 128 S 4.1550 7.8374 115.0044 61.3248 62.7179 176.3871 129 E 4.1998 8.5920 122.6342 58.9683 29.2730 178.5126 130 K 3.9087 8.3809 119.9734 59.8620 32.2154 178.5954 131 E 4.1971 8.4638 118.7612 59.1128 29.2911 179.1543 132 W 4.3620 8.5807 128.5957 60.5544 30.6338 177.9020 133 K 3.6596 8.1904 116.2026 57.9934 31.7047 178.6650 134 E 4.1609 7.8154 119.9605 58.7600 29.2535 178.3589 135 W 4.1449 8.4882 128.6218 60.5829 30.4893 177.9610 136 L 3.3645 7.9632 118.0535 57.1171 40.9379 179.4920 137 K 3.9889 7.4688 117.9610 59.4368 32.3291 177.1019 138 T 3.9223 6.9776 118.3923 63.7806 68.2994 174.1724 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 3 N 8.41 4.77 0.00 2.70 2.85 0.00 0.00 6.76 5.80 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 4 K 7.71 4.60 0.00 1.94 1.73 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.54 7.81 5 P 0.00 4.57 0.00 1.87 1.95 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.96 0.00 6 I 7.97 4.71 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.57 0.96 0.00 0.00 7 V 8.41 4.59 2.32 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 0.99 0.00 0.00 1.19 0.00 0.00 8 L 8.40 4.86 0.00 1.60 1.47 0.89 0.79 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 9 S 8.13 4.77 0.00 3.99 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 10 T 8.30 3.70 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 1.12 0.00 0.00 11 W 7.88 3.47 0.00 2.14 2.43 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 12 N 8.47 4.37 0.00 2.83 2.90 0.00 0.00 6.56 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 13 F 7.66 4.40 0.00 3.21 3.29 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 14 G 7.90 3.82 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 0.00 0.00 0.00 15 L 7.51 3.97 0.00 1.74 1.76 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 16 H 7.88 4.45 0.00 3.25 3.37 0.00 5.64 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 17 A 8.01 4.09 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 18 N 8.59 4.41 0.00 3.11 2.88 0.00 0.00 6.66 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 19 V 7.66 3.69 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.99 0.00 0.00 20 E 8.26 4.01 0.00 2.23 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 2.46 2.37 0.00 21 A 8.16 4.37 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 22 W 8.66 4.22 0.00 3.57 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 23 K 7.77 4.03 0.00 1.99 1.88 0.00 1.91 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.78 7.81 24 V 7.27 3.70 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 1.06 0.00 0.00 0.93 0.00 0.00 25 L 7.72 3.77 0.00 1.15 1.15 1.09 0.58 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 26 S 7.32 3.53 0.00 3.67 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 27 K 7.75 4.19 0.00 1.79 1.80 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.45 7.81 28 G 7.81 3.72 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 0.00 0.00 0.00 29 G 7.56 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 30 K 8.28 4.15 0.00 1.98 1.73 0.00 1.68 0.00 0.00 1.98 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 31 A 8.67 3.99 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 32 L 7.91 3.89 0.00 1.77 1.69 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.09 4.41 0.00 2.84 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 34 A 7.99 3.98 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 35 V 8.12 3.62 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 0.96 0.00 0.00 1.05 0.00 0.00 36 E 8.09 3.93 0.00 2.15 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 0.00 2.35 2.39 0.00 37 K 8.39 4.08 0.00 1.98 1.88 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.79 1.63 7.81 38 G 8.20 3.83 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 0.00 0.00 0.00 39 V 7.83 3.88 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 0.85 0.00 0.00 1.07 0.00 0.00 40 R 8.00 4.14 0.00 2.11 2.03 0.00 3.18 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.85 0.00 41 L 7.56 3.95 0.00 1.89 1.90 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.67 3.58 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 0.58 0.00 0.00 0.99 0.00 0.00 43 E 8.23 4.10 0.00 2.23 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 0.00 2.33 2.54 0.00 44 D 8.32 4.73 0.00 2.92 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 45 D 7.72 4.52 0.00 2.77 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 46 P 0.00 4.21 0.00 1.80 1.01 0.00 3.89 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.86 0.00 47 T 8.06 3.73 4.59 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 1.17 0.00 0.00 48 E 7.94 4.17 0.00 1.73 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 1.85 1.58 0.00 49 R 8.35 4.38 0.00 1.82 1.87 0.00 3.55 0.00 0.00 3.28 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.55 0.00 50 S 7.79 4.63 0.00 3.80 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.26 4.39 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 0.76 0.00 0.00 0.84 0.00 0.00 52 G 8.34 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 53 Y 9.20 4.52 0.00 2.93 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 54 G 8.46 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 55 G 7.37 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.22 4.25 0.00 1.65 1.78 0.00 3.08 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 57 P 0.00 4.57 0.00 1.59 1.79 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 58 D 8.74 4.52 0.00 2.78 2.76 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 59 R 8.34 3.93 0.00 2.35 2.15 0.00 3.27 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 60 D 8.34 4.91 0.00 2.77 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 61 G 7.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.87 4.04 0.00 2.09 1.91 0.00 3.04 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.43 0.00 63 V 8.01 4.31 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 0.78 0.00 0.00 0.91 0.00 0.00 64 T 8.32 4.78 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 65 L 9.01 4.86 0.00 1.50 1.50 0.94 0.68 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 66 D 8.34 5.34 0.00 2.49 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 8.83 4.74 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 C 8.40 5.23 0.00 3.07 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 69 I 8.77 4.78 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 1.12 1.46 0.95 0.00 0.00 70 M 8.45 5.26 0.00 1.95 1.82 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.37 0.00 71 D 8.39 4.94 0.00 2.81 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 72 E 8.63 4.21 0.00 2.10 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 0.00 2.29 2.24 0.00 73 N 8.28 5.06 0.00 2.80 2.76 0.00 0.00 7.10 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 Y 8.06 3.35 0.00 3.16 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 75 N 7.89 4.98 0.00 3.09 2.75 0.00 0.00 6.51 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 76 I 8.29 5.22 1.87 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 1.32 0.67 0.91 0.00 0.00 77 G 8.86 4.35 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 0.00 78 S 8.93 5.27 0.00 3.74 3.69 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 79 V 8.98 5.57 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 0.61 0.00 0.00 0.93 0.00 0.00 80 A 8.11 4.71 1.17 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 0.00 0.00 81 C 8.92 4.19 0.00 3.05 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 82 M 8.29 4.74 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 83 E 8.32 4.84 0.00 1.96 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 2.41 2.22 0.00 84 H 8.38 4.77 0.00 3.43 3.43 0.00 6.05 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 6.97 4.66 1.78 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.73 0.82 0.00 0.00 86 K 8.89 4.00 0.00 1.94 1.84 0.00 1.76 0.00 0.00 1.95 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.42 7.81 87 N 7.98 5.60 0.00 2.90 2.83 0.00 0.00 7.36 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 4.17 0.00 2.22 2.27 0.00 3.89 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.00 0.00 89 I 8.20 3.67 2.01 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 1.55 1.50 1.07 0.00 0.00 90 S 7.93 4.36 0.00 4.37 4.18 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 91 V 7.51 3.17 1.96 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 0.96 0.00 0.00 -0.09 0.00 0.00 92 A 8.29 3.98 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.33 3.88 0.00 2.02 2.16 0.00 3.14 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 94 A 8.56 4.15 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 95 V 8.18 3.30 2.27 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 0.88 0.00 0.00 0.93 0.00 0.00 96 M 7.85 4.09 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.61 0.00 97 E 8.36 4.27 0.00 2.04 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 2.36 2.55 0.00 98 K 8.54 4.56 0.00 2.24 2.07 0.00 1.61 0.00 0.00 1.88 0.00 0.00 3.18 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.74 1.48 7.81 99 T 7.50 4.64 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 0.59 0.00 0.00 100 P 0.00 4.49 0.00 2.06 2.09 0.00 3.54 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.84 0.00 101 H 8.09 5.06 0.00 2.99 3.14 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 8.06 4.41 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 0.99 0.00 0.00 0.94 0.00 0.00 103 M 7.82 5.22 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 104 L 8.82 4.88 0.00 1.57 1.46 0.59 0.67 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 0.00 105 V 8.07 4.69 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.91 0.00 0.00 106 G 8.86 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 9.01 4.47 0.00 2.70 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 0.00 108 G 8.26 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 0.00 109 A 7.80 4.05 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 0.00 110 L 7.85 3.85 0.00 1.77 1.88 1.01 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.65 3.97 0.00 2.23 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 0.00 2.36 2.51 0.00 112 F 8.44 4.24 0.00 3.14 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 0.00 113 A 8.22 3.68 1.17 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 0.00 0.00 114 L 8.26 4.20 0.00 1.84 1.74 0.92 0.95 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 0.00 115 S 7.94 4.29 0.00 4.05 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 0.00 116 Q 7.49 4.34 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.60 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 117 G 7.88 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 0.00 118 F 7.84 4.11 0.00 3.02 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 0.00 119 K 8.36 4.49 0.00 1.71 1.70 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.43 7.81 120 K 8.40 4.53 0.00 1.75 1.67 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.28 1.39 7.81 121 E 9.39 4.76 0.00 1.87 1.61 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 2.11 2.16 0.00 122 N 8.58 4.97 0.00 2.72 2.75 0.00 0.00 6.98 7.78 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 0.00 123 L 8.61 4.50 0.00 1.76 1.77 0.97 0.48 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 0.00 124 L 7.73 4.40 0.00 1.55 1.60 0.84 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 125 T 8.25 4.28 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 0.75 0.00 0.00 126 A 8.64 3.98 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 0.00 127 E 8.11 3.86 0.00 2.01 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 2.36 2.39 0.00 128 S 7.84 4.15 0.00 3.95 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.59 4.20 0.00 2.14 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 2.61 2.64 0.00 130 K 8.38 3.91 0.00 2.07 2.15 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.78 7.81 131 E 8.46 4.20 0.00 2.11 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 2.37 2.35 0.00 132 W 8.58 4.36 0.00 3.40 3.54 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 0.00 133 K 8.19 3.66 0.00 1.92 1.70 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.99 1.27 7.81 134 E 7.82 4.16 0.00 2.18 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 2.30 2.43 0.00 135 W 8.49 4.14 0.00 3.41 3.48 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 0.00 136 L 7.96 3.36 0.00 1.35 1.46 -0.08 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 0.00 137 K 7.47 3.99 0.00 1.77 1.76 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.59 7.81 138 T 6.98 3.92 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 1.16 0.00 0.00