NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.6303 8.3044 120.2866 55.3173 33.9071 173.9807 3 V 4.1605 8.8869 123.5258 59.9606 33.4084 173.1170 4 W 4.6072 9.1416 135.0000 57.5115 31.5718 174.8933 5 T 4.1528 8.1576 123.8582 61.5531 67.0494 172.4644 6 P 4.6138 0.0000 0.0000 62.8356 32.3269 175.3367 7 V 4.0642 7.3730 119.9594 62.7519 32.7258 175.3039 8 N 4.2767 8.6646 125.2334 54.9699 36.0841 173.4063 9 N 5.0621 7.6256 108.7790 52.9655 40.0967 174.1984 10 K 4.1421 8.3042 116.0035 56.5468 32.7915 176.6432 11 M 4.9576 8.3274 120.8243 54.0054 35.3111 175.5659 12 F 4.5508 8.2746 115.6814 57.2520 40.8829 175.7379 13 E 3.4736 8.1682 122.7369 57.0170 28.1634 175.0924 14 T 3.7549 8.4309 120.1455 66.7140 68.9158 174.0064 15 F 4.4681 9.0698 123.8755 57.7197 36.6214 176.4684 16 S 4.4948 8.3918 114.9967 60.3172 63.0701 174.4537 17 Y 4.4003 8.2755 117.4068 57.9903 38.1470 174.9730 18 L 4.7772 7.5336 119.7649 52.0497 43.9146 174.5438 19 P 4.4775 0.0000 0.0000 61.6749 31.8374 174.8892 20 P 4.2035 0.0000 0.0000 63.1047 31.6636 176.4251 21 L 4.2097 8.3815 123.2965 54.6048 42.2797 177.9231 22 S 4.5052 9.0725 119.4639 57.5928 65.4833 175.1406 23 D 4.3694 8.4820 121.2329 57.4646 40.4498 178.6973 24 E 3.9221 8.0718 119.3807 59.4181 29.8251 178.7794 25 Q 3.9614 7.9325 117.6779 58.7602 28.7060 178.7862 26 I 3.7659 7.9259 120.8618 64.2772 37.1133 178.2307 27 A 4.0635 8.2844 121.5540 55.1250 18.1946 179.5469 28 A 4.1140 8.0797 119.3412 55.4910 18.5650 179.9312 29 Q 4.0933 7.9577 116.1620 59.0316 28.7575 179.1309 30 V 3.7854 8.0374 119.4817 66.1503 31.5249 177.8594 31 D 4.4423 8.4712 118.9503 57.4151 40.6492 178.1621 32 Y 4.1541 8.0911 120.1793 60.6314 38.8339 178.0902 33 I 3.9595 7.8345 120.3522 64.5694 37.3101 178.6399 34 V 3.5524 7.8081 118.7627 65.9606 31.1554 177.9217 35 A 3.9384 8.0857 119.7812 54.5277 18.2487 178.3296 36 N 4.0490 7.1313 111.8928 52.0262 38.6155 175.5773 37 G 3.7702 7.2739 108.2165 46.1894 0.0000 174.1625 38 W 4.9025 7.6551 118.9137 55.9138 30.8410 176.5374 39 I 4.4560 8.9532 123.4060 59.3914 37.4401 174.0388 40 P 4.8995 0.0000 0.0000 63.2596 32.8826 174.8533 41 C 5.0105 8.8364 119.7887 58.5853 35.6214 172.3550 42 L 5.3407 8.6973 123.8898 53.1669 44.5125 175.2014 43 E 5.6257 9.1751 121.2299 54.8975 34.1057 174.5710 44 F 5.6328 9.1279 116.4966 56.1056 42.2611 172.8909 45 A 4.4076 8.2078 119.0986 50.5529 22.7085 176.2896 46 E 4.4048 8.4390 118.3669 55.6440 31.1515 177.9696 47 S 4.3984 8.9657 115.8634 62.2789 62.8795 176.9026 48 D 4.5943 8.1646 117.0998 56.1594 40.6951 177.0088 49 K 4.6264 7.8839 117.2938 56.0158 32.6886 177.0074 50 A 3.8768 7.7548 124.4557 54.1314 18.5085 178.4002 51 Y 4.7476 7.4034 111.0150 55.6154 40.6758 176.0421 52 V 4.4762 8.4926 115.1638 61.5548 32.3061 175.6538 53 S 4.7667 8.3962 116.2623 57.5208 66.2744 173.7516 54 N 5.0454 8.5836 114.3957 52.6761 39.7062 176.2229 55 E 3.9052 8.5496 119.4228 60.1965 29.2122 179.5589 56 S 4.0271 8.7964 115.7483 60.4609 62.7399 176.2363 57 A 2.5800 7.7363 123.4273 53.8456 17.7240 179.1538 58 I 3.5334 7.0949 116.1038 63.4817 38.0601 177.1071 59 R 4.3382 7.4757 116.4862 55.5462 30.5057 176.2383 60 F 4.9866 7.3369 118.2766 56.2868 41.1634 176.5152 61 G 4.0859 8.1613 114.1152 45.9271 0.0000 175.1868 62 S 4.6117 8.4225 113.4187 58.6686 62.1517 174.3856 63 V 4.4695 7.2138 106.9311 61.2112 33.2107 177.5412 64 S 4.5196 8.2493 114.1249 59.2562 63.5805 173.3911 65 C 4.1438 8.0599 119.3981 61.5738 27.9703 173.2591 66 L 3.5607 8.4762 124.0874 55.7847 38.9361 173.4083 67 Y 4.4375 7.3593 118.4418 55.7868 40.7666 174.3406 68 Y 4.9023 7.1342 122.9090 56.6625 42.4005 174.3663 69 D 4.5842 9.1526 123.3103 54.8925 42.1167 177.1736 70 N 4.5315 8.8841 116.5023 54.0828 35.9414 175.9556 71 R 3.9935 7.9205 118.8580 59.1041 30.4591 177.0094 72 Y 4.4646 7.7551 114.7301 57.6253 38.5357 174.5658 73 W 5.0677 8.7023 123.4219 55.2435 33.0090 174.3853 74 T 4.3032 8.1385 117.1479 62.6627 69.4903 174.5329 75 M 4.7066 8.5101 126.4253 55.1807 33.2213 175.1332 76 W 4.8246 9.5277 135.0000 56.2570 31.4292 176.8442 77 K 3.4037 8.5381 128.4450 57.4475 30.7939 177.9943 78 L 4.9047 8.2467 124.9625 52.7716 45.4094 173.8822 79 P 4.2553 0.0000 0.0000 63.2507 32.2328 177.7842 80 M 4.3433 8.6076 123.6626 53.7915 30.3476 175.9499 81 F 4.4698 7.3384 118.1175 59.0545 40.0089 176.6781 82 G 3.9879 9.1455 112.2303 45.6222 0.0000 173.1534 83 C 4.2729 7.9778 120.9530 59.7154 31.7797 173.2181 84 R 4.5709 8.6344 123.9933 55.5072 31.4045 174.4201 85 D 4.7854 7.8967 118.2901 51.1270 42.9028 174.3358 86 P 4.3510 0.0000 0.0000 66.3717 30.9912 178.1931 87 M 4.1047 8.3615 118.5449 58.2012 31.8449 178.4162 88 Q 3.9824 8.1242 119.9001 58.9558 29.2055 178.4378 89 V 3.6071 7.7376 118.8961 66.0305 31.8319 177.7992 90 L 4.0150 8.0614 118.7330 57.9591 41.3953 179.7895 91 R 3.9749 8.2420 118.0483 59.3530 30.0077 179.0171 92 E 4.1254 8.2894 118.2662 59.2812 29.4052 179.4124 93 I 3.5843 7.6307 120.1695 64.1288 37.1070 178.6328 94 V 3.4588 7.5507 118.4048 65.8953 31.4005 177.9896 95 A 3.9565 8.0665 120.6348 55.1316 18.2333 179.1971 96 C 2.0000 7.8821 117.5821 62.0457 31.1557 176.0292 97 T 3.7325 7.5488 111.0265 64.1684 68.0005 176.3987 98 K 3.8908 7.6076 122.0875 59.2400 32.3066 178.3607 99 A 3.9990 7.6066 120.1951 53.4994 19.7657 177.6808 100 F 4.6381 7.7371 115.6877 54.8191 39.0097 174.0797 101 P 4.3370 0.0000 0.0000 64.3958 31.7572 177.9664 102 D 4.6941 8.0928 116.5468 53.7569 41.0838 175.2269 103 A 4.8757 7.3514 121.0845 50.2187 21.9306 176.6255 104 Y 4.2142 8.9080 117.2896 57.6607 39.6395 175.3447 105 V 5.2576 8.8135 122.6017 61.2804 35.3463 174.2223 106 R 4.9516 9.4515 123.6430 54.2739 33.1690 173.6773 107 L 4.8890 8.1897 123.2117 53.7349 44.1626 175.6543 108 V 4.9026 8.6866 118.1716 59.7411 36.7874 173.9612 109 A 4.8550 7.9501 121.7258 50.7474 22.7139 175.4420 110 F 5.2574 9.1100 120.1577 55.7147 42.8147 174.2518 111 D 5.4303 8.8153 121.5144 52.6418 42.9186 176.2941 112 N 4.7606 9.2050 122.9518 54.1191 38.3021 176.4043 113 Q 4.1419 8.7172 118.9122 59.1160 28.9325 177.4377 114 K 4.1440 8.0456 113.3382 56.2091 32.8867 176.7569 115 Q 3.4278 7.9587 117.8659 55.5581 26.9662 172.3705 116 V 4.4011 7.7922 117.2008 60.1882 34.8914 173.4920 117 Q 4.4474 8.7433 123.0785 56.4844 29.2754 175.5978 118 I 4.0711 8.0106 125.3517 61.3562 38.9076 174.3461 119 M 4.3760 6.5410 117.2508 54.5115 34.0211 173.7202 120 G 4.8986 8.2821 110.9133 47.5013 0.0000 171.8234 121 F 5.0071 7.0248 114.8751 55.3494 41.0106 172.7958 122 L 4.4441 8.8388 122.8661 55.5409 42.0711 176.7994 123 V 4.4904 8.8913 118.0360 61.3666 34.0395 175.6702 124 Q 4.4319 7.7042 121.4002 54.4856 32.5375 172.8736 125 R 4.3182 8.0833 126.0339 53.1037 32.8333 173.3447 126 P 4.1880 0.0000 0.0000 62.6757 31.6934 177.4745 127 K 4.1151 8.4708 119.6792 58.8573 32.1040 177.9756 128 S 4.4409 7.8954 111.3541 58.2464 63.6973 174.2352 129 A 4.2958 7.8814 125.7840 53.0473 18.3974 177.4732 130 R 4.7005 8.8550 120.2985 55.8992 31.8300 175.3852 131 D 4.9751 8.6018 116.3209 52.5322 39.7321 175.3804 132 W 5.4501 7.8418 115.1248 55.0663 31.2988 174.1747 133 Q 4.3085 8.4384 117.7404 53.0725 31.1719 174.1763 134 P 4.6114 0.0000 0.0000 62.0788 32.7394 176.8990 135 A 4.0181 8.9015 122.7120 55.6688 18.1644 179.4433 136 N 4.5864 8.0765 110.1372 54.2862 37.8260 175.6403 137 K 4.4092 7.9346 117.7079 56.1973 32.8788 177.3687 138 R 3.5607 7.4618 119.8716 57.9136 30.1072 176.7311 139 S 4.8984 7.3946 110.3828 56.2958 66.2090 174.2228 140 V 3.9725 8.7135 115.0757 61.6869 31.9790 175.5840 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 2 M 8.30 4.63 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.89 4.16 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 0.90 0.00 0.00 0.96 0.00 0.00 4 W 9.14 4.61 0.00 3.49 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 5 T 8.16 4.15 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 0.96 0.00 0.00 6 P 0.00 4.61 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 7 V 7.37 4.06 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.66 4.28 0.00 2.78 2.85 0.00 0.00 6.81 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 9 N 7.63 5.06 0.00 2.63 2.70 0.00 0.00 7.30 6.68 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 10 K 8.30 4.14 0.00 1.96 1.57 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.25 1.28 7.81 11 M 8.33 4.96 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 12 F 8.27 4.55 0.00 3.14 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 13 E 8.17 3.47 0.00 2.13 1.77 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 2.19 2.13 0.00 14 T 8.43 3.75 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 0.10 0.00 0.00 15 F 9.07 4.47 0.00 3.29 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 16 S 8.39 4.49 0.00 4.14 4.22 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 17 Y 8.28 4.40 0.00 3.05 3.20 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 0.00 0.00 0.00 0.00 18 L 7.53 4.78 0.00 1.81 1.60 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.48 0.00 2.05 2.01 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 20 P 0.00 4.20 0.00 2.06 2.04 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.24 0.00 21 L 8.38 4.21 0.00 1.60 1.50 0.40 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 22 S 9.07 4.51 0.00 4.01 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 23 D 8.48 4.37 0.00 2.70 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 24 E 8.07 3.92 0.00 2.02 1.92 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 2.35 2.39 0.00 25 Q 7.93 3.96 0.00 2.16 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 26 I 7.93 3.77 2.07 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 1.62 1.15 1.10 0.00 0.00 27 A 8.28 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 4.11 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 29 Q 7.96 4.09 0.00 2.48 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.39 1.85 0.00 30 V 8.04 3.79 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 1.10 0.00 0.00 1.14 0.00 0.00 31 D 8.47 4.44 0.00 2.97 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 32 Y 8.09 4.15 0.00 3.25 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 33 I 7.83 3.96 2.16 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.25 1.13 0.00 0.00 34 V 7.81 3.55 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 1.02 0.00 0.00 1.01 0.00 0.00 35 A 8.09 3.94 1.25 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 36 N 7.13 4.05 0.00 1.44 1.42 0.00 0.00 7.01 7.85 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 37 G 7.27 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 38 W 7.66 4.90 0.00 3.39 3.09 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 0.00 0.00 0.00 0.00 39 I 8.95 4.46 2.13 0.00 0.00 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 1.54 0.91 0.77 0.00 0.00 40 P 0.00 4.90 0.00 2.13 2.22 0.00 3.79 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 2.01 0.00 41 C 8.84 5.01 0.00 3.09 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 42 L 8.70 5.34 0.00 1.86 1.61 0.85 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.18 5.63 0.00 2.09 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 2.37 2.31 0.00 44 F 9.13 5.63 0.00 2.97 3.01 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 0.00 45 A 8.21 4.41 -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 46 E 8.44 4.40 0.00 2.19 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 2.29 2.31 0.00 47 S 8.97 4.40 0.00 4.01 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 0.00 48 D 8.16 4.59 0.00 2.68 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 49 K 7.88 4.63 0.00 1.51 1.67 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.41 7.81 50 A 7.75 3.88 0.49 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 0.00 0.00 51 Y 7.40 4.75 0.00 2.89 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 52 V 8.49 4.48 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 0.47 0.00 0.00 0.77 0.00 0.00 53 S 8.40 4.77 0.00 4.08 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 54 N 8.58 5.05 0.00 2.77 2.86 0.00 0.00 6.51 7.66 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 55 E 8.55 3.91 0.00 2.15 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 2.60 2.41 0.00 56 S 8.80 4.03 0.00 4.03 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 57 A 7.74 2.58 1.14 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 0.00 0.00 58 I 7.09 3.53 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.88 0.00 0.00 59 R 7.48 4.34 0.00 1.92 2.01 0.00 3.20 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 60 F 7.34 4.99 0.00 2.99 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 61 G 8.16 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.42 4.61 0.00 3.87 3.86 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 63 V 7.21 4.47 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 0.67 0.00 0.00 0.53 0.00 0.00 64 S 8.25 4.52 0.00 4.10 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 0.00 65 C 8.06 4.14 0.00 2.96 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 66 L 8.48 3.56 0.00 1.77 1.75 0.94 0.96 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 67 Y 7.36 4.44 0.00 2.94 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 68 Y 7.13 4.90 0.00 2.82 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 69 D 9.15 4.58 0.00 2.79 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 70 N 8.88 4.53 0.00 3.06 3.25 0.00 0.00 6.99 7.66 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 71 R 7.92 3.99 0.00 1.52 1.71 0.00 3.08 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 72 Y 7.76 4.46 0.00 3.04 2.84 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 73 W 8.70 5.07 0.00 3.07 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 74 T 8.14 4.30 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 0.94 0.00 0.00 75 M 8.51 4.71 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.80 0.00 76 W 9.53 4.82 0.00 3.63 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 K 8.54 3.40 0.00 1.65 0.74 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.77 0.21 7.81 78 L 8.25 4.90 0.00 1.57 1.54 0.98 1.02 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 79 P 0.00 4.26 0.00 0.69 1.82 0.00 3.59 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.14 0.00 80 M 8.61 4.34 0.00 2.07 2.02 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 2.63 2.54 0.00 81 F 7.34 4.47 0.00 3.11 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 82 G 9.15 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 0.00 0.00 0.00 83 C 7.98 4.27 0.00 3.07 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 84 R 8.63 4.57 0.00 1.80 1.86 0.00 3.21 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.79 0.00 85 D 7.90 4.79 0.00 2.71 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 86 P 0.00 4.35 0.00 2.33 2.34 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 87 M 8.36 4.10 0.00 2.09 2.46 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 2.63 2.70 0.00 88 Q 8.12 3.98 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.74 3.61 2.28 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 1.05 0.00 0.00 0.97 0.00 0.00 90 L 8.06 4.01 0.00 1.91 1.72 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.24 3.97 0.00 2.05 2.01 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 92 E 8.29 4.13 0.00 2.25 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 2.60 2.66 0.00 93 I 7.63 3.58 2.01 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 1.33 0.82 0.83 0.00 0.00 94 V 7.55 3.46 2.24 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 0.97 0.00 0.00 0.98 0.00 0.00 95 A 8.07 3.96 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 2.00 0.00 1.23 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 0.00 0.00 0.00 97 T 7.55 3.73 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 1.12 0.00 0.00 98 K 7.61 3.89 0.00 1.80 1.94 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.38 7.81 99 A 7.61 4.00 1.25 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 0.00 100 F 7.74 4.64 0.00 2.78 2.82 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 0.00 101 P 0.00 4.34 0.00 2.11 2.11 0.00 3.28 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.09 4.69 0.00 2.68 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 0.00 103 A 7.35 4.88 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 0.00 104 Y 8.91 4.21 0.00 2.51 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 0.00 105 V 8.81 5.26 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 0.94 0.00 0.00 0.98 0.00 0.00 106 R 9.45 4.95 0.00 1.82 1.89 0.00 2.33 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.35 0.00 107 L 8.19 4.89 0.00 1.47 0.76 0.84 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.69 4.90 1.63 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 0.42 0.00 0.00 0.52 0.00 0.00 109 A 7.95 4.86 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 0.00 110 F 9.11 5.26 0.00 3.00 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 0.00 111 D 8.82 5.43 0.00 2.52 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 0.00 112 N 9.21 4.76 0.00 2.93 3.04 0.00 0.00 6.34 7.39 0.00 0.00 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 Q 8.72 4.14 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 114 K 8.05 4.14 0.00 1.84 1.86 0.00 1.86 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.57 7.81 115 Q 7.96 3.43 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 V 7.79 4.40 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 0.56 0.00 0.00 0.92 0.00 0.00 117 Q 8.74 4.45 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.19 1.89 0.00 118 I 8.01 4.07 1.14 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.08 -0.52 0.00 0.00 119 M 6.54 4.38 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.74 0.00 120 G 8.28 4.90 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 0.00 121 F 7.02 5.01 0.00 3.24 3.31 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 0.00 122 L 8.84 4.44 0.00 1.55 1.59 0.68 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.89 4.49 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 0.60 0.00 0.00 0.89 0.00 0.00 124 Q 7.70 4.43 0.00 1.96 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 125 R 8.08 4.32 0.00 1.37 1.29 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.11 0.00 126 P 0.00 4.19 0.00 2.12 2.06 0.00 2.20 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 127 K 8.47 4.12 0.00 1.75 1.93 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.38 7.81 128 S 7.90 4.44 0.00 4.01 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 0.00 129 A 7.88 4.30 1.57 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 0.00 0.00 130 R 8.86 4.70 0.00 1.81 1.89 0.00 3.21 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.91 0.00 131 D 8.60 4.98 0.00 2.91 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 0.00 132 W 7.84 5.45 0.00 3.67 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 0.00 133 Q 8.44 4.31 0.00 2.02 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.08 0.00 0.00 0.00 0.00 0.00 2.36 2.04 0.00 134 P 0.00 4.61 0.00 2.19 2.08 0.00 3.44 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.77 0.00 135 A 8.90 4.02 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.08 4.59 0.00 2.82 2.94 0.00 0.00 5.85 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 0.00 137 K 7.93 4.41 0.00 1.57 1.74 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.26 1.37 7.81 138 R 7.46 3.56 0.00 1.46 0.66 0.00 3.07 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 139 S 7.39 4.90 0.00 4.00 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 0.00 140 V 8.71 3.97 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 0.71 0.00 0.00 0.96 0.00 0.00