NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4243 8.2893 120.3276 54.9284 31.5510 175.0048 2 S 3.2483 7.9755 114.0352 57.6432 63.6183 175.4579 3 S 3.3401 8.0233 118.8705 57.9741 63.2771 172.9957 4 L 4.4583 8.0112 121.5888 53.1505 43.2046 175.4549 5 L 4.1323 8.3149 128.3813 54.7356 42.7585 175.9483 6 V 4.4776 8.3163 127.9508 61.4554 32.3083 175.3865 7 K 4.3511 8.9824 132.1194 54.3180 31.9342 175.0585 8 K 3.9818 8.4983 124.7829 57.1902 32.2439 176.4454 9 L 4.7268 9.0249 122.6729 54.8340 43.1456 177.0070 10 V 4.5408 7.5428 111.5204 59.2370 35.8589 175.1379 11 E 3.9685 9.1531 121.7284 59.7825 29.1901 178.7161 12 S 4.1178 8.2154 112.8910 61.6321 62.9968 174.2163 13 A 3.6424 7.0289 122.3346 49.9374 18.0287 177.4256 14 T 4.2987 8.2917 120.3781 62.8620 69.9883 173.8781 15 T 4.3426 8.0009 116.8743 59.9211 68.2047 170.7069 16 P 5.1558 0.0000 0.0000 62.2354 31.4397 174.9729 17 M 4.7266 8.6242 123.7906 53.5565 36.3722 174.7231 18 R 4.3733 8.1342 123.0537 54.2556 30.8826 177.3408 19 G 3.8417 8.7827 111.0900 46.6437 0.0000 171.3740 20 S 4.5961 8.1480 113.9176 56.3197 65.8812 174.6298 21 E 3.9197 8.9535 125.4436 59.1955 29.4682 177.9473 22 G 3.8806 7.9122 103.6483 44.8759 0.0000 173.0893 23 A 3.9870 6.8681 121.5097 52.2097 18.8862 177.8090 24 A 4.7098 8.4868 119.9851 52.0207 21.0085 176.8065 25 G 4.4808 7.6475 100.9207 44.8650 0.0000 171.9208 26 Y 4.6820 9.7766 120.3772 56.6543 39.4607 175.1077 27 D 4.7688 9.1805 125.6680 54.5901 42.3694 175.5172 28 I 4.7664 8.5407 116.0303 59.3692 40.0344 175.0935 29 S 4.9299 8.7024 122.8547 57.0842 64.9263 173.8922 30 S 4.4115 9.4255 118.0078 58.5728 62.9809 174.6328 31 V 4.3201 8.6875 125.1534 63.0818 32.7153 174.4436 32 E 4.9894 7.8275 117.8766 55.0618 33.1427 173.6918 33 D 5.3502 8.7129 119.4175 53.3211 43.3278 175.8477 34 V 4.7245 8.8900 116.3982 59.6119 37.0459 174.6825 35 V 4.8260 8.2387 120.9656 59.9989 33.6138 175.7581 36 V 4.2019 8.5782 126.4940 59.3590 32.2600 173.4801 37 P 4.6078 0.0000 0.0000 62.0117 32.0827 175.6453 38 A 4.0792 8.8961 124.5105 54.4574 18.5023 176.9977 39 M 3.4330 8.3283 121.5212 55.1492 30.2387 176.3544 40 G 4.5148 8.3315 105.7885 44.5686 0.0000 171.6698 41 R 5.8252 8.1047 115.0392 53.7378 33.1508 174.1881 42 I 4.1763 7.9413 115.1019 60.3975 41.3103 172.7924 43 A 4.6873 8.6737 129.9216 50.3382 19.5884 176.6876 44 V 4.0329 8.3609 121.6113 63.7731 33.3483 175.0390 45 S 5.0543 9.3582 123.4962 57.9175 63.7747 174.8677 46 T 4.2867 8.7160 114.0254 60.5121 70.3765 175.7046 47 G 4.6543 9.2528 111.4327 45.8985 0.0000 172.5938 48 I 5.0704 7.2044 110.3731 59.3107 41.5137 173.4624 49 S 5.1127 8.6572 117.2421 56.6421 66.0438 172.5006 50 I 5.8313 8.1901 116.6482 58.4035 41.4914 174.3662 51 R 4.5798 8.2740 120.0977 54.2604 33.0006 175.2909 52 V 3.9097 8.5103 124.6464 61.5037 32.3657 173.9371 53 P 4.2124 0.0000 0.0000 62.5692 31.2249 175.6074 54 D 5.0033 8.1070 119.5925 54.5364 41.6835 175.8640 55 G 4.2525 8.6002 108.0992 46.1096 0.0000 172.6024 56 T 4.7700 7.2614 110.9920 60.9626 71.6080 171.8089 57 Y 4.9231 8.9694 126.0781 55.4169 41.7332 174.8664 58 G 3.7035 8.8737 107.5961 44.6472 0.0000 172.2595 59 R 5.0256 7.8755 128.7902 54.5354 31.6078 175.2206 60 I 4.3175 8.8008 121.6453 60.2847 38.3770 175.4110 61 A 4.8276 8.7881 129.6503 49.4784 21.6646 173.8325 62 P 4.8609 0.0000 0.0000 62.2761 32.5537 176.6694 63 R 4.2143 8.5167 121.1752 56.0674 31.0239 177.5115 64 S 4.3068 8.6990 117.6624 61.6317 62.8454 176.8247 65 G 4.0201 8.1525 107.3469 48.4403 0.0000 174.8439 66 L 4.1457 8.1718 120.8775 57.3536 41.8368 179.7016 67 A 4.5121 7.7276 121.6654 54.8193 18.1549 179.1271 68 Y 4.0551 8.3657 116.9439 61.0892 39.0256 177.8863 69 K 3.4811 8.4513 119.1509 58.7198 32.2770 177.5882 70 Y 4.3744 7.0913 114.2702 57.2385 39.0047 175.5897 71 G 4.1482 7.6932 107.9357 47.7052 0.0000 173.1633 72 I 4.7708 7.3715 118.2427 59.5142 40.5630 175.8658 73 D 5.2387 8.7297 123.5170 52.6732 45.7111 173.8993 74 V 4.8524 8.3142 120.2822 61.0710 33.2623 174.8566 75 L 4.5168 8.9424 128.1313 53.2747 43.0899 179.2488 76 A 3.3256 9.9159 124.4734 53.5375 17.6505 179.1251 77 G 3.9266 9.0576 108.3571 47.2197 0.0000 172.1974 78 V 4.4570 7.4984 119.9594 62.1695 32.2911 175.3701 79 I 4.2835 8.7814 130.6655 59.5019 38.6131 175.4236 80 D 4.7627 8.5603 127.1825 53.9630 41.4957 176.4520 81 E 4.1042 9.1748 122.6414 59.4967 29.8586 178.0784 82 D 5.0490 7.8970 116.5217 53.6036 40.2084 175.3316 83 Y 4.8829 7.9087 120.2786 57.4936 40.5401 175.2829 84 T 4.3030 7.9843 121.6109 63.0449 70.2929 174.3161 85 G 3.6541 5.5215 109.7499 43.0357 0.0000 172.7290 86 E 4.2035 8.2832 119.9412 55.7115 30.0785 176.0816 87 V 4.1143 8.7357 126.3077 62.8085 32.7698 174.6027 88 K 4.8173 8.7416 127.2172 54.7921 34.5138 176.1599 89 V 4.1838 8.4718 126.1837 61.3844 32.2990 174.4070 90 I 4.5097 8.1483 122.5325 60.0201 38.8659 174.7012 91 L 5.0223 8.6451 127.9786 53.5187 43.9557 175.1273 92 Y 5.1505 8.6909 123.7930 55.8390 41.8386 173.8407 93 N 4.4417 9.6049 126.0170 52.4791 39.5348 175.1461 94 T 4.0331 8.2776 121.8283 63.7093 68.0946 173.8018 95 T 4.6544 8.2737 112.3248 60.8454 71.4999 174.6576 96 E 4.1930 8.7426 117.4937 57.0590 30.6375 175.8180 97 R 4.4763 7.1607 120.2813 54.9230 30.7668 176.0076 98 D 4.7755 8.7009 125.4904 54.6365 42.9455 174.2756 99 Y 4.8665 8.3611 120.6004 55.9462 41.7625 174.1590 100 I 4.0337 7.7465 127.8653 60.6504 38.2743 175.6686 101 I 4.2280 8.8489 130.0344 59.2614 38.2700 175.2482 102 K 4.5915 8.3529 126.9492 55.6295 34.2162 176.6562 103 K 4.6709 8.4946 123.5416 57.6693 32.5812 176.0120 104 G 4.1213 8.7533 112.6918 45.4507 0.0000 174.0273 105 D 4.5479 7.8047 119.1276 54.6735 42.1416 176.0446 106 R 4.8179 8.5624 121.3013 55.5992 30.6237 176.2348 107 I 4.5413 8.1163 116.4484 60.9173 39.6473 174.5998 108 A 4.6770 7.5152 123.2590 51.7659 22.7538 174.3841 109 Q 4.8957 8.7060 114.6687 54.8956 32.2802 173.8627 110 L 4.6198 9.9847 126.5945 54.1508 43.8649 175.0107 111 I 4.5635 8.2743 127.1262 59.5869 39.8491 175.2603 112 L 4.6165 8.4253 127.9959 53.8494 40.6844 174.7238 113 E 4.1400 8.2634 122.4776 55.7043 30.8444 175.8372 114 Q 5.1922 8.9472 124.4076 55.2530 29.5055 175.3116 115 I 4.8718 8.1918 115.3861 59.3508 41.5496 174.8467 116 V 4.4273 8.3148 114.5108 59.9666 34.6942 176.6825 117 T 4.5320 8.1332 118.8621 59.8764 66.8418 172.8620 118 P 4.5059 0.0000 0.0000 61.9676 32.4601 175.4255 119 G 4.1168 8.4105 108.5719 44.6621 0.0000 172.1787 120 V 4.1931 8.0775 117.9924 60.7786 33.1193 174.9776 121 A 4.4383 8.2808 128.4292 50.5800 20.1019 175.8842 122 V 4.2075 8.0212 115.4787 61.6487 33.8133 174.9277 123 V 4.3188 7.5972 111.2032 61.0501 34.5680 174.6301 124 L 4.1459 8.6573 120.5908 56.2169 41.4205 177.0821 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.29 4.42 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.60 0.00 2 S 7.98 3.25 0.00 4.05 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 3 S 8.02 3.34 0.00 4.09 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 4 L 8.01 4.46 0.00 1.47 1.56 0.76 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.31 4.13 0.00 1.86 1.56 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.32 4.48 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 0.84 0.00 0.00 1.02 0.00 0.00 7 K 8.98 4.35 0.00 1.84 1.67 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.40 7.81 8 K 8.50 3.98 0.00 1.68 1.76 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.51 7.81 9 L 9.02 4.73 0.00 1.60 1.67 0.89 0.73 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 10 V 7.54 4.54 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 0.85 0.00 0.00 0.94 0.00 0.00 11 E 9.15 3.97 0.00 2.05 2.12 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 2.29 2.40 0.00 12 S 8.22 4.12 0.00 3.96 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 13 A 7.03 3.64 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.29 4.30 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 1.23 0.00 0.00 15 T 8.00 4.34 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 1.23 0.00 0.00 16 P 0.00 5.16 0.00 2.09 2.19 0.00 3.77 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 17 M 8.62 4.73 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 18 R 8.13 4.37 0.00 1.52 1.65 0.00 2.26 0.00 0.00 2.77 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 19 G 8.78 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 20 S 8.15 4.60 0.00 3.77 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 21 E 8.95 3.92 0.00 1.92 1.94 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 2.27 2.35 0.00 22 G 7.91 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 23 A 6.87 3.99 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 24 A 8.49 4.71 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.65 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 0.00 0.00 0.00 0.00 26 Y 9.78 4.68 0.00 2.86 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 D 9.18 4.77 0.00 2.76 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.54 4.77 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.13 1.03 0.00 0.00 29 S 8.70 4.93 0.00 3.80 4.07 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 0.00 0.00 0.00 30 S 9.43 4.41 0.00 3.87 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 31 V 8.69 4.32 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 0.85 0.00 0.00 0.97 0.00 0.00 32 E 7.83 4.99 0.00 2.05 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 2.18 2.25 0.00 33 D 8.71 5.35 0.00 2.52 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.89 4.72 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 0.87 0.00 0.00 0.95 0.00 0.00 35 V 8.24 4.83 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 0.76 0.00 0.00 0.96 0.00 0.00 36 V 8.58 4.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.94 0.00 0.00 37 P 0.00 4.61 0.00 2.13 2.26 0.00 3.87 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.87 0.00 38 A 8.90 4.08 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 39 M 8.33 3.43 0.00 2.18 2.15 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 2.55 2.63 0.00 40 G 8.33 4.51 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 0.00 41 R 8.10 5.83 0.00 2.00 2.18 0.00 2.73 0.00 0.00 3.85 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 42 I 7.94 4.18 1.90 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 1.30 0.98 0.95 0.00 0.00 43 A 8.67 4.69 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.36 4.03 2.12 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 0.95 0.00 0.00 0.97 0.00 0.00 45 S 9.36 5.05 0.00 3.81 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 46 T 8.72 4.29 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 47 G 9.25 4.65 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 0.00 0.00 0.00 48 I 7.20 5.07 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 1.14 0.56 0.97 0.00 0.00 49 S 8.66 5.11 0.00 3.76 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 50 I 8.19 5.83 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.50 0.92 0.00 0.00 51 R 8.27 4.58 0.00 1.77 1.84 0.00 3.16 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 52 V 8.51 3.91 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 0.75 0.00 0.00 0.96 0.00 0.00 53 P 0.00 4.21 0.00 2.05 2.00 0.00 3.67 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.25 0.00 54 D 8.11 5.00 0.00 2.76 2.55 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 55 G 8.60 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 56 T 7.26 4.77 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 1.24 0.00 0.00 57 Y 8.97 4.92 0.00 3.18 2.96 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 58 G 8.87 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 59 R 7.88 5.03 0.00 1.63 1.51 0.00 3.26 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 60 I 8.80 4.32 1.88 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 1.18 0.75 0.92 0.00 0.00 61 A 8.79 4.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.86 0.00 2.11 2.08 0.00 3.79 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 1.99 2.02 0.00 63 R 8.52 4.21 0.00 1.94 1.92 0.00 3.35 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 64 S 8.70 4.31 0.00 3.88 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 65 G 8.15 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 66 L 8.17 4.15 0.00 1.72 1.70 0.98 1.22 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 67 A 7.73 4.51 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 68 Y 8.37 4.06 0.00 2.86 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 69 K 8.45 3.48 0.00 0.79 0.74 0.00 1.64 0.00 0.00 1.58 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.22 1.46 7.81 70 Y 7.09 4.37 0.00 2.68 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 71 G 7.69 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 0.00 0.00 0.00 0.00 72 I 7.37 4.77 1.71 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 0.84 0.85 0.80 0.00 0.00 73 D 8.73 5.24 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.31 4.85 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 1.00 0.00 0.00 0.98 0.00 0.00 75 L 8.94 4.52 0.00 1.67 1.56 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 76 A 9.92 3.33 1.06 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 77 G 9.06 3.93 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 0.00 0.00 0.00 78 V 7.50 4.46 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 0.67 0.00 0.00 0.89 0.00 0.00 79 I 8.78 4.28 2.10 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 1.13 0.64 0.98 0.00 0.00 80 D 8.56 4.76 0.00 2.66 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 9.17 4.10 0.00 2.04 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 2.41 2.51 0.00 82 D 7.90 5.05 0.00 2.86 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 83 Y 7.91 4.88 0.00 3.05 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 84 T 7.98 4.30 4.08 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 1.13 0.00 0.00 85 G 5.52 3.65 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 0.00 0.00 0.00 86 E 8.28 4.20 0.00 1.95 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 2.34 2.32 0.00 87 V 8.74 4.11 2.16 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 0.93 0.00 0.00 1.09 0.00 0.00 88 K 8.74 4.82 0.00 1.68 1.73 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.59 1.39 7.81 89 V 8.47 4.18 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 1.01 0.00 0.00 0.96 0.00 0.00 90 I 8.15 4.51 1.90 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 1.53 0.63 0.92 0.00 0.00 91 L 8.65 5.02 0.00 1.68 1.62 0.97 0.67 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 92 Y 8.69 5.15 0.00 3.05 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 93 N 9.60 4.44 0.00 2.85 2.79 0.00 0.00 6.48 7.10 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 94 T 8.28 4.03 4.32 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 1.19 0.00 0.00 95 T 8.27 4.65 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 1.21 0.00 0.00 96 E 8.74 4.19 0.00 2.09 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 2.21 2.22 0.00 97 R 7.16 4.48 0.00 1.71 1.89 0.00 3.35 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 98 D 8.70 4.78 0.00 2.71 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 99 Y 8.36 4.87 0.00 2.85 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 0.00 100 I 7.75 4.03 1.55 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.81 0.74 0.00 0.00 101 I 8.85 4.23 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.82 0.94 0.00 0.00 102 K 8.35 4.59 0.00 1.79 1.85 0.00 1.47 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.69 1.45 7.81 103 K 8.49 4.67 0.00 1.82 1.77 0.00 1.62 0.00 0.00 1.56 0.00 0.00 3.25 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.40 7.81 104 G 8.75 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 D 7.80 4.55 0.00 2.83 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 0.00 106 R 8.56 4.82 0.00 1.74 1.91 0.00 3.33 0.00 0.00 3.30 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 107 I 8.12 4.54 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.70 0.99 0.00 0.00 108 A 7.52 4.68 1.30 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 0.00 0.00 109 Q 8.71 4.90 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 110 L 9.98 4.62 0.00 1.81 1.65 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.27 4.56 1.78 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 1.40 0.62 0.96 0.00 0.00 112 L 8.43 4.62 0.00 1.43 1.53 0.69 0.38 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 0.00 113 E 8.26 4.14 0.00 1.54 1.85 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 2.14 1.68 0.00 114 Q 8.95 5.19 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.20 0.00 115 I 8.19 4.87 1.91 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.70 1.21 0.00 0.00 116 V 8.31 4.43 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 0.75 0.00 0.00 0.94 0.00 0.00 117 T 8.13 4.53 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 1.21 0.00 0.00 118 P 0.00 4.51 0.00 2.07 2.02 0.00 3.64 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 119 G 8.41 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.08 4.19 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 0.92 0.00 0.00 121 A 8.28 4.44 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 0.00 122 V 8.02 4.21 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 0.74 0.00 0.00 0.93 0.00 0.00 123 V 7.60 4.32 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 0.65 0.00 0.00 0.93 0.00 0.00 124 L 8.66 4.15 0.00 1.61 1.60 0.92 0.76 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