NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4498 8.3349 116.7960 58.5884 64.2790 172.3190 2 Q 4.6796 8.2999 119.9382 52.6377 31.4580 171.9087 3 E 4.7825 8.8343 116.3404 56.4480 31.3842 176.1231 4 V 4.5579 7.7995 114.0263 62.8707 31.4812 174.5271 5 M 4.8997 7.5226 117.3676 54.4725 33.6196 175.9527 6 K 4.2687 8.1051 117.8224 55.8537 33.9008 175.4835 7 N 4.0013 8.6634 116.7839 55.1852 38.8624 172.6837 8 L 4.0846 8.5234 125.5899 54.4386 40.1106 174.0006 9 S 4.3797 8.9497 121.3546 61.1206 63.2507 175.8258 10 L 4.0782 8.3094 120.1780 54.7066 42.3154 178.2628 11 N 4.7632 8.4212 123.3665 53.1111 35.4009 176.1060 12 F 4.2847 8.1509 122.7340 60.3100 39.6347 177.5336 13 G 3.8028 8.4155 105.2093 48.0011 0.0000 175.6884 14 K 3.9977 8.1149 121.3895 58.6487 32.0425 179.2986 15 A 3.9353 7.5686 119.5576 55.3022 18.3284 179.6134 16 L 3.8161 8.3659 117.7296 58.0442 41.5077 179.3331 17 D 4.5682 8.0745 116.4231 56.6705 41.2215 177.9241 18 E 4.1700 7.9317 119.0686 59.5596 29.8373 178.0258 19 C 4.3783 8.3306 116.8616 59.9148 38.4705 176.3016 20 K 3.7424 8.5820 120.7899 59.7817 32.0392 178.9941 21 K 4.1533 8.2947 119.4223 58.2163 32.0952 179.0156 22 E 4.0518 7.9781 117.8285 59.5043 29.5261 177.8187 23 M 4.1912 8.1043 115.5853 55.2754 32.9793 176.2513 24 T 3.5023 6.9661 112.7393 64.5912 66.0357 171.0735 25 L 4.3763 7.9903 122.3306 53.4192 43.9259 176.5297 26 T 4.1578 8.1670 110.1245 62.3280 69.5215 172.9508 27 D 4.6926 8.4112 118.0446 54.5782 42.9908 177.4683 28 A 4.0125 8.3014 121.1357 55.5531 17.9690 179.1355 29 I 3.7015 7.9022 110.8039 64.6522 37.0999 177.2378 30 N 4.5385 8.1744 116.8226 55.2332 39.0012 175.9636 31 E 4.3296 7.9688 119.1340 58.9091 30.5697 177.3304 32 D 4.2598 8.3595 118.2782 57.2882 40.8543 178.2671 33 F 3.7542 8.1220 120.4196 61.4610 39.7205 176.4710 34 Y 2.0000 7.5722 115.6235 60.2159 37.6288 178.0647 35 N 3.8973 8.1412 117.6639 55.7877 38.2071 176.7974 36 F 4.1491 7.1663 121.5169 61.5531 39.2904 177.0921 37 W 4.1551 7.2430 117.1469 58.1109 29.2689 177.3077 38 K 4.0807 7.2342 117.8787 56.2825 31.8426 176.7591 39 E 4.0353 8.7053 121.5736 57.5611 29.9821 178.0584 40 G 3.9703 8.7444 108.4147 46.0649 0.0000 172.5423 41 Y 4.4167 7.5415 120.5497 55.6121 40.1158 175.2219 42 E 4.5666 8.8090 127.4239 55.3162 29.2730 175.6929 43 I 4.2940 8.1137 127.1435 59.3478 36.4163 176.6730 44 K 4.5128 7.7654 127.1428 56.0498 31.1586 175.4790 45 N 5.0825 7.2623 116.8534 51.8342 43.1172 175.0002 46 R 3.9795 8.4882 119.9154 59.5067 30.2408 179.2723 47 E 4.0132 8.1024 117.7204 59.5641 29.4550 179.4110 48 T 4.0992 7.8668 115.7587 66.3328 68.3908 176.7548 49 G 3.5773 7.4526 106.2443 47.9140 0.0000 175.1844 50 C 4.3261 8.3237 118.7035 59.5583 38.1258 175.8844 51 A 3.9314 8.5130 122.6981 55.4216 18.0253 179.3601 52 I 3.8759 7.9222 118.0624 65.2310 37.0860 178.4099 53 M 4.1797 8.3313 118.0886 58.3468 32.1673 176.8761 54 C 4.5122 8.3542 118.4557 58.9217 45.3966 175.4657 55 L 3.8109 8.4183 121.1320 57.4522 40.9334 179.3996 56 S 4.4981 8.0892 114.7965 59.8778 62.8086 174.6382 57 T 4.4190 7.4811 116.8096 61.8245 67.6573 173.8103 58 K 4.6053 8.0745 116.3812 55.1031 33.5164 178.2148 59 L 3.8012 8.1251 122.5775 58.0579 41.1691 178.8967 60 N 4.6154 7.9553 116.3167 55.1363 37.0460 176.4543 61 M 4.1712 7.7920 120.7520 57.8479 32.7435 178.1453 62 L 4.1338 7.5791 118.8861 56.0331 41.7308 176.3657 63 D 4.8781 7.9734 121.0752 51.2184 39.6890 175.2636 64 P 4.2751 0.0000 0.0000 65.2546 31.8872 177.2778 65 E 4.0923 8.1560 115.8929 56.3771 29.7295 176.6083 66 G 3.8424 8.0185 106.6834 46.5763 0.0000 175.0218 67 N 4.3849 8.3760 118.6488 54.5855 38.0476 174.9704 68 L 4.1010 8.0267 122.0901 53.8577 42.2622 175.1589 69 H 4.9406 8.5565 122.6170 53.4776 32.2243 172.6723 70 H 4.3757 8.8150 120.9905 57.4968 29.6385 175.0626 71 G 3.9816 9.2486 115.2974 46.2171 0.0000 173.5282 72 N 4.8389 8.4172 119.2990 51.6523 39.6087 173.8356 73 A 4.8801 8.2021 122.6465 51.3754 20.6340 178.1712 74 M 4.1736 8.2207 119.7286 59.2448 32.0100 178.6076 75 E 3.9612 8.1546 118.2648 59.2914 29.4399 178.7085 76 F 4.0878 8.4185 120.0250 61.3575 39.3263 176.6370 77 A 3.7401 8.6083 120.4796 55.3752 18.3503 179.8864 78 K 3.8948 7.9892 116.2942 59.1777 31.8049 179.6540 79 K 4.0555 7.6632 118.0653 58.4843 31.8208 177.3622 80 H 4.7574 6.9464 114.2207 55.1904 29.0882 174.5316 81 G 3.6711 7.8638 105.9036 46.1146 0.0000 173.8841 82 A 4.2212 7.9124 123.4688 50.2591 19.0535 178.5382 83 D 4.6219 7.9737 123.3599 52.6940 42.3813 176.2964 84 E 3.8768 8.6468 118.7436 60.3524 29.3360 179.0770 85 T 4.0940 7.8633 114.6689 66.5450 68.4823 176.7345 86 M 3.7615 7.7129 120.2159 58.0141 31.8880 178.3179 87 A 4.3952 8.2781 122.6260 54.8912 18.5639 179.2523 88 Q 3.9218 8.5518 118.3945 59.5117 28.9922 178.5885 89 Q 4.0877 8.2169 118.8713 59.3674 28.8245 179.1907 90 L 4.0931 8.0425 119.2127 57.8416 41.6312 179.8263 91 I 3.6525 8.0296 120.0693 64.2584 37.0732 177.8993 92 D 4.3314 8.3685 119.2163 57.2301 40.9283 178.4238 93 I 3.5829 7.6691 120.3743 64.2205 37.1292 178.2432 94 V 3.1922 7.4005 119.2065 66.5512 31.1116 177.8377 95 H 4.9458 7.2497 115.2452 57.6236 28.6947 177.6767 96 G 3.7314 8.0477 108.1374 47.4291 0.0000 174.8803 97 C 4.5449 8.1887 119.4328 58.0500 36.0434 175.7227 98 E 3.9080 8.1435 120.4354 59.0110 28.7110 179.3396 99 K 4.1618 7.5804 118.3414 59.3356 32.4426 179.0961 100 S 4.3467 7.9682 113.9108 60.6390 62.9596 174.6383 101 T 4.0363 7.1971 119.6574 62.3407 68.5577 172.3486 102 P 4.3089 0.0000 0.0000 62.2715 31.8698 176.0210 103 A 3.9759 8.5837 124.8846 52.5306 17.2143 176.2923 104 N 4.6617 8.5068 119.6007 53.6966 39.8731 175.1638 105 D 4.3303 8.7233 123.1863 56.0307 41.6987 175.8578 106 D 4.8653 8.1052 118.3617 52.2698 42.9854 176.2233 107 K 4.0805 8.6877 128.6197 59.6060 32.1924 179.2277 108 C 4.3434 8.3707 116.7323 60.2805 40.2530 176.2112 109 I 3.6509 7.9219 120.8190 63.8599 36.7041 177.7309 110 W 4.2758 8.5552 129.5538 61.2165 30.4076 177.9652 111 T 3.5004 8.4661 115.3560 66.5981 67.9744 176.3719 112 L 3.9455 8.2708 122.4447 57.7912 42.0015 178.9095 113 G 3.6837 7.9899 105.8115 47.9595 0.0000 175.3911 114 V 3.3374 7.3751 121.0745 65.4686 31.2933 177.6679 115 A 4.3651 7.9566 117.2592 53.8515 17.1958 179.1322 116 T 4.1745 7.9310 115.1707 66.3714 68.6397 176.0591 117 C 4.3317 8.2675 120.4701 59.7742 44.3377 174.9707 118 F 4.3102 8.4409 122.2554 61.6439 38.7532 176.7384 119 K 3.4827 7.5276 118.5747 59.7422 31.6572 178.5522 120 A 4.0128 7.5206 119.3687 54.9231 18.4804 179.1501 121 E 4.0978 8.3196 117.4835 59.4467 29.6723 179.1452 122 I 3.4419 7.8190 119.4737 64.7131 36.8782 177.3652 123 H 4.4198 7.7322 117.2823 58.0749 29.7505 176.5777 124 K 4.2294 7.8248 119.1272 57.4434 32.5877 177.1671 125 L 4.2509 6.6929 116.9403 54.6781 41.9856 176.7299 126 N 4.6848 8.7216 116.6544 53.1122 37.9289 174.1026 127 W 5.0136 7.6526 114.6785 54.8171 31.4323 174.4319 128 A 3.9676 8.4335 120.4042 49.8375 19.5994 174.2345 129 P 4.6187 0.0000 0.0000 63.4910 32.2791 177.7223 130 S 4.2030 8.4132 116.2722 58.8128 64.7198 175.7808 131 M 3.7401 8.2719 124.2602 58.4517 31.5266 178.6542 132 D 4.6008 7.9945 118.6651 57.9623 40.8435 178.4809 133 V 3.8885 7.6953 118.2690 65.3048 31.7129 177.4216 134 A 4.0977 8.2054 120.0448 55.4422 18.3784 179.7849 135 V 3.6658 8.0677 116.8328 66.2086 31.6475 178.2931 136 G 3.9313 8.2187 104.9514 47.9747 0.0000 175.5018 137 E 4.1064 8.8555 121.0331 59.4045 29.6877 179.2067 138 I 3.8185 8.0304 118.3304 63.8657 37.5358 178.0027 139 L 4.0813 8.2188 120.0222 57.7400 41.4960 179.0606 140 A 4.1837 8.2300 120.2927 54.3951 17.9295 177.7656 141 E 4.3934 7.4611 113.0360 58.0019 31.5775 176.1953 142 V 3.9229 8.1238 122.2410 63.2589 31.5864 175.6898 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 S 8.33 4.45 0.00 3.88 3.89 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 2 Q 8.30 4.68 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.52 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 3 E 8.83 4.78 0.00 2.03 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 0.00 2.20 2.37 0.00 4 V 7.80 4.56 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 0.98 0.00 0.00 1.01 0.00 0.00 5 M 7.52 4.90 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 6 K 8.11 4.27 0.00 1.90 1.88 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.49 7.81 7 N 8.66 4.00 0.00 2.72 2.85 0.00 0.00 7.06 8.00 0.00 0.00 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 L 8.52 4.08 0.00 2.01 1.92 1.48 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.95 4.38 0.00 4.15 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 10 L 8.31 4.08 0.00 1.79 1.05 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.42 4.76 0.00 2.77 2.85 0.00 0.00 6.94 7.12 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 12 F 8.15 4.28 0.00 3.39 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.42 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 0.00 0.00 0.00 14 K 8.11 4.00 0.00 1.93 1.86 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.61 7.81 15 A 7.57 3.94 1.29 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 0.00 0.00 16 L 8.37 3.82 0.00 1.90 1.71 0.77 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.07 4.57 0.00 2.80 2.88 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 18 E 7.93 4.17 0.00 2.23 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 0.00 2.30 2.50 0.00 19 C 8.33 4.38 0.00 2.90 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 20 K 8.58 3.74 0.00 1.97 2.07 0.00 1.30 0.00 0.00 1.64 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.65 7.81 21 K 8.29 4.15 0.00 1.88 1.88 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.65 7.81 22 E 7.98 4.05 0.00 2.06 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 2.31 2.46 0.00 23 M 8.10 4.19 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 24 T 6.97 3.50 4.24 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 1.21 0.00 0.00 25 L 7.99 4.38 0.00 1.65 1.63 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.17 4.16 4.24 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 1.23 0.00 0.00 27 D 8.41 4.69 0.00 2.75 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 28 A 8.30 4.01 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 29 I 7.90 3.70 1.88 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 1.60 0.59 0.91 0.00 0.00 30 N 8.17 4.54 0.00 2.78 2.91 0.00 0.00 7.21 7.79 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 31 E 7.97 4.33 0.00 2.15 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 2.26 2.32 0.00 32 D 8.36 4.26 0.00 2.78 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 33 F 8.12 3.75 0.00 2.91 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 34 Y 7.57 2.00 0.00 2.80 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 35 N 8.14 3.90 0.00 2.53 1.90 0.00 0.00 6.49 7.67 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 36 F 7.17 4.15 0.00 2.63 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 37 W 7.24 4.16 0.00 3.30 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 38 K 7.23 4.08 0.00 1.71 1.93 0.00 1.12 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.27 7.81 39 E 8.71 4.04 0.00 2.10 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 2.39 2.35 0.00 40 G 8.74 3.97 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 0.00 0.00 0.00 41 Y 7.54 4.42 0.00 3.16 2.77 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 42 E 8.81 4.57 0.00 2.00 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 0.00 2.25 2.41 0.00 43 I 8.11 4.29 1.97 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 0.48 0.79 0.00 0.00 44 K 7.77 4.51 0.00 1.84 1.86 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.41 7.81 45 N 7.26 5.08 0.00 2.75 2.62 0.00 0.00 7.05 7.90 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 46 R 8.49 3.98 0.00 1.89 1.96 0.00 3.18 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 47 E 8.10 4.01 0.00 2.03 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 2.39 2.45 0.00 48 T 7.87 4.10 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 0.63 0.00 0.00 49 G 7.45 3.58 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 0.00 0.00 0.00 50 C 8.32 4.33 0.00 3.17 3.16 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 51 A 8.51 3.93 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 52 I 7.92 3.88 2.12 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 1.72 1.19 1.06 0.00 0.00 53 M 8.33 4.18 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.81 0.00 54 C 8.35 4.51 0.00 3.13 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 55 L 8.42 3.81 0.00 2.05 1.86 0.35 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 56 S 8.09 4.50 0.00 4.39 4.24 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 57 T 7.48 4.42 4.27 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 1.27 0.00 0.00 58 K 8.07 4.61 0.00 1.90 1.64 0.00 1.71 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.54 7.81 59 L 8.13 3.80 0.00 1.56 1.57 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 60 N 7.96 4.62 0.00 2.81 2.92 0.00 0.00 6.36 7.62 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 61 M 7.79 4.17 0.00 1.92 2.19 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.65 0.00 62 L 7.58 4.13 0.00 1.51 1.25 0.57 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 63 D 7.97 4.88 0.00 2.62 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 64 P 0.00 4.28 0.00 2.20 2.21 0.00 3.77 0.00 0.00 3.83 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 65 E 8.16 4.09 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 2.32 0.00 66 G 8.02 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 67 N 8.38 4.38 0.00 2.89 2.99 0.00 0.00 6.20 7.83 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 68 L 8.03 4.10 0.00 0.95 1.39 0.49 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 69 H 8.56 4.94 0.00 3.19 3.14 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 H 8.82 4.38 0.00 3.10 3.23 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 9.25 3.98 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 0.00 72 N 8.42 4.84 0.00 2.71 2.74 0.00 0.00 6.88 8.64 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 73 A 8.20 4.88 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 74 M 8.22 4.17 0.00 2.07 2.17 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 2.72 2.62 0.00 75 E 8.15 3.96 0.00 2.05 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 2.43 2.34 0.00 76 F 8.42 4.09 0.00 3.11 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 77 A 8.61 3.74 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 78 K 7.99 3.89 0.00 2.04 1.84 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.61 7.81 79 K 7.66 4.06 0.00 1.45 1.71 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.62 7.81 80 H 6.95 4.76 0.00 3.04 3.13 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.86 3.67 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 0.00 82 A 7.91 4.22 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 83 D 7.97 4.62 0.00 2.79 2.74 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 84 E 8.65 3.88 0.00 2.02 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 0.00 2.39 2.43 0.00 85 T 7.86 4.09 4.30 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 1.17 0.00 0.00 86 M 7.71 3.76 0.00 1.12 1.92 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.81 0.00 87 A 8.28 4.40 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 88 Q 8.55 3.92 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 89 Q 8.22 4.09 0.00 2.75 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.64 0.00 0.00 0.00 0.00 0.00 2.67 2.84 0.00 90 L 8.04 4.09 0.00 1.98 1.91 1.29 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.03 3.65 2.01 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 1.72 0.68 0.95 0.00 0.00 92 D 8.37 4.33 0.00 2.97 2.66 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 0.00 0.00 0.00 0.00 93 I 7.67 3.58 1.73 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 1.40 0.55 0.76 0.00 0.00 94 V 7.40 3.19 1.84 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 0.91 0.00 0.00 0.50 0.00 0.00 95 H 7.25 4.95 0.00 3.17 3.35 0.00 5.69 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.05 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 97 C 8.19 4.54 0.00 3.07 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 98 E 8.14 3.91 0.00 2.37 2.42 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 2.65 2.67 0.00 99 K 7.58 4.16 0.00 1.81 1.90 0.00 1.81 0.00 0.00 1.93 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.67 1.62 7.81 100 S 7.97 4.35 0.00 4.06 4.14 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 0.00 101 T 7.20 4.04 4.24 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 1.17 0.00 0.00 102 P 0.00 4.31 0.00 2.25 2.12 0.00 3.85 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 2.07 2.02 0.00 103 A 8.58 3.98 1.18 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 0.00 0.00 104 N 8.51 4.66 0.00 2.94 3.07 0.00 0.00 7.28 8.54 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 0.00 105 D 8.72 4.33 0.00 2.66 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 0.00 106 D 8.11 4.87 0.00 2.79 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 0.00 107 K 8.69 4.08 0.00 1.94 1.88 0.00 1.43 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.57 1.76 7.81 108 C 8.37 4.34 0.00 3.22 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 0.00 109 I 7.92 3.65 1.94 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 1.53 1.00 0.95 0.00 0.00 110 W 8.56 4.28 0.00 3.40 3.49 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 0.00 111 T 8.47 3.50 4.53 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 1.31 0.00 0.00 112 L 8.27 3.95 0.00 1.55 1.58 0.53 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.99 3.68 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 0.00 0.00 0.00 114 V 7.38 3.34 1.73 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 0.89 0.00 0.00 -0.48 0.00 0.00 115 A 7.96 4.37 1.55 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 0.00 0.00 116 T 7.93 4.17 4.43 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 1.27 0.00 0.00 117 C 8.27 4.33 0.00 2.98 3.26 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 0.00 118 F 8.44 4.31 0.00 3.11 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 0.00 119 K 7.53 3.48 0.00 1.75 1.61 0.00 1.34 0.00 0.00 1.16 0.00 0.00 2.72 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.14 1.06 7.81 120 A 7.52 4.01 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 0.00 121 E 8.32 4.10 0.00 2.25 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 2.51 0.00 122 I 7.82 3.44 1.81 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.22 0.55 0.00 0.00 123 H 7.73 4.42 0.00 3.10 3.50 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.82 4.23 0.00 1.92 1.83 0.00 1.93 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.58 7.81 125 L 6.69 4.25 0.00 1.58 1.39 0.73 1.32 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 0.00 126 N 8.72 4.68 0.00 2.91 3.00 0.00 0.00 5.94 9.01 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 0.00 127 W 7.65 5.01 0.00 3.52 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 0.00 128 A 8.43 3.97 1.12 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 0.00 129 P 0.00 4.62 0.00 1.91 2.13 0.00 3.07 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.39 0.00 130 S 8.41 4.20 0.00 3.73 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 0.00 131 M 8.27 3.74 0.00 1.19 1.61 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.03 0.00 132 D 7.99 4.60 0.00 2.60 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 0.00 133 V 7.70 3.89 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 1.25 0.00 0.00 0.86 0.00 0.00 134 A 8.21 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.07 3.67 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 1.12 0.00 0.00 0.40 0.00 0.00 136 G 8.22 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 0.00 137 E 8.86 4.11 0.00 2.23 2.25 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 2.57 2.71 0.00 138 I 8.03 3.82 2.18 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 1.63 1.60 1.29 0.00 0.00 139 L 8.22 4.08 0.00 2.12 1.81 1.38 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.23 4.18 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 0.00 141 E 7.46 4.39 0.00 2.00 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 2.30 2.43 0.00 142 V 8.12 3.92 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 0.83 0.00 0.00 0.95 0.00 0.00