NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 M 4.3674 8.3049 120.3380 55.6863 33.5041 175.8115 4 H 4.5321 8.2851 122.9760 52.4799 29.6412 169.4548 5 V 3.6163 8.7959 126.9077 65.8874 32.0356 177.2692 6 K 3.8775 7.8110 117.6440 59.1378 31.9394 179.1431 7 E 3.9708 8.0760 118.6258 59.4556 29.4083 179.4039 8 R 4.0094 8.1769 118.1828 59.2545 30.0552 178.4046 9 Y 4.6644 8.4497 121.1604 60.3105 38.8451 178.4259 10 K 3.7443 8.2732 119.3900 59.4696 32.0341 179.1617 11 N 4.3497 8.3664 116.8605 56.2037 38.3692 177.2617 12 F 4.1116 8.6083 122.5714 61.1062 39.5888 177.2401 13 L 3.8171 7.9430 118.8895 57.7167 41.1883 178.9770 14 N 4.2554 7.8305 115.7569 56.7244 38.9755 176.5011 15 Q 3.9718 7.9692 118.3231 57.6526 29.2626 176.1365 16 H 4.6478 7.8080 113.6727 53.5809 31.3085 173.1824 17 V 4.4086 7.6992 119.1640 61.1796 33.1810 176.0190 18 G 4.1080 9.2672 116.0346 43.7580 0.0000 170.6443 19 P 4.5331 0.0000 0.0000 64.9911 31.8479 176.8093 20 D 4.9074 7.7041 116.4007 53.8897 41.6708 175.6491 21 M 4.2161 7.7885 116.6636 54.9052 32.7569 175.7346 22 S 4.6612 7.8281 113.2964 55.8849 66.4130 175.5622 23 V 3.6782 8.4314 114.8747 64.5452 30.9995 178.5956 24 Q 4.1749 8.0219 115.5604 58.1973 28.7998 177.3846 25 R 4.3441 7.6332 119.2678 56.1037 30.3980 177.0595 26 C 4.0908 7.8897 118.2488 60.3846 38.3048 175.9211 27 N 4.4443 8.0716 117.1085 56.5052 38.0928 177.4347 28 S 4.1243 7.9273 112.7988 61.3630 62.8051 175.5398 29 E 4.0299 8.3919 121.6817 59.2677 29.1814 179.1979 30 I 4.0120 8.0218 119.8386 63.0319 37.3521 176.6376 31 G 4.2422 7.8979 109.4411 44.0072 0.0000 172.3238 32 P 4.2963 0.0000 0.0000 64.5849 31.2486 176.8644 33 N 4.7575 7.9356 115.1203 53.9629 40.7246 174.5437 34 N 4.9583 8.1716 111.7999 53.9134 38.6429 176.0065 35 R 4.0908 6.0016 128.9499 57.2947 31.4898 176.1079 36 K 3.7327 7.7651 118.5055 57.2176 30.9201 175.0159 37 I 4.2388 7.8655 119.0005 61.3170 37.9220 177.4145 38 T 4.9915 8.3121 116.1888 59.2102 72.5265 173.4037 39 L 4.0775 8.6518 125.5276 55.2916 43.1452 176.8026 40 S 4.2833 8.7269 122.2560 60.5242 63.1952 174.8169 41 G 3.9981 9.3385 112.8123 45.3951 0.0000 172.7261 42 T 4.7383 7.4700 108.1330 59.7284 71.6606 173.6012 43 D 4.7258 8.5645 120.5451 54.2590 40.4598 177.3944 44 N 4.9984 7.8551 115.1424 53.6988 39.8886 174.4026 45 G 4.2782 8.6603 108.0131 45.8583 0.0000 172.3689 46 C 5.0783 8.4298 117.9310 55.2575 39.7599 174.3441 47 K 4.3323 8.7647 123.8168 55.6978 32.5951 176.2497 48 P 4.4617 0.0000 0.0000 65.4519 32.5141 176.2725 49 V 5.1371 7.2666 116.0438 60.6299 34.7679 173.5287 50 N 4.8971 9.2072 121.8918 52.6816 42.5141 172.8494 51 T 4.8029 8.6220 123.0570 61.8893 71.0420 173.4445 52 F 4.6530 8.8683 125.0470 55.9764 41.3165 174.8164 53 I 4.4253 8.7677 125.0138 59.9177 38.5503 176.2852 54 L 4.8206 8.6038 130.2407 52.4922 39.0381 175.6121 55 A 4.6312 7.4681 121.2968 49.6411 22.8268 176.6130 56 N 4.6212 8.6253 118.0939 53.1567 41.0756 176.1761 57 K 4.1598 8.8136 126.0446 60.5319 32.3363 179.5774 58 R 4.0072 8.7060 118.8306 58.8278 30.1492 178.4444 59 L 4.2057 8.1265 119.8265 58.3247 42.2518 178.9634 60 I 3.7806 8.1086 119.8630 64.1772 36.9892 178.2812 61 K 3.9211 8.4359 120.8543 59.5111 31.8458 178.8111 62 T 3.8506 7.8475 109.7627 64.4266 68.4749 176.4769 63 V 3.6605 7.8983 121.4493 65.8686 31.2619 176.3416 64 C 4.6567 8.0750 113.8567 56.7742 40.1684 174.2264 65 G 3.9163 8.4203 110.1872 45.8975 0.0000 176.7833 66 R 4.0809 8.8258 124.1494 57.3098 30.2120 176.3625 67 A 4.8333 7.9523 120.9940 51.6187 19.4251 176.0315 68 G 5.2041 7.9265 103.7645 45.0864 0.0000 172.9063 69 S 4.9692 8.9666 115.0070 55.2998 66.6848 171.8235 70 P 4.6507 0.0000 0.0000 63.2142 32.1285 176.8494 71 Q 4.3207 9.1148 124.1529 55.0655 30.4465 175.8185 72 G 3.7171 8.1012 116.1076 46.3124 0.0000 172.2004 73 N 4.5630 8.8355 121.7803 53.6281 37.6896 174.0032 74 M 4.9223 8.0619 119.4413 53.6328 36.3854 174.1702 75 V 4.7838 8.8504 118.4733 61.4647 34.9676 174.2945 76 R 5.1644 8.9586 128.5892 54.3556 31.9883 175.5889 77 S 4.7501 8.9784 121.7630 58.9319 63.1572 174.3195 78 N 4.7145 9.4121 120.0967 55.3400 38.9880 175.3487 79 Q 5.0553 8.1746 116.3861 53.0456 31.7924 174.0108 80 P 4.2534 0.0000 0.0000 62.7667 32.4502 175.3757 81 F 4.8953 9.3569 119.8424 54.7809 42.9235 172.8563 82 P 4.9204 0.0000 0.0000 63.1165 32.6084 175.5537 83 V 5.0155 9.0170 115.3464 59.7975 36.9232 174.3147 84 V 4.6718 8.8568 122.9002 61.2035 34.0410 174.1762 85 K 4.6581 9.1292 130.8922 55.3054 33.7932 174.2298 86 C 5.4042 8.8657 125.6929 55.3361 38.9722 172.9153 87 V 4.9687 8.9039 124.6506 60.5239 33.9554 174.5137 88 L 3.4621 9.1123 130.9130 55.6746 42.6287 176.2237 89 N 4.7265 9.0712 125.0347 54.9403 41.3942 173.8182 90 N 4.8878 7.8978 113.2422 52.6064 40.5067 174.7668 91 G 4.4497 9.5999 106.2585 47.0706 0.0000 173.0691 92 E 4.8290 8.6421 116.6348 55.4069 31.7239 174.9987 93 R 4.9397 7.7169 116.0765 54.8279 33.2366 174.2261 94 H 4.6032 8.8784 118.2470 55.0972 29.5542 173.2836 95 P 4.7190 0.0000 0.0000 63.4384 31.6952 175.6016 96 Y 5.2233 7.6147 114.8040 57.9965 38.5221 174.6079 97 C 4.6730 8.4035 118.1126 56.5107 40.4938 173.0889 98 E 5.0578 8.8476 123.9475 54.7419 31.8870 175.0222 99 Y 4.8078 9.7554 121.9815 56.1666 41.5059 174.9174 100 R 4.6523 9.2698 122.2051 54.8100 32.2730 175.2373 101 G 4.7214 8.7725 112.4532 44.5863 0.0000 172.2135 102 T 4.8204 8.7112 111.4443 59.5643 72.1555 172.5551 103 R 5.0035 8.6427 125.4751 55.3437 31.5300 175.2013 104 S 4.6816 8.8918 120.0454 57.9160 66.9996 172.2713 105 T 5.0505 8.4032 115.3149 62.2419 71.1796 174.0774 106 R 4.7246 9.0890 124.5806 54.4510 35.2485 174.2846 107 Y 4.5884 8.6302 119.8555 57.5652 38.3400 175.4262 108 I 4.0968 8.6079 119.2604 60.4024 39.7579 175.0262 109 V 4.7715 7.8466 123.8277 61.2317 34.0158 174.1898 110 L 5.1932 9.0026 127.0744 52.7894 46.3132 175.0882 111 K 4.7362 8.7455 122.0258 55.3498 33.9483 174.6065 112 C 5.5185 8.6959 123.3176 55.2536 45.1926 173.6498 113 E 4.4967 9.0328 121.0685 55.5023 31.9214 175.8429 114 E 3.9143 10.0765 125.5359 57.3791 27.1450 176.0886 115 G 3.6961 8.4922 104.7065 44.8964 0.0000 173.5839 116 W 4.4894 7.8373 120.2592 53.6810 31.4133 173.4599 117 P 4.6814 0.0000 0.0000 62.8074 31.4543 176.7223 118 V 4.6564 8.2265 112.7569 61.0782 33.8499 174.8636 119 H 5.0058 7.8284 118.7873 55.3484 33.2864 171.1981 120 Y 4.7542 8.3842 125.2102 55.9402 40.6055 174.3641 121 H 4.5562 8.5613 128.0892 55.5353 29.9970 174.7418 122 E 4.5700 8.6068 125.5260 55.2755 30.6503 176.5366 123 D 4.5225 8.3613 120.6287 53.9553 41.5771 176.3392 124 E 4.1291 8.5392 122.6039 56.5228 30.2894 176.4498 125 V 4.5229 7.9748 116.5893 59.5571 35.6653 174.3135 126 N 4.8108 8.5399 120.0016 52.0093 39.8693 175.0832 127 V 4.0093 8.1888 119.2142 61.8225 32.8539 176.4518 128 G 4.3513 8.6970 111.1097 45.9631 0.0000 173.3938 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 3 M 8.30 4.37 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 4 H 8.29 4.53 0.00 3.31 3.19 0.00 5.87 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.80 3.62 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 1.05 0.00 0.00 0.95 0.00 0.00 6 K 7.81 3.88 0.00 1.67 1.67 0.00 1.08 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.05 7.81 7 E 8.08 3.97 0.00 2.15 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 2.36 2.38 0.00 8 R 8.18 4.01 0.00 2.07 2.07 0.00 3.18 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 9 Y 8.45 4.66 0.00 3.06 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 10 K 8.27 3.74 0.00 1.98 1.79 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.71 7.81 11 N 8.37 4.35 0.00 2.95 2.88 0.00 0.00 6.65 7.72 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 12 F 8.61 4.11 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 13 L 7.94 3.82 0.00 1.75 1.59 0.71 0.46 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 14 N 7.83 4.26 0.00 2.65 2.91 0.00 0.00 7.31 6.76 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 15 Q 7.97 3.97 0.00 1.59 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 16 H 7.81 4.65 0.00 1.87 2.57 0.00 5.57 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.70 4.41 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.91 0.00 0.00 18 G 9.27 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.53 0.00 2.06 2.16 0.00 3.61 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.30 0.00 20 D 7.70 4.91 0.00 2.54 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 M 7.79 4.22 0.00 1.86 2.03 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.22 0.00 22 S 7.83 4.66 0.00 3.91 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 23 V 8.43 3.68 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 1.04 0.00 0.00 0.93 0.00 0.00 24 Q 8.02 4.17 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 25 R 7.63 4.34 0.00 1.86 1.82 0.00 3.07 0.00 0.00 3.07 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 26 C 7.89 4.09 0.00 3.05 3.12 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 27 N 8.07 4.44 0.00 2.79 2.96 0.00 0.00 6.67 7.78 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 28 S 7.93 4.12 0.00 3.84 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 29 E 8.39 4.03 0.00 1.82 1.60 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 2.13 2.12 0.00 30 I 8.02 4.01 1.90 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.79 0.95 0.00 0.00 31 G 7.90 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 0.00 0.00 0.00 32 P 0.00 4.30 0.00 2.10 2.04 0.00 3.73 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 1.90 1.88 0.00 33 N 7.94 4.76 0.00 2.70 2.87 0.00 0.00 6.72 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 34 N 8.17 4.96 0.00 2.87 2.25 0.00 0.00 7.01 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 35 R 6.00 4.09 0.00 1.96 1.98 0.00 3.45 0.00 0.00 3.59 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 36 K 7.77 3.73 0.00 1.76 1.73 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.20 7.81 37 I 7.87 4.24 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.76 0.85 0.00 0.00 38 T 8.31 4.99 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 1.37 0.00 0.00 39 L 8.65 4.08 0.00 1.90 1.61 0.94 1.03 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 40 S 8.73 4.28 0.00 3.92 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 41 G 9.34 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 42 T 7.47 4.74 4.25 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 1.22 0.00 0.00 43 D 8.56 4.73 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 44 N 7.86 5.00 0.00 2.77 3.01 0.00 0.00 6.12 6.92 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 45 G 8.66 4.28 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 0.00 46 C 8.43 5.08 0.00 2.82 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 47 K 8.76 4.33 0.00 1.90 1.77 0.00 1.63 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.42 7.81 48 P 0.00 4.46 0.00 2.14 2.32 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 49 V 7.27 5.14 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 0.61 0.00 0.00 0.96 0.00 0.00 50 N 9.21 4.90 0.00 2.58 2.24 0.00 0.00 7.01 8.02 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 51 T 8.62 4.80 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 1.02 0.00 0.00 52 F 8.87 4.65 0.00 2.87 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 53 I 8.77 4.43 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.66 1.02 0.00 0.00 54 L 8.60 4.82 0.00 1.71 1.67 0.98 0.67 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 55 A 7.47 4.63 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.63 4.62 0.00 2.83 2.77 0.00 0.00 6.64 6.30 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 57 K 8.81 4.16 0.00 2.31 2.21 0.00 1.79 0.00 0.00 1.92 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.62 1.73 7.81 58 R 8.71 4.01 0.00 2.01 2.08 0.00 3.22 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 59 L 8.13 4.21 0.00 1.85 1.98 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.11 3.78 2.20 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.86 1.06 0.00 0.00 61 K 8.44 3.92 0.00 1.91 1.91 0.00 0.85 0.00 0.00 1.31 0.00 0.00 2.18 0.00 0.00 2.25 0.00 0.00 0.00 0.00 1.11 1.15 7.81 62 T 7.85 3.85 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 1.25 0.00 0.00 63 V 7.90 3.66 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.92 0.00 0.00 64 C 8.08 4.66 0.00 3.10 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 65 G 8.42 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.83 4.08 0.00 1.81 1.99 0.00 3.18 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 67 A 7.95 4.83 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 68 G 7.93 5.20 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 0.00 0.00 0.00 69 S 8.97 4.97 0.00 3.82 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 70 P 0.00 4.65 0.00 1.93 2.00 0.00 3.62 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 71 Q 9.11 4.32 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.73 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 72 G 8.10 3.72 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 0.00 0.00 0.00 73 N 8.84 4.56 0.00 2.82 2.91 0.00 0.00 5.67 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 74 M 8.06 4.92 0.00 2.10 2.05 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 2.43 2.40 0.00 75 V 8.85 4.78 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 0.95 0.00 0.00 0.89 0.00 0.00 76 R 8.96 5.16 0.00 2.00 1.74 0.00 3.08 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 77 S 8.98 4.75 0.00 4.29 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 78 N 9.41 4.71 0.00 2.70 2.99 0.00 0.00 6.78 7.23 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 79 Q 8.17 5.06 0.00 1.86 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.03 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 80 P 0.00 4.25 0.00 1.77 1.12 0.00 3.60 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 81 F 9.36 4.90 0.00 2.90 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 82 P 0.00 4.92 0.00 2.15 2.18 0.00 3.71 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 2.31 2.00 0.00 83 V 9.02 5.02 2.16 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 0.84 0.00 0.00 0.99 0.00 0.00 84 V 8.86 4.67 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.94 0.00 0.00 85 K 9.13 4.66 0.00 1.87 1.69 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.41 7.81 86 C 8.87 5.40 0.00 2.77 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 87 V 8.90 4.97 2.15 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 0.89 0.00 0.00 0.99 0.00 0.00 88 L 9.11 3.46 0.00 1.73 1.42 0.38 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 89 N 9.07 4.73 0.00 2.70 2.80 0.00 0.00 6.34 6.75 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 90 N 7.90 4.89 0.00 2.80 2.80 0.00 0.00 6.44 6.92 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 91 G 9.60 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 0.00 0.00 0.00 0.00 92 E 8.64 4.83 0.00 1.96 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 2.25 2.21 0.00 93 R 7.72 4.94 0.00 1.96 2.02 0.00 3.00 0.00 0.00 3.37 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 94 H 8.88 4.60 0.00 3.03 3.19 0.00 5.64 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.72 0.00 1.85 1.86 0.00 2.92 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.38 0.00 96 Y 7.61 5.22 0.00 3.20 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 97 C 8.40 4.67 0.00 3.04 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 98 E 8.85 5.06 0.00 1.90 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 2.41 2.52 0.00 99 Y 9.76 4.81 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 R 9.27 4.65 0.00 1.86 1.81 0.00 3.06 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 101 G 8.77 4.72 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 0.00 0.00 0.00 102 T 8.71 4.82 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 1.24 0.00 0.00 103 R 8.64 5.00 0.00 1.83 1.88 0.00 3.49 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 104 S 8.89 4.68 0.00 3.91 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 0.00 105 T 8.40 5.05 4.21 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 1.18 0.00 0.00 106 R 9.09 4.72 0.00 1.76 1.84 0.00 3.34 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 107 Y 8.63 4.59 0.00 2.95 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 0.00 108 I 8.61 4.10 1.82 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.01 1.11 0.00 0.00 109 V 7.85 4.77 1.97 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 0.97 0.00 0.00 0.91 0.00 0.00 110 L 9.00 5.19 0.00 1.43 1.43 0.82 0.72 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 0.00 111 K 8.75 4.74 0.00 1.86 1.68 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.39 7.81 112 C 8.70 5.52 0.00 2.81 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 0.00 113 E 9.03 4.50 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.43 0.00 114 E 10.08 3.91 0.00 2.23 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 2.25 2.33 0.00 115 G 8.49 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 0.00 0.00 0.00 116 W 7.84 4.49 0.00 3.37 2.85 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 0.00 0.00 0.00 0.00 117 P 0.00 4.68 0.00 0.49 1.74 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.01 0.00 118 V 8.23 4.66 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.01 0.00 0.00 119 H 7.83 5.01 0.00 3.31 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 8.38 4.75 0.00 2.63 2.40 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 0.00 121 H 8.56 4.56 0.00 3.10 3.20 0.00 5.99 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.61 4.57 0.00 2.01 1.90 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 2.40 2.31 0.00 123 D 8.36 4.52 0.00 2.70 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 E 8.54 4.13 0.00 1.94 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 0.00 2.31 2.35 0.00 125 V 7.97 4.52 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 0.86 0.00 0.00 1.00 0.00 0.00 126 N 8.54 4.81 0.00 2.67 2.72 0.00 0.00 7.04 7.71 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 0.00 127 V 8.19 4.01 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 0.74 0.00 0.00 0.92 0.00 0.00 128 G 8.70 4.35 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 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