NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5469 8.3649 120.1911 54.2806 42.3362 175.3341 2 C 4.8427 8.3237 121.3206 53.7467 42.7383 171.4850 3 P 4.6650 0.0000 0.0000 62.3797 32.4106 177.8102 4 S 4.1876 8.8376 115.9875 61.2445 62.7995 174.9933 5 D 4.6021 8.3231 117.9465 53.6589 39.8591 175.5730 6 W 4.9593 8.3965 119.9386 55.2819 32.3120 175.2247 7 S 5.0820 9.4371 117.4327 56.9398 65.3680 174.1624 8 S 5.1216 8.9183 119.2964 58.2380 64.8767 173.9165 9 Y 3.8365 9.1862 119.7073 57.8156 40.4235 173.1758 10 E 3.5315 9.0262 129.2372 57.5376 26.4986 175.1693 11 G 3.8998 7.8337 103.1819 46.2620 0.0000 170.7996 12 H 5.1049 7.7232 114.8641 53.7839 33.4668 171.6285 13 C 5.4183 8.3093 118.4515 55.3637 40.8929 172.7189 14 Y 5.8327 9.5846 120.6301 56.4793 41.9808 174.7856 15 K 4.5742 8.9420 123.6268 54.6358 35.6452 173.3967 16 P 5.2394 0.0000 0.0000 62.3957 32.5539 175.2327 17 F 4.7185 9.3031 119.4167 55.8831 42.4642 176.2050 18 S 3.3141 8.4683 115.5430 59.9783 63.7368 173.8780 19 E 3.8874 7.8923 120.1583 55.7661 29.5504 175.5791 20 P 4.6112 0.0000 0.0000 62.8653 32.0502 176.2611 21 K 4.8076 8.9241 122.4703 54.5062 37.2277 175.8783 22 N 5.9491 8.6308 119.2523 51.6308 38.6836 175.8067 23 W 2.5778 8.4575 127.8941 60.1586 30.3855 177.6340 24 A 3.9626 8.0142 119.8023 55.5436 17.7966 179.2667 25 D 4.1952 7.8697 116.4572 57.0542 40.7825 178.8149 26 A 2.9142 7.3539 121.3804 54.6473 18.3750 178.9690 27 E 3.3661 6.9894 117.6391 59.4073 29.3151 178.3862 28 N 4.1353 7.5346 115.5254 56.6806 39.1982 176.0764 29 F 4.2802 8.1983 121.9773 61.5709 39.4272 176.2771 30 C 4.2711 8.4205 116.5132 60.4098 39.8554 176.3132 31 T 4.0668 7.4745 110.7395 63.6013 68.2303 175.3436 32 Q 4.2718 7.5794 118.8706 56.1543 29.1643 176.5130 33 Q 4.3424 7.6304 119.0843 55.7601 30.1161 175.0029 34 H 4.0675 7.2552 117.1753 54.8549 32.3288 172.9148 35 A 3.9639 8.1846 127.6906 53.9813 18.4084 177.6871 36 G 3.9218 8.7562 109.4954 46.3104 0.0000 173.7602 37 G 4.0649 7.6894 106.5635 46.3575 0.0000 173.2818 38 H 5.2490 8.8536 118.5124 54.2738 34.1749 172.9918 39 L 4.7887 8.9135 120.5335 54.6168 42.0934 178.2217 40 V 4.3444 8.7263 122.2981 62.2772 32.4831 175.3688 41 S 4.6207 9.0593 116.0549 56.4049 65.8160 173.3835 42 F 5.3930 8.5689 120.6844 56.3469 40.3327 175.2382 43 Q 4.6271 9.9500 126.9308 56.3477 29.9586 175.2175 44 S 4.7411 7.6245 111.1498 56.7152 67.2982 175.0058 45 S 4.0702 8.5275 117.9251 61.7059 62.5278 176.7960 46 E 3.9259 8.0959 120.8752 59.1771 29.3121 178.7503 47 E 3.3997 8.1450 118.8467 59.1780 29.6785 178.7284 48 A 2.5800 7.3567 120.5266 54.6632 18.1976 179.2171 49 D 4.0353 7.8200 117.3259 57.4544 40.9270 178.8129 50 F 3.8564 7.9009 121.1481 61.1827 39.1333 177.3598 51 V 3.0430 7.2944 117.7487 65.5387 31.2000 178.1336 52 V 3.3273 7.4284 118.2615 65.7631 31.3481 177.6091 53 K 3.7157 7.7491 119.3543 59.4812 31.8440 178.1770 54 L 3.7408 7.3157 119.8824 58.0460 41.9800 178.5041 55 A 3.6497 7.7912 120.7908 55.1411 18.1717 179.4052 56 F 4.1546 8.3535 118.9672 61.7175 39.3236 177.2788 57 Q 4.0276 8.2352 116.6238 59.1784 28.4678 179.1087 58 T 3.6370 7.7711 116.2245 65.8102 68.7277 175.6736 59 F 4.8814 8.0775 115.3436 56.2096 41.1671 177.8355 60 G 2.8678 7.9758 109.1728 45.5204 0.0000 173.8560 61 H 4.4277 8.7895 121.0153 56.6668 29.1202 174.3427 62 S 4.6314 8.3199 118.6042 58.0282 67.2134 174.5205 63 I 5.1177 7.2124 113.7235 58.9527 40.5843 174.4723 64 F 5.0783 8.7608 122.6890 55.0853 41.9067 174.6356 65 W 5.1614 9.3825 123.3078 57.4322 30.2702 174.9264 66 M 4.9148 9.3937 122.5689 52.9982 35.4202 176.3508 67 G 3.8364 8.6582 109.0468 45.8293 0.0000 173.3540 68 L 4.5844 8.1960 120.9466 52.3819 43.5164 176.1843 69 S 3.8840 7.7294 116.8462 56.1013 66.0590 173.5356 70 N 4.2802 7.5924 114.7961 53.7209 35.3990 176.4257 71 V 3.2814 7.1580 112.3974 63.1707 32.4769 177.9734 72 W 5.0344 7.6166 116.8051 56.3152 30.7495 176.9653 73 N 4.4680 7.9600 117.3733 56.0555 38.0479 176.4012 74 Q 4.4617 7.9823 114.2692 56.0148 29.1666 175.3862 75 C 4.3585 7.7579 116.5563 59.2175 28.8986 173.5529 76 N 4.6706 8.0821 120.1994 52.0976 37.2277 173.2934 77 W 4.4307 8.4680 123.9416 55.9475 30.2253 176.1561 78 Q 4.5933 8.0895 119.7438 54.4944 32.3575 174.0413 79 W 4.4863 8.5429 121.3161 56.3927 29.7357 177.9196 80 S 4.4447 9.0448 117.9181 60.8202 62.5281 174.5622 81 N 4.6076 8.4071 116.7071 52.0928 37.2895 174.6624 82 A 3.8237 8.4740 119.8601 53.3253 16.7898 177.9252 83 A 4.3455 7.9364 121.0598 52.9939 19.2087 178.6757 84 M 4.1473 8.5515 121.1233 55.3186 32.4221 176.2585 85 L 4.6189 8.7278 125.9392 55.2990 41.9480 175.0967 86 R 4.5324 8.6656 122.9446 57.8648 32.5397 175.3797 87 Y 4.3214 8.2042 117.7849 57.3385 39.3349 174.9217 88 K 4.5415 8.0176 125.6920 54.8656 35.2688 176.2722 89 A 4.5314 7.5453 124.2266 50.4512 19.0839 176.9925 90 W 4.1000 8.2577 120.7170 57.5425 29.9748 177.1252 91 A 4.2460 8.8454 126.2726 54.5259 18.2435 177.6010 92 E 4.8180 8.0358 112.9363 54.5462 33.3478 175.5094 93 E 3.9843 8.7497 120.1311 58.4975 30.6742 176.7313 94 S 4.6913 7.4276 111.6979 57.1608 66.4715 173.0359 95 Y 4.9430 8.5434 118.5889 56.5689 41.2629 175.2505 96 C 5.0572 9.4898 118.5045 55.1235 46.0349 173.1334 97 V 5.0955 8.4536 121.4871 62.2866 33.0202 174.4837 98 Y 5.5966 8.9383 124.7095 55.6466 42.2496 173.4090 99 F 5.3589 8.8823 113.5004 55.0288 42.1045 173.5839 100 K 5.3295 8.8330 119.1441 55.1284 34.6743 177.3816 101 S 4.5827 9.2604 118.1964 60.8297 63.0394 175.3290 102 T 4.0954 7.9886 110.4788 63.1417 69.4071 173.8949 103 N 4.8682 7.9540 117.5603 51.9512 40.2114 173.1934 104 N 4.7425 8.4416 114.1085 52.7534 37.6648 175.0996 105 K 4.3609 7.9365 118.0502 56.4683 32.9729 176.5218 106 W 4.7853 8.8335 123.3986 56.6885 29.9709 175.8112 107 R 4.9742 8.9244 122.7600 54.3155 33.9746 174.3354 108 S 5.6987 8.7725 114.4805 57.2103 65.8798 173.3771 109 R 5.0284 9.3588 120.4685 54.8332 34.1362 173.9124 110 A 3.6705 8.6499 126.9109 52.4621 18.8676 179.4279 111 C 4.1333 9.0346 120.6362 59.6333 40.5031 176.4075 112 R 3.7708 7.7641 114.8007 58.5480 29.7205 176.4568 113 M 4.4666 7.9991 118.9518 55.4873 33.5061 175.0944 114 M 5.2951 8.0526 118.7555 54.3824 34.9066 175.1693 115 A 3.9409 7.8656 119.7841 51.2872 23.5381 176.2279 116 Q 4.5187 7.5564 118.8505 55.9025 31.0099 174.8151 117 F 5.3534 7.8711 112.5807 56.8714 41.8577 172.9814 118 V 5.0366 8.4003 119.5253 61.5458 34.2709 173.9582 119 C 5.6629 9.6790 124.8734 55.9677 38.8388 172.1651 120 E 5.9800 9.8371 120.4405 55.7876 33.2499 173.7475 121 F 5.2428 7.9491 118.6201 55.4381 41.5043 173.4151 122 Q 4.2537 9.0482 121.4113 55.7153 30.3729 175.5635 123 A 4.1308 8.3035 124.8859 52.6820 19.3020 176.7174 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 D 8.36 4.55 0.00 2.64 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 2 C 8.32 4.84 0.00 3.16 3.07 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 3 P 0.00 4.67 0.00 2.46 2.10 0.00 3.66 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 4 S 8.84 4.19 0.00 4.03 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 0.00 5 D 8.32 4.60 0.00 2.79 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.40 4.96 0.00 3.30 3.28 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 0.00 7 S 9.44 5.08 0.00 3.98 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 0.00 8 S 8.92 5.12 0.00 3.89 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 9 Y 9.19 3.84 0.00 1.43 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 10 E 9.03 3.53 0.00 2.05 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 1.57 1.47 0.00 11 G 7.83 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 12 H 7.72 5.10 0.00 3.42 2.59 0.00 5.57 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 8.31 5.42 0.00 1.23 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 9.58 5.83 0.00 3.09 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.94 4.57 0.00 0.79 0.74 0.00 0.63 0.00 0.00 0.82 0.00 0.00 2.13 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.35 0.83 7.81 16 P 0.00 5.24 0.00 2.38 1.95 0.00 3.50 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 1.70 1.75 0.00 17 F 9.30 4.72 0.00 1.51 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.47 3.31 0.00 3.41 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.89 3.89 0.00 1.78 1.88 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 2.26 2.25 0.00 20 P 0.00 4.61 0.00 1.84 1.85 0.00 3.54 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 1.88 2.00 0.00 21 K 8.92 4.81 0.00 1.44 1.47 0.00 1.10 0.00 0.00 1.40 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.53 7.81 22 N 8.63 5.95 0.00 3.18 3.10 0.00 0.00 6.35 8.88 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 23 W 8.46 2.58 0.00 1.93 2.68 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 0.00 0.00 0.00 0.00 24 A 8.01 3.96 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 25 D 7.87 4.20 0.00 2.55 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 26 A 7.35 2.91 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 6.99 3.37 0.00 1.16 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 1.95 2.12 0.00 28 N 7.53 4.14 0.00 2.67 2.74 0.00 0.00 7.29 6.46 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 29 F 8.20 4.28 0.00 3.05 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.42 4.27 0.00 3.22 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 31 T 7.47 4.07 4.13 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 0.00 0.00 0.00 1.22 0.00 0.00 32 Q 7.58 4.27 0.00 1.81 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.86 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 33 Q 7.63 4.34 0.00 2.40 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.83 0.00 0.00 0.00 0.00 0.00 2.07 2.23 0.00 34 H 7.26 4.07 0.00 2.71 2.45 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.18 3.96 1.08 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 0.00 0.00 36 G 8.76 3.92 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 0.00 0.00 0.00 37 G 7.69 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 0.00 0.00 0.00 38 H 8.85 5.25 0.00 3.15 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.91 4.79 0.00 1.55 1.70 0.25 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.73 4.34 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.29 0.00 0.00 41 S 9.06 4.62 0.00 3.98 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 42 F 8.57 5.39 0.00 3.38 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 Q 9.95 4.63 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.66 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 44 S 7.62 4.74 0.00 4.09 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.53 4.07 0.00 3.87 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 46 E 8.10 3.93 0.00 2.18 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 0.00 2.46 2.45 0.00 47 E 8.15 3.40 0.00 2.28 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 2.48 2.40 0.00 48 A 7.36 2.58 0.50 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 0.00 0.00 49 D 7.82 4.04 0.00 2.75 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 50 F 7.90 3.86 0.00 2.34 2.34 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 51 V 7.29 3.04 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 1.06 0.00 0.00 0.78 0.00 0.00 52 V 7.43 3.33 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 0.97 0.00 0.00 0.53 0.00 0.00 53 K 7.75 3.72 0.00 1.88 1.67 0.00 1.54 0.00 0.00 1.49 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.45 7.81 54 L 7.32 3.74 0.00 1.10 1.33 0.72 0.94 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 55 A 7.79 3.65 0.75 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 0.00 0.00 56 F 8.35 4.15 0.00 3.31 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 57 Q 8.24 4.03 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 58 T 7.77 3.64 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 -0.22 0.00 0.00 59 F 8.08 4.88 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 60 G 7.98 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 0.00 0.00 0.00 61 H 8.79 4.43 0.00 3.26 3.39 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.32 4.63 0.00 3.82 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 63 I 7.21 5.12 1.61 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 -0.03 0.96 0.00 0.00 64 F 8.76 5.08 0.00 2.12 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 65 W 9.38 5.16 0.00 3.30 2.91 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 66 M 9.39 4.91 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 67 G 8.66 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 68 L 8.20 4.58 0.00 1.57 1.41 0.75 0.77 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 69 S 7.73 3.88 0.00 2.72 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 70 N 7.59 4.28 0.00 2.64 2.89 0.00 0.00 7.63 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 71 V 7.16 3.28 1.65 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 0.42 0.00 0.00 -0.52 0.00 0.00 72 W 7.62 5.03 0.00 3.81 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 73 N 7.96 4.47 0.00 2.61 2.80 0.00 0.00 6.91 7.18 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 74 Q 7.98 4.46 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 75 C 7.76 4.36 0.00 3.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.08 4.67 0.00 2.66 2.69 0.00 0.00 7.01 7.95 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 77 W 8.47 4.43 0.00 3.39 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 78 Q 8.09 4.59 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 79 W 8.54 4.49 0.00 3.47 3.27 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 80 S 9.04 4.44 0.00 4.03 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 0.00 81 N 8.41 4.61 0.00 2.86 2.98 0.00 0.00 6.01 7.26 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 82 A 8.47 3.82 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.94 4.35 1.16 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 0.00 0.00 0.00 84 M 8.55 4.15 0.00 2.12 2.11 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 2.67 2.61 0.00 85 L 8.73 4.62 0.00 1.74 1.75 1.05 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 86 R 8.67 4.53 0.00 1.92 2.00 0.00 3.50 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 87 Y 8.20 4.32 0.00 2.93 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 88 K 8.02 4.54 0.00 1.73 1.89 0.00 2.00 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.64 1.63 7.81 89 A 7.55 4.53 1.07 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 0.00 0.00 90 W 8.26 4.10 0.00 3.19 3.36 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 91 A 8.85 4.25 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.04 4.82 0.00 2.10 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 2.29 2.19 0.00 93 E 8.75 3.98 0.00 1.87 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 2.16 2.16 0.00 94 S 7.43 4.69 0.00 3.77 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 95 Y 8.54 4.94 0.00 2.45 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 96 C 9.49 5.06 0.00 2.47 2.48 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 97 V 8.45 5.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.90 0.00 0.00 98 Y 8.94 5.60 0.00 3.05 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 99 F 8.88 5.36 0.00 3.26 3.32 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 0.00 100 K 8.83 5.33 0.00 2.06 2.20 0.00 1.66 0.00 0.00 1.97 0.00 0.00 3.01 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.57 1.58 7.81 101 S 9.26 4.58 0.00 4.50 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 7.99 4.10 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 0.00 103 N 7.95 4.87 0.00 2.84 2.79 0.00 0.00 6.94 7.95 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 0.00 104 N 8.44 4.74 0.00 2.65 2.71 0.00 0.00 6.08 7.13 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 0.00 105 K 7.94 4.36 0.00 1.86 1.86 0.00 1.93 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 106 W 8.83 4.79 0.00 3.15 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 0.00 107 R 8.92 4.97 0.00 0.67 1.60 0.00 2.75 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 108 S 8.77 5.70 0.00 4.27 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 0.00 109 R 9.36 5.03 0.00 1.92 1.92 0.00 2.21 0.00 0.00 2.82 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.58 0.00 110 A 8.65 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 9.03 4.13 0.00 2.80 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 0.00 112 R 7.76 3.77 0.00 1.89 2.01 0.00 3.01 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 113 M 8.00 4.47 0.00 1.99 2.25 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 2.60 2.50 0.00 114 M 8.05 5.30 0.00 1.83 1.88 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 115 A 7.87 3.94 -0.13 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 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.56 4.52 0.00 1.01 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.58 0.00 0.00 0.00 0.00 0.00 2.06 1.70 0.00 117 F 7.87 5.35 0.00 3.29 3.32 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 0.00 118 V 8.40 5.04 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.06 0.00 0.00 119 C 9.68 5.66 0.00 3.15 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 9.84 5.98 0.00 2.14 1.86 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 2.09 1.50 0.00 121 F 7.95 5.24 0.00 2.93 2.93 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 0.00 122 Q 9.05 4.25 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.09 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 123 A 8.30 4.13 1.28 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 0.00 0.00 0.00