NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4736 8.1633 120.6130 55.4317 33.7714 173.3995 2 K 4.8410 8.4041 126.3470 54.8340 34.1473 174.2145 3 I 4.8542 8.7396 126.2562 59.4112 40.4278 174.0040 4 L 4.5507 8.3871 129.5377 53.7665 43.5467 175.1809 5 V 4.7268 8.6257 127.6056 61.6634 33.2102 174.2832 6 I 5.0177 8.9228 130.1061 59.8186 39.6039 174.7117 7 Q 4.7916 9.3363 126.9026 54.1986 31.0400 176.6042 8 G 4.1481 8.9052 115.7546 43.8655 0.0000 170.9343 9 P 4.4107 0.0000 0.0000 64.2988 31.6292 177.3541 10 N 4.4251 9.1982 116.3613 53.8862 38.1004 176.5947 11 L 3.9757 7.4336 117.8516 57.1051 41.8201 178.8005 12 N 4.4003 7.9484 114.7870 55.1622 36.2268 175.5261 13 M 4.2714 7.8798 118.0868 55.4546 32.5236 176.1397 14 L 3.9436 7.1622 119.1596 56.3055 42.5525 177.0730 15 G 4.3323 8.9441 114.6190 46.6198 0.0000 175.3844 16 H 4.1360 7.2324 115.8566 58.3952 28.7261 176.3401 17 R 4.3659 7.9603 114.8190 55.2642 30.6243 175.5068 18 D 4.6077 8.2385 117.9179 53.7396 39.0668 173.6006 19 P 4.6132 0.0000 0.0000 63.5773 28.9123 176.3929 20 R 4.0814 8.9197 122.5586 57.2988 30.7607 177.7122 21 L 4.0400 7.9247 118.4308 57.8186 42.0270 178.2312 22 Y 4.2470 7.8551 113.7357 58.2187 39.1370 174.3221 23 G 3.9621 7.1269 103.8067 44.5072 0.0000 172.9000 24 M 4.4992 8.5191 116.8398 55.2239 34.0399 176.1869 25 V 4.0280 7.6046 118.9918 62.2701 32.6063 176.2256 26 T 4.3509 8.0679 117.4966 60.7434 71.1261 175.7931 27 L 3.6622 8.0425 122.4679 58.1850 42.0894 178.4995 28 D 4.1394 7.8603 118.3090 57.6092 40.7294 178.6916 29 Q 4.1679 7.7425 117.7814 58.9718 28.7143 179.1125 30 I 3.5528 7.5948 120.8106 64.7375 37.2461 178.2545 31 H 3.8391 7.7449 117.0126 58.4449 28.1626 177.8062 32 E 3.9408 8.5027 120.8459 59.6245 29.3713 179.1244 33 I 3.7129 7.9048 119.9426 64.9770 37.1461 178.3765 34 M 4.4385 7.8738 120.2948 57.9837 31.8119 178.6741 35 Q 4.1300 8.1238 117.7593 59.4157 28.8896 178.8465 36 T 3.9170 8.2202 116.9549 66.9980 66.9949 176.1852 37 F 4.0576 8.4723 122.1394 61.2568 39.4674 177.3311 38 V 3.7817 8.0606 117.8743 65.8918 31.3003 178.1893 39 K 3.9719 8.4285 118.5270 59.5794 31.8407 179.1893 40 Q 4.2957 8.0097 114.7823 57.2118 28.7705 177.3419 41 G 3.8028 6.8882 105.6494 43.7994 0.0000 172.9326 42 N 4.2215 8.8513 116.0116 53.9099 36.7444 174.5172 43 L 4.0939 7.5393 117.2784 55.1826 42.5807 177.6762 44 D 4.6657 8.3076 122.9680 52.8554 39.6796 175.6826 45 V 4.7209 7.2861 118.6922 61.1909 35.2582 174.4988 46 E 4.6704 9.1148 127.5887 54.7880 31.4848 174.8919 47 L 4.9188 8.4025 124.3742 53.1543 43.7130 175.3841 48 E 4.4783 8.6114 123.8682 54.3839 32.0296 174.4043 49 F 5.3653 8.6243 125.3391 56.0358 41.3922 175.1337 50 F 5.0624 9.3595 124.7115 56.8415 42.8841 172.7205 51 Q 4.9233 8.1535 126.5370 54.5633 31.4509 174.0484 52 T 4.6302 8.4291 119.1792 61.0170 70.8054 173.0877 53 N 4.7239 9.1105 121.4561 53.1873 39.5274 175.2751 54 F 4.7817 8.6940 119.7427 55.6213 40.8066 175.6545 55 E 3.7488 9.0541 124.9030 59.6364 29.1748 179.2414 56 G 3.6880 8.1810 104.8128 47.7668 0.0000 175.4309 57 E 4.0842 8.2659 120.4404 59.1779 29.5659 179.0044 58 I 3.9063 7.9716 119.9363 64.6470 37.1686 178.4395 59 I 3.6978 7.7825 120.2875 64.5183 36.8831 177.9889 60 D 4.3614 8.3200 119.9419 57.4697 40.8208 179.1503 61 K 3.7796 8.3244 120.0427 59.4258 31.9794 178.7183 62 I 3.6795 7.6869 119.0634 64.6629 37.2877 178.0481 63 Q 4.1506 8.3299 118.8331 59.1062 28.3915 178.7533 64 E 4.0561 8.3042 118.3539 58.6792 29.2330 179.0053 65 S 4.5643 8.0241 113.9554 60.6825 62.9196 176.4587 66 V 3.7213 7.7688 122.3678 66.0842 31.4792 177.9882 67 G 3.7690 8.0298 104.5324 47.1484 0.0000 173.3004 68 S 4.5533 7.4790 114.2684 57.3718 64.7631 172.8916 69 D 4.7056 8.0593 117.6293 53.9506 39.7100 175.7446 70 Y 4.7379 7.2636 117.1077 58.4770 38.7968 175.7801 71 E 4.3289 9.2828 125.5457 58.8407 30.7125 176.6357 72 G 4.2202 7.7345 104.0671 45.5408 0.0000 172.1355 73 I 5.1845 8.8042 120.7497 59.3323 40.8880 174.8419 74 I 4.9294 8.6348 127.2142 59.6032 39.6290 174.5791 75 I 5.0970 9.0527 126.9544 59.4040 41.9469 173.2854 76 N 5.2255 9.1928 128.0361 50.4084 40.2071 172.8114 77 P 4.5452 0.0000 0.0000 62.1775 32.7766 178.1079 78 G 3.7097 8.8127 108.5501 46.0324 0.0000 175.4267 79 A 4.2432 8.2999 121.6437 54.6663 18.7393 179.4829 80 F 4.8338 7.7485 114.4779 59.9397 38.8536 177.5153 81 S 4.6024 8.2995 117.3986 61.3498 62.4351 176.0704 82 H 4.8180 7.9781 117.0910 56.5109 28.7933 176.1575 83 T 4.6992 8.0192 108.3873 61.5269 70.9401 174.7260 84 S 4.4364 8.4028 117.6859 56.6787 61.4380 173.9678 85 I 3.4021 7.7044 129.0517 63.6533 37.0531 177.3938 86 A 3.9297 7.8480 121.0904 55.4814 18.1434 179.6803 87 I 3.6993 8.1025 118.2761 64.1582 37.1168 178.4782 88 A 4.0321 7.8685 121.6709 55.3522 18.2599 179.4009 89 D 4.2704 8.5303 117.4549 57.4133 40.6857 178.6474 90 A 4.0044 7.7790 119.9259 55.4974 18.7684 179.3855 91 I 3.8172 8.0937 118.3427 64.9478 36.9676 178.6434 92 M 4.1706 8.0584 118.5640 57.6448 30.4738 177.7439 93 L 4.4319 7.9108 117.8099 55.9901 40.8161 178.2818 94 A 4.2090 7.8864 122.1813 53.0164 19.0025 177.6981 95 G 4.0166 7.4367 105.2971 45.4668 0.0000 172.5715 96 K 4.4186 7.3317 113.2566 54.7372 35.3553 173.3574 97 P 4.3917 0.0000 0.0000 62.9157 32.6076 175.4518 98 V 4.8825 8.4920 123.6412 61.0802 34.7280 173.8723 99 I 4.9295 8.8386 128.5229 59.4791 40.3074 173.9798 100 E 4.9473 8.8842 128.2553 54.9645 31.0439 174.8167 101 V 4.7765 8.6162 126.4964 61.3520 35.0049 173.8203 102 H 4.9995 9.1432 123.2301 54.0330 32.4098 173.9700 103 L 4.1581 9.1227 123.7058 57.9785 42.1811 177.7730 104 T 4.4216 7.7060 106.2730 59.8727 70.7254 174.4502 105 N 4.4516 8.1177 121.2454 52.4847 37.4769 175.4207 106 I 3.8939 7.9088 118.5921 62.6421 38.0364 177.8729 107 Q 3.9343 7.9329 119.7473 58.2827 28.5783 176.8169 108 A 4.5758 8.0438 119.3623 51.6751 19.3507 176.4916 109 R 4.7656 7.2136 118.6167 55.5340 33.2386 175.3456 110 E 3.8093 8.2321 117.2550 57.1515 30.2335 177.6422 111 E 3.7904 8.6893 121.8851 59.3925 29.6483 179.0710 112 F 4.4276 7.7573 111.1026 58.7029 37.9320 175.5732 113 R 3.8476 7.0247 119.0944 56.1097 30.8498 177.6466 114 K 4.1373 7.8619 118.0705 59.0689 32.1183 177.6412 115 N 4.1476 7.9731 117.4148 53.7324 39.5566 173.4015 116 S 4.5126 8.2346 118.1823 55.8014 64.4675 173.8503 117 Y 4.2664 8.3076 127.8098 61.3623 38.2290 178.5756 118 T 4.2038 8.1766 110.2113 64.9676 68.6798 176.4906 119 G 3.6849 8.4985 108.8054 47.3644 0.0000 175.4963 120 A 4.0428 7.8823 121.6677 54.7117 18.4663 179.0597 121 A 4.1987 7.7679 117.8534 53.4232 18.9423 177.7189 122 C 4.4514 6.9615 114.6838 58.9557 29.2274 174.1084 123 G 3.7899 8.4027 109.2420 49.3967 0.0000 173.8806 124 G 4.4278 7.7549 105.3868 45.0084 0.0000 172.0710 125 V 5.1363 8.1782 118.9072 61.0888 35.0768 174.3353 126 I 4.8708 9.0935 127.8580 59.6803 40.3815 174.3669 127 M 5.0745 8.8623 123.4733 54.6247 34.1649 175.2837 128 G 3.7143 9.1391 109.9457 45.7060 0.0000 173.6571 129 F 4.6768 7.9940 114.9803 56.1778 39.9424 177.6418 130 G 4.0007 7.9775 111.6356 44.7671 0.0000 172.6244 131 P 4.5412 0.0000 0.0000 65.7193 31.8028 178.0738 132 L 4.0436 8.3435 119.4084 58.2707 41.7430 178.8854 133 G 3.7564 8.3142 105.5207 48.2603 0.0000 175.1943 134 Y 4.0446 8.1901 118.7001 60.9128 37.4205 178.0421 135 N 3.9096 8.0311 117.0902 56.2411 38.6465 177.1504 136 M 3.9148 7.8457 119.9776 58.1124 31.9604 178.6992 137 A 3.9235 7.8527 120.8562 55.0248 18.5843 179.4375 138 L 3.9082 7.9638 117.7032 58.2602 41.7594 179.2385 139 M 4.1214 8.5436 118.0494 58.9856 32.0491 178.1919 140 A 4.0073 8.0565 120.5880 55.1794 18.4337 179.2120 141 M 3.9473 8.6095 117.1315 58.8430 32.2571 178.5647 142 V 3.6140 7.9643 118.3276 66.2425 31.6941 177.7846 143 N 4.3712 8.2752 116.1816 56.3359 38.3465 177.5748 144 I 3.7722 8.1244 121.6105 64.1688 37.1586 178.5847 145 L 3.9397 8.3274 119.9025 57.6915 41.4546 178.9440 146 A 3.9879 8.1790 121.1493 55.6714 18.1449 179.4437 147 E 3.9374 8.3856 117.1897 59.3984 29.1286 178.8635 148 M 4.1577 8.0465 119.1741 58.0526 31.7979 178.4650 149 K 4.2080 8.0099 117.1495 58.2024 32.4735 178.7824 150 A 4.1707 8.2598 121.7798 55.3497 18.1321 179.3703 151 F 4.3046 7.8706 117.6552 61.3491 39.4697 176.4618 152 Q 3.9187 7.5476 117.3488 59.5804 28.8715 177.2937 153 E 4.2057 7.6079 120.8874 56.6748 29.6467 176.7608 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 8.16 4.47 0.00 2.44 2.08 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.62 0.00 2 K 8.40 4.84 0.00 2.01 1.94 0.00 1.17 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.46 1.45 7.81 3 I 8.74 4.85 1.86 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 1.15 1.17 0.91 0.00 0.00 4 L 8.39 4.55 0.00 0.79 1.18 0.69 0.35 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 5 V 8.63 4.73 2.23 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 1.22 0.00 0.00 0.98 0.00 0.00 6 I 8.92 5.02 1.97 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 1.42 0.66 1.09 0.00 0.00 7 Q 9.34 4.79 0.00 1.88 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 8 G 8.91 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 9 P 0.00 4.41 0.00 1.84 1.79 0.00 3.64 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.44 0.00 10 N 9.20 4.43 0.00 2.77 2.84 0.00 0.00 7.00 6.32 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 11 L 7.43 3.98 0.00 1.79 1.66 1.14 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 12 N 7.95 4.40 0.00 2.78 2.99 0.00 0.00 6.05 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 13 M 7.88 4.27 0.00 2.02 2.15 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 2.53 2.58 0.00 14 L 7.16 3.94 0.00 1.62 1.74 0.89 1.04 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 15 G 8.94 4.33 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 0.00 16 H 7.23 4.14 0.00 3.24 3.36 0.00 5.66 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.96 4.37 0.00 1.79 1.96 0.00 3.53 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 18 D 8.24 4.61 0.00 2.91 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 19 P 0.00 4.61 0.00 2.12 2.13 0.00 3.81 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 20 R 8.92 4.08 0.00 1.93 1.96 0.00 3.14 0.00 0.00 3.16 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 21 L 7.92 4.04 0.00 1.20 1.39 1.19 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.86 4.25 0.00 2.91 3.02 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 23 G 7.13 3.96 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 0.00 0.00 0.00 24 M 8.52 4.50 0.00 1.99 2.10 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 2.51 2.49 0.00 25 V 7.60 4.03 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 0.80 0.00 0.00 0.94 0.00 0.00 26 T 8.07 4.35 4.03 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 0.00 0.00 1.05 0.00 0.00 27 L 8.04 3.66 0.00 1.73 1.52 0.71 1.10 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 28 D 7.86 4.14 0.00 2.63 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 7.74 4.17 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 30 I 7.59 3.55 1.62 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.12 0.33 0.00 0.00 31 H 7.74 3.84 0.00 2.64 1.46 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.50 3.94 0.00 2.06 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 2.32 2.30 0.00 33 I 7.90 3.71 2.04 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 1.54 0.94 0.99 0.00 0.00 34 M 7.87 4.44 0.00 2.33 2.51 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.54 0.00 35 Q 8.12 4.13 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.73 0.00 0.00 0.00 0.00 0.00 2.83 2.70 0.00 36 T 8.22 3.92 4.50 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 1.27 0.00 0.00 37 F 8.47 4.06 0.00 3.29 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.06 3.78 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.11 0.00 0.00 39 K 8.43 3.97 0.00 1.82 1.83 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.51 7.81 40 Q 8.01 4.30 0.00 1.87 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 41 G 6.89 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 42 N 8.85 4.22 0.00 2.81 2.89 0.00 0.00 6.97 8.28 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 43 L 7.54 4.09 0.00 1.71 1.64 0.95 0.80 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 44 D 8.31 4.67 0.00 2.61 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 45 V 7.29 4.72 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.97 0.00 0.00 46 E 9.11 4.67 0.00 1.95 1.83 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 2.24 2.26 0.00 47 L 8.40 4.92 0.00 0.99 0.74 1.07 0.85 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 48 E 8.61 4.48 0.00 2.14 1.72 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 2.23 2.34 0.00 49 F 8.62 5.37 0.00 2.95 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 50 F 9.36 5.06 0.00 3.07 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 51 Q 8.15 4.92 0.00 1.97 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.55 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 52 T 8.43 4.63 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 53 N 9.11 4.72 0.00 2.64 2.66 0.00 0.00 6.87 7.45 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 54 F 8.69 4.78 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 55 E 9.05 3.75 0.00 1.18 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 0.00 2.13 1.74 0.00 56 G 8.18 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.27 4.08 0.00 2.26 2.39 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 2.60 2.42 0.00 58 I 7.97 3.91 2.14 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.98 1.03 0.00 0.00 59 I 7.78 3.70 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 0.91 0.00 0.00 60 D 8.32 4.36 0.00 2.97 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 61 K 8.32 3.78 0.00 1.94 1.74 0.00 1.38 0.00 0.00 0.81 0.00 0.00 2.53 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 1.21 7.81 62 I 7.69 3.68 2.00 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 1.53 0.82 0.92 0.00 0.00 63 Q 8.33 4.15 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 64 E 8.30 4.06 0.00 2.00 2.02 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 2.32 2.36 0.00 65 S 8.02 4.56 0.00 4.07 4.20 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 66 V 7.77 3.72 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 0.84 0.00 0.00 0.98 0.00 0.00 67 G 8.03 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 0.00 0.00 0.00 68 S 7.48 4.55 0.00 3.87 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 69 D 8.06 4.71 0.00 2.69 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 70 Y 7.26 4.74 0.00 3.24 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 E 9.28 4.33 0.00 1.89 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 2.35 2.44 0.00 72 G 7.73 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 0.00 0.00 0.00 73 I 8.80 5.18 1.86 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 1.11 0.76 0.97 0.00 0.00 74 I 8.63 4.93 1.97 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 1.14 0.82 1.02 0.00 0.00 75 I 9.05 5.10 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 1.25 2.02 0.99 0.00 0.00 76 N 9.19 5.23 0.00 2.86 3.00 0.00 0.00 7.10 8.57 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 77 P 0.00 4.55 0.00 2.42 2.21 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.14 0.00 78 G 8.81 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.30 4.24 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 80 F 7.75 4.83 0.00 3.27 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 81 S 8.30 4.60 0.00 3.58 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 82 H 7.98 4.82 0.00 3.32 3.52 0.00 5.56 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.02 4.70 4.37 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 1.36 0.00 0.00 84 S 8.40 4.44 0.00 3.79 3.96 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 85 I 7.70 3.40 1.65 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.74 0.00 0.00 86 A 7.85 3.93 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 87 I 8.10 3.70 1.91 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 1.47 0.63 0.97 0.00 0.00 88 A 7.87 4.03 1.50 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 89 D 8.53 4.27 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.78 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.09 3.82 2.06 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 1.55 1.14 0.96 0.00 0.00 92 M 8.06 4.17 0.00 2.01 2.22 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 2.65 2.56 0.00 93 L 7.91 4.43 0.00 1.93 1.89 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.89 4.21 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 95 G 7.44 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 96 K 7.33 4.42 0.00 2.03 1.77 0.00 1.63 0.00 0.00 1.89 0.00 0.00 3.25 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.43 7.81 97 P 0.00 4.39 0.00 2.11 2.04 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 98 V 8.49 4.88 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 1.09 0.00 0.00 0.96 0.00 0.00 99 I 8.84 4.93 1.86 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 1.11 0.61 0.88 0.00 0.00 100 E 8.88 4.95 0.00 2.06 1.79 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 2.08 2.31 0.00 101 V 8.62 4.78 1.47 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 0.18 0.00 0.00 0.65 0.00 0.00 102 H 9.14 5.00 0.00 3.07 3.18 0.00 5.69 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 0.00 103 L 9.12 4.16 0.00 1.76 1.83 1.15 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.71 4.42 4.03 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 0.00 0.00 0.76 0.00 0.00 105 N 8.12 4.45 0.00 2.57 2.63 0.00 0.00 6.63 7.99 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 0.00 106 I 7.91 3.89 1.99 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.61 0.79 0.00 0.00 107 Q 7.93 3.93 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.31 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 108 A 8.04 4.58 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 0.00 109 R 7.21 4.77 0.00 1.57 1.66 0.00 3.06 0.00 0.00 3.09 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.45 0.00 110 E 8.23 3.81 0.00 1.16 1.13 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 2.22 2.17 0.00 111 E 8.69 3.79 0.00 1.98 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 2.38 2.37 0.00 112 F 7.76 4.43 0.00 3.10 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 0.00 113 R 7.02 3.85 0.00 1.63 1.75 0.00 3.05 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.09 0.00 114 K 7.86 4.14 0.00 1.78 1.79 0.00 1.63 0.00 0.00 1.56 0.00 0.00 3.12 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.49 1.41 7.81 115 N 7.97 4.15 0.00 2.67 2.57 0.00 0.00 6.55 7.63 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 0.00 116 S 8.23 4.51 0.00 3.89 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 0.00 117 Y 8.31 4.27 0.00 3.23 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 0.00 118 T 8.18 4.20 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 1.32 0.00 0.00 119 G 8.50 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 0.00 120 A 7.88 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.77 4.20 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 0.00 122 C 6.96 4.45 0.00 3.13 3.03 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 0.00 0.00 0.00 123 G 8.40 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.75 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 0.00 0.00 0.00 0.00 125 V 8.18 5.14 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 0.95 0.00 0.00 0.95 0.00 0.00 126 I 9.09 4.87 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 1.01 0.00 0.00 127 M 8.86 5.07 0.00 1.99 2.10 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 2.35 2.50 0.00 128 G 9.14 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.99 4.68 0.00 2.99 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 0.00 130 G 7.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.54 0.00 2.24 2.17 0.00 3.69 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 2.15 2.14 0.00 132 L 8.34 4.04 0.00 1.79 2.01 0.87 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.31 3.76 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 0.00 0.00 0.00 134 Y 8.19 4.04 0.00 3.23 3.03 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 0.00 0.00 0.00 135 N 8.03 3.91 0.00 2.50 1.61 0.00 0.00 7.15 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 0.00 136 M 7.85 3.91 0.00 1.85 2.06 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.28 0.00 137 A 7.85 3.92 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 7.96 3.91 0.00 1.68 1.87 1.06 1.07 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 0.00 139 M 8.54 4.12 0.00 2.15 2.24 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 2.68 2.61 0.00 140 A 8.06 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.61 3.95 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 142 V 7.96 3.61 2.39 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 1.11 0.00 0.00 1.04 0.00 0.00 143 N 8.28 4.37 0.00 2.94 2.86 0.00 0.00 7.06 7.51 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 0.00 144 I 8.12 3.77 2.05 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 0.67 0.92 0.00 0.00 145 L 8.33 3.94 0.00 1.75 1.74 0.95 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 146 A 8.18 3.99 1.42 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 0.00 0.00 147 E 8.39 3.94 0.00 2.24 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 0.00 2.30 2.36 0.00 148 M 8.05 4.16 0.00 2.17 2.32 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 2.74 2.62 0.00 149 K 8.01 4.21 0.00 1.77 1.88 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.65 7.81 150 A 8.26 4.17 1.44 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 0.00 0.00 151 F 7.87 4.30 0.00 2.96 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 0.00 152 Q 7.55 3.92 0.00 2.12 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 153 E 7.61 4.21 0.00 2.12 1.83 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 2.33 2.31 0.00