NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1710 8.0549 120.3146 61.4407 32.7678 174.4650 2 L 4.4676 8.2195 121.9098 51.0486 43.6971 175.7231 3 S 4.4255 9.2156 117.8805 58.0456 65.9492 174.8967 4 E 4.2637 8.8593 123.0522 59.6235 29.4061 179.2965 5 G 3.6379 8.1150 105.2754 47.6243 0.0000 175.4062 6 E 3.8987 8.3447 120.9138 59.1610 29.4272 179.3647 7 W 4.4373 8.3481 119.2848 60.0915 29.0585 178.6280 8 Q 4.1382 8.5580 118.0246 58.8890 28.1157 178.8127 9 L 4.0866 8.1203 120.2828 57.5919 41.6543 179.5883 10 V 3.7363 8.0022 118.2296 66.2830 31.5528 178.1887 11 L 4.3079 8.4323 118.4553 57.5227 41.4613 179.0187 12 H 4.2186 8.5011 119.1340 59.2903 29.9136 177.7261 13 V 3.7077 8.0094 120.8579 64.2661 31.3861 178.1333 14 W 3.9426 8.3715 129.1164 60.1459 30.2594 177.7475 15 A 4.0155 8.0847 120.2377 54.9510 18.0591 179.4854 16 K 3.8983 7.3800 115.8176 59.3883 32.0565 179.4905 17 V 2.7708 7.1492 118.4787 65.8585 30.9887 177.5357 18 E 3.9618 7.4153 115.1900 57.7888 29.3827 178.4449 19 A 4.1564 7.4508 120.6900 53.9633 19.4782 177.6638 20 D 4.6586 7.9315 116.2640 52.2458 42.9516 175.5808 21 V 3.4445 7.8351 123.5989 65.7876 32.0369 176.6155 22 A 4.0488 8.0213 120.0534 55.3547 18.2968 179.7805 23 G 3.6534 8.3905 105.4609 45.3333 0.0000 175.7475 24 H 4.1905 8.4547 118.7200 58.4670 28.6042 178.0292 25 G 3.5898 8.4755 108.0022 47.8981 0.0000 175.7682 26 Q 3.8900 8.1622 120.7243 58.8348 28.7203 178.6830 27 D 4.3050 8.0608 119.8055 57.2278 40.7193 179.0557 28 I 3.6577 7.8965 120.5252 64.3146 37.0865 178.4377 29 L 3.4781 7.8540 119.8868 57.7010 41.3964 179.7486 30 I 3.6717 7.8464 120.0549 64.2684 37.0303 178.4629 31 R 3.8416 8.0813 119.7582 59.0907 29.9551 178.3734 32 L 3.8893 7.7552 120.2432 58.3016 42.0448 179.0961 33 F 4.6144 7.9224 117.8599 60.3936 38.5499 177.6895 34 K 4.0048 8.0257 118.7152 59.5414 32.1387 178.8726 35 S 4.2717 7.9220 114.2836 60.4377 64.3408 174.7264 36 H 4.7603 7.8229 118.0444 52.5407 30.1466 172.1423 37 P 4.8118 0.0000 0.0000 64.3120 31.6617 177.6790 38 E 4.1290 8.2365 116.6878 59.4336 29.4676 179.0751 39 T 3.7452 8.0663 110.9507 64.4228 68.8163 176.2676 40 L 3.8031 8.0534 122.5810 57.6310 41.7614 178.5484 41 E 4.1350 8.0026 117.4534 58.7308 29.4275 178.5094 42 K 4.3957 8.2101 117.0250 56.6039 32.7813 176.9087 43 F 4.5626 8.0212 119.0383 55.1774 39.5164 175.4608 44 D 4.3142 8.5205 126.1537 57.1243 40.8130 178.1121 45 R 4.3229 7.5993 114.5801 56.3860 30.5399 176.5468 46 F 5.2256 8.0953 117.0238 57.4185 40.4510 176.8716 47 K 4.2778 8.1021 118.5915 57.6270 32.7880 177.0304 48 H 4.4641 8.2579 114.3732 56.3828 28.9956 175.0121 49 L 4.2427 7.7671 121.7821 54.1246 41.2980 176.6173 50 K 4.3098 9.2290 124.6919 57.3169 33.0060 177.6227 51 T 4.7282 7.4683 108.2648 58.6938 73.1626 174.0340 52 E 3.8617 8.7537 122.0516 59.7478 29.5900 179.1082 53 A 3.9829 7.9272 120.0161 55.1996 18.2418 179.3224 54 E 3.9230 7.9285 116.4079 59.7451 29.6778 179.1217 55 M 4.1091 8.3912 119.2334 58.3003 31.7689 178.9778 56 K 3.9977 8.0547 117.5745 58.8614 32.3152 178.5366 57 A 4.3707 7.7761 118.9914 51.9656 18.8854 177.1059 58 S 4.2870 7.3578 113.7637 57.0842 62.7696 174.2536 59 E 3.9475 8.9208 129.2823 59.5720 29.3313 178.2864 60 D 4.5117 8.1316 118.4611 57.2539 40.9310 178.3432 61 L 3.4468 7.8673 120.9082 57.7656 41.9920 178.9134 62 K 3.8678 7.9404 119.5872 59.4288 32.0432 178.8679 63 K 3.9877 8.5204 119.1959 59.8213 31.9670 178.8004 64 H 4.3909 8.7213 118.9774 59.2894 29.7265 177.5890 65 G 3.6311 8.3733 107.7117 47.6373 0.0000 175.9440 66 V 3.6271 7.8106 120.5987 66.0068 31.6280 178.2202 67 T 3.8902 8.2030 115.8453 66.5963 68.3320 176.6970 68 V 3.6017 8.1257 120.3874 66.2026 31.5986 178.1989 69 L 4.2932 8.3319 118.9391 57.8954 41.4191 179.6516 70 T 3.9829 8.4565 116.2340 66.5120 68.3873 176.5657 71 A 3.9799 7.9788 122.4962 55.0601 18.3602 179.4439 72 L 3.6810 8.0645 119.0376 58.0631 42.1047 179.3587 73 G 3.0510 8.4682 105.8708 47.6157 0.0000 175.5193 74 A 3.9695 7.7418 122.1653 54.7642 18.6256 179.5541 75 I 3.7568 7.5740 118.3609 64.5554 37.1491 178.6767 76 L 3.9800 7.8335 120.1039 57.6399 41.1710 179.6352 77 K 3.9454 7.7672 117.1161 58.4679 32.1905 178.5234 78 K 3.9945 7.7931 117.8068 55.5981 32.7749 176.5191 79 K 2.0000 8.2504 118.8179 56.3302 29.8649 174.6720 80 G 3.9660 7.7410 105.7778 45.9056 0.0000 173.8718 81 H 4.5125 7.6004 118.9764 55.1017 27.3109 174.7832 82 H 5.5716 7.3648 111.0900 53.9669 29.9712 175.8763 83 E 3.9295 8.5570 122.6392 60.1364 29.0447 178.6806 84 A 4.0512 7.9539 118.8500 55.0509 18.8349 178.7913 85 E 4.1681 8.0908 116.4568 58.8093 29.8275 178.6975 86 L 4.0951 8.3408 120.9940 57.6305 42.1118 178.8523 87 K 3.9290 8.1093 118.6187 59.2880 32.0771 177.5294 88 P 4.3031 0.0000 0.0000 65.4115 31.1259 178.7250 89 L 4.1154 7.9916 117.4909 57.5507 41.6440 178.9765 90 A 4.1869 8.2564 120.9345 55.1923 18.3005 179.5290 91 Q 3.8976 8.3545 118.3109 59.4673 29.1935 178.6460 92 S 4.1700 8.2070 115.5407 61.2733 63.1379 176.5373 93 G 3.7812 8.8845 110.7764 46.7318 0.0000 175.0848 94 A 3.0116 8.2007 121.9921 52.4835 19.1913 177.8433 95 T 4.2737 7.5197 104.5155 61.0816 69.7919 173.6571 96 K 4.2416 7.1447 120.2342 58.1182 34.3724 176.5025 97 H 4.3075 8.5950 117.7349 56.3042 29.5545 175.7952 98 K 2.9960 7.3593 116.9153 56.8581 28.6237 174.1045 99 I 4.2769 7.7536 118.1390 58.5805 37.9821 174.6893 100 P 4.6312 0.0000 0.0000 62.1954 32.1304 177.5892 101 I 3.7542 8.5883 121.6581 64.4528 36.7874 178.8788 102 K 4.0668 7.8219 120.5743 59.7016 32.1529 178.6952 103 Y 4.0828 7.9541 117.7308 60.7061 37.6917 178.2309 104 L 4.1909 7.9481 119.6153 57.4879 41.6187 179.1418 105 E 4.0120 8.2567 118.9507 59.3467 29.4321 179.0510 106 F 4.5923 8.1433 118.1211 61.0743 38.9743 177.7344 107 I 3.9316 8.3388 117.9280 63.8066 37.7672 177.9603 108 S 4.2302 8.4865 116.6156 61.6821 62.5773 176.4534 109 E 4.0803 8.7114 121.2328 59.3895 29.1407 179.2556 110 A 4.0311 8.1528 120.8300 55.1250 18.3296 179.7513 111 I 3.6843 8.1182 118.5087 64.6738 37.1688 178.7126 112 I 3.9330 7.9526 120.6038 64.6081 36.8723 177.8922 113 H 4.1490 8.5756 119.2750 59.5016 29.7159 177.5556 114 V 3.5342 8.1424 120.1893 65.7830 31.2607 177.8222 115 L 3.7876 8.1153 119.1924 58.1203 41.1149 179.0903 116 H 4.4366 8.3614 117.1559 59.3343 29.9008 177.1842 117 S 4.1837 8.1267 116.5201 61.2660 62.6986 176.1479 118 R 4.1718 7.8285 119.1729 57.1043 31.1662 176.3531 119 H 5.0401 8.2911 116.1091 54.1304 30.0788 173.4083 120 P 4.1824 0.0000 0.0000 65.8523 31.5060 178.8411 121 G 3.7875 8.1022 106.1305 47.3571 0.0000 173.4546 122 D 5.0739 8.2369 119.1102 53.7653 42.0993 176.7358 123 F 5.0849 8.0709 119.1073 56.0466 40.0389 174.1456 124 G 3.9684 7.7326 109.4735 44.0284 0.0000 171.9251 125 A 3.8946 8.4278 120.6501 55.4490 18.3453 179.8869 126 D 4.2023 7.9562 116.6330 57.4105 40.9563 178.7301 127 A 3.9851 7.8108 120.8433 55.0543 18.4670 179.5295 128 Q 3.2343 8.2039 117.0952 58.6324 28.6630 179.0625 129 G 3.5636 8.1780 106.7922 47.8383 0.0000 175.4725 130 A 3.8460 8.0298 123.8452 54.9117 18.3411 179.4311 131 M 4.0226 8.2671 116.7943 58.7512 32.2876 177.9830 132 N 4.3388 8.7047 117.0449 56.4951 38.6763 177.5062 133 K 3.9300 8.4214 119.8493 59.2804 32.0660 179.3355 134 A 3.9020 8.0418 121.1720 55.2176 18.2807 179.7697 135 L 4.1316 8.2804 117.7161 57.8251 41.5981 179.4792 136 E 3.9914 8.6504 119.1846 59.3521 29.3116 179.2118 137 L 3.9605 8.3406 120.6636 57.9091 42.1155 178.4103 138 F 4.1839 8.4639 120.8043 61.8158 39.2071 177.5273 139 R 3.4230 8.1803 117.3840 58.6785 29.8049 179.0234 140 K 3.8315 8.1862 119.6868 59.7011 32.2722 178.7376 141 D 4.3190 8.2404 119.4186 57.2767 40.7508 178.6314 142 I 3.4101 7.6424 119.1798 63.5351 37.7970 177.7799 143 A 3.7511 7.8527 121.7163 55.0472 18.2096 179.4425 144 A 3.9343 7.9032 119.2155 55.2611 18.4073 180.0647 145 K 3.9746 7.9994 116.9882 59.6256 32.1207 178.9556 146 Y 4.5294 8.5081 117.4675 61.5331 37.7959 179.2622 147 K 4.2901 8.3717 119.1023 59.4775 31.9272 179.3328 148 E 4.0062 8.1637 118.0287 58.7823 29.4201 178.3549 149 L 4.5009 7.6137 116.2953 54.1086 42.0411 176.9894 150 G 3.8081 8.2937 107.4884 46.2355 0.0000 172.5696 151 Y 4.6938 8.0238 120.6451 55.7909 39.9218 175.1537 152 Q 4.3381 8.2657 126.1109 55.7649 29.4330 175.9513 153 G 3.0547 5.7882 113.2818 45.5527 0.0000 174.3342 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 V 8.05 4.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.02 0.00 0.00 2 L 8.22 4.47 0.00 0.80 0.77 0.63 -1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.22 4.43 0.00 4.00 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 4 E 8.86 4.26 0.00 2.20 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 2.43 2.52 0.00 5 G 8.12 3.64 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 0.00 0.00 0.00 6 E 8.34 3.90 0.00 2.03 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 2.20 2.26 0.00 7 W 8.35 4.44 0.00 3.56 3.19 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 8 Q 8.56 4.14 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.75 0.00 9 L 8.12 4.09 0.00 1.89 1.79 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.00 3.74 2.46 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 1.21 0.00 0.00 0.90 0.00 0.00 11 L 8.43 4.31 0.00 1.85 1.81 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.50 4.22 0.00 3.38 3.58 0.00 5.78 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.01 3.71 2.38 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 0.93 0.00 0.00 0.70 0.00 0.00 14 W 8.37 3.94 0.00 3.62 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 15 A 8.08 4.02 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 16 K 7.38 3.90 0.00 1.51 1.48 0.00 1.62 0.00 0.00 1.46 0.00 0.00 2.75 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.39 7.81 17 V 7.15 2.77 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 0.00 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 18 E 7.42 3.96 0.00 2.05 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 2.23 2.21 0.00 19 A 7.45 4.16 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 20 D 7.93 4.66 0.00 2.66 2.53 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 0.00 21 V 7.84 3.44 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 0.95 0.00 0.00 0.89 0.00 0.00 22 A 8.02 4.05 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.39 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.45 4.19 0.00 3.22 3.22 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.48 3.59 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 0.00 0.00 0.00 26 Q 8.16 3.89 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.52 0.00 27 D 8.06 4.31 0.00 2.73 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 28 I 7.90 3.66 1.82 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 1.52 0.64 0.89 0.00 0.00 29 L 7.85 3.48 0.00 1.41 1.10 0.84 0.55 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 30 I 7.85 3.67 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.89 0.89 0.00 0.00 31 R 8.08 3.84 0.00 1.95 2.09 0.00 3.04 0.00 0.00 2.96 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 32 L 7.76 3.89 0.00 1.74 1.42 1.03 0.85 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 33 F 7.92 4.61 0.00 3.18 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 34 K 8.03 4.00 0.00 1.77 1.86 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 35 S 7.92 4.27 0.00 3.74 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 7.82 4.76 0.00 3.01 2.76 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.81 0.00 2.16 2.12 0.00 3.84 0.00 0.00 3.59 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 38 E 8.24 4.13 0.00 2.32 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 0.00 2.32 2.61 0.00 39 T 8.07 3.75 4.36 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 0.88 0.00 0.00 40 L 8.05 3.80 0.00 1.50 1.81 0.05 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.00 4.13 0.00 2.31 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 2.38 2.39 0.00 42 K 8.21 4.40 0.00 1.54 1.48 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.19 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.68 1.84 7.81 43 F 8.02 4.56 0.00 3.19 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 44 D 8.52 4.31 0.00 2.59 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 45 R 7.60 4.32 0.00 1.54 1.97 0.00 3.15 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 46 F 8.10 5.23 0.00 2.92 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 47 K 8.10 4.28 0.00 1.87 1.92 0.00 1.58 0.00 0.00 1.87 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.69 1.44 7.81 48 H 8.26 4.46 0.00 3.29 3.44 0.00 5.54 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.77 4.24 0.00 1.69 1.59 0.80 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.23 4.31 0.00 1.79 1.85 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.50 7.81 51 T 7.47 4.73 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 1.20 0.00 0.00 52 E 8.75 3.86 0.00 2.04 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 2.35 2.37 0.00 53 A 7.93 3.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.93 3.92 0.00 2.10 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 2.31 2.32 0.00 55 M 8.39 4.11 0.00 1.98 2.21 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.51 0.00 56 K 8.05 4.00 0.00 1.69 1.83 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.60 7.81 57 A 7.78 4.37 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 58 S 7.36 4.29 0.00 3.77 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 59 E 8.92 3.95 0.00 2.08 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 2.40 2.42 0.00 60 D 8.13 4.51 0.00 3.00 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 61 L 7.87 3.45 0.00 0.90 1.49 0.58 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.94 3.87 0.00 1.84 1.93 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.45 7.81 63 K 8.52 3.99 0.00 2.06 1.91 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.72 7.81 64 H 8.72 4.39 0.00 3.60 3.68 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.37 3.63 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 0.00 0.00 0.00 66 V 7.81 3.63 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 1.12 0.00 0.00 0.99 0.00 0.00 67 T 8.20 3.89 4.46 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 1.28 0.00 0.00 68 V 8.13 3.60 2.19 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 1.09 0.00 0.00 0.87 0.00 0.00 69 L 8.33 4.29 0.00 1.77 1.87 0.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.46 3.98 4.45 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 1.25 0.00 0.00 71 A 7.98 3.98 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 72 L 8.06 3.68 0.00 1.61 1.75 0.26 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.47 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 0.00 0.00 0.00 74 A 7.74 3.97 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 75 I 7.57 3.76 1.82 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 1.51 0.54 0.87 0.00 0.00 76 L 7.83 3.98 0.00 1.28 1.57 -0.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.77 3.95 0.00 1.63 1.80 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.53 7.81 78 K 7.79 3.99 0.00 1.79 1.88 0.00 1.76 0.00 0.00 1.55 0.00 0.00 3.10 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.61 1.75 7.81 79 K 8.25 2.00 0.00 1.13 0.74 0.00 1.48 0.00 0.00 1.42 0.00 0.00 2.70 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.63 0.92 7.81 80 G 7.74 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 81 H 7.60 4.51 0.00 3.11 3.25 0.00 5.79 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.36 5.57 0.00 3.25 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.56 3.93 0.00 2.07 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 2.40 2.41 0.00 84 A 7.95 4.05 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.09 4.17 0.00 2.22 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 2.37 2.42 0.00 86 L 8.34 4.10 0.00 1.89 1.67 1.02 0.54 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 87 K 8.11 3.93 0.00 1.96 1.88 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.60 7.81 88 P 0.00 4.30 0.00 2.19 2.13 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 89 L 7.99 4.12 0.00 1.98 1.84 1.13 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.26 4.19 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 91 Q 8.35 3.90 0.00 2.31 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 92 S 8.21 4.17 0.00 4.04 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.88 3.78 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 0.00 0.00 0.00 94 A 8.20 3.01 1.09 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 95 T 7.52 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 1.17 0.00 0.00 96 K 7.14 4.24 0.00 1.48 1.39 0.00 1.65 0.00 0.00 1.42 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.16 1.30 7.81 97 H 8.59 4.31 0.00 3.10 3.22 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.36 3.00 0.00 1.74 1.66 0.00 1.42 0.00 0.00 1.08 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.12 1.23 7.81 99 I 7.75 4.28 2.08 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 1.43 0.95 1.17 0.00 0.00 100 P 0.00 4.63 0.00 2.05 1.99 0.00 2.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.70 0.00 101 I 8.59 3.75 1.82 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.77 0.84 0.00 0.00 102 K 7.82 4.07 0.00 1.70 1.92 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 0.97 7.81 103 Y 7.95 4.08 0.00 3.20 3.14 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 0.00 104 L 7.95 4.19 0.00 1.87 1.85 0.77 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.26 4.01 0.00 2.05 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 2.34 2.52 0.00 106 F 8.14 4.59 0.00 3.20 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 0.00 107 I 8.34 3.93 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 1.13 0.00 0.00 108 S 8.49 4.23 0.00 4.25 4.01 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 0.00 109 E 8.71 4.08 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 110 A 8.15 4.03 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 0.00 111 I 8.12 3.68 2.12 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 0.89 1.05 0.00 0.00 112 I 7.95 3.93 2.16 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.86 1.13 0.00 0.00 113 H 8.58 4.15 0.00 3.29 3.52 0.00 5.78 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.14 3.53 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 0.90 0.00 0.00 1.00 0.00 0.00 115 L 8.12 3.79 0.00 1.19 0.41 0.56 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.36 4.44 0.00 3.49 3.44 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.13 4.18 0.00 3.90 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 0.00 118 R 7.83 4.17 0.00 1.47 1.51 0.00 2.66 0.00 0.00 2.95 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.57 0.00 119 H 8.29 5.04 0.00 3.17 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.18 0.00 2.18 2.13 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.89 0.00 121 G 8.10 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 0.00 122 D 8.24 5.07 0.00 2.68 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 0.00 123 F 8.07 5.08 0.00 3.00 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 0.00 124 G 7.73 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 0.00 125 A 8.43 3.89 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.96 4.20 0.00 2.70 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 0.00 127 A 7.81 3.99 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 0.00 128 Q 8.20 3.23 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 1.41 1.72 0.00 129 G 8.18 3.56 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 0.00 130 A 8.03 3.85 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 0.00 131 M 8.27 4.02 0.00 2.45 2.43 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.93 0.00 132 N 8.70 4.34 0.00 3.03 2.85 0.00 0.00 7.04 7.64 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 0.00 133 K 8.42 3.93 0.00 1.72 1.70 0.00 1.52 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.54 7.81 134 A 8.04 3.90 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.28 4.13 0.00 1.78 1.86 1.03 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.65 3.99 0.00 2.21 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 2.35 2.43 0.00 137 L 8.34 3.96 0.00 1.88 1.99 0.99 1.30 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 0.00 138 F 8.46 4.18 0.00 3.05 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 0.00 139 R 8.18 3.42 0.00 1.98 1.85 0.00 3.19 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.99 0.00 140 K 8.19 3.83 0.00 1.83 1.97 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.45 7.81 141 D 8.24 4.32 0.00 2.77 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 0.00 142 I 7.64 3.41 1.24 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.51 0.27 0.00 0.00 143 A 7.85 3.75 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 0.00 144 A 7.90 3.93 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 0.00 145 K 8.00 3.97 0.00 1.92 1.91 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.59 7.81 146 Y 8.51 4.53 0.00 3.07 3.23 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 0.00 147 K 8.37 4.29 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.45 1.67 7.81 148 E 8.16 4.01 0.00 2.13 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 2.36 2.61 0.00 149 L 7.61 4.50 0.00 1.80 1.72 0.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.29 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.02 4.69 0.00 2.66 2.80 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 0.00 152 Q 8.27 4.34 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 153 G 5.79 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 0.00 0.00 0.00