NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3857 8.3044 120.3494 54.8131 33.4244 174.9174 2 I 3.6165 8.3715 125.9911 61.1859 38.6966 173.3191 3 Q 4.8459 8.3958 125.1810 54.1351 33.6029 173.8026 4 S 5.1616 8.6206 116.3301 56.8177 66.3197 173.2530 5 Q 4.7715 9.0322 120.9181 54.7827 30.3820 175.7122 6 I 4.4551 8.3076 110.8945 60.1226 39.1022 174.8033 7 N 4.7946 7.8305 119.7616 50.9163 40.5870 174.4337 8 R 3.9793 8.6399 124.3432 59.4437 29.2672 178.2131 9 N 4.4333 8.4275 116.9440 55.7354 38.5163 177.4628 10 I 3.7192 7.5164 121.6915 64.5341 37.2126 178.5362 11 R 4.0726 7.8877 118.0101 58.6479 30.0765 178.8961 12 L 4.0201 8.0057 119.3125 57.5798 41.7361 178.8477 13 D 4.3622 8.2191 118.9713 57.3944 40.7343 178.7205 14 L 3.9299 7.8721 120.0796 57.9588 41.9978 178.5907 15 A 4.2077 8.1889 122.4299 54.7543 18.2909 179.2764 16 D 4.2960 8.0596 116.7408 57.4895 40.8883 178.9206 17 A 3.9882 7.9236 120.9267 55.2875 18.4110 179.7169 18 I 3.6560 7.9689 118.3511 64.6601 37.0837 178.7782 19 L 4.2579 8.3050 119.9603 57.2698 41.2761 179.4576 20 L 3.9367 7.9158 120.6861 58.0914 42.1367 178.6750 21 S 4.0284 7.9566 113.1479 61.3681 62.2794 175.7683 22 K 3.6980 8.5057 122.2894 59.7671 31.8657 178.3988 23 A 4.0110 7.6387 120.7092 54.7299 18.2478 179.5634 24 K 3.8705 8.0616 116.4833 59.4313 32.2994 178.8601 25 K 4.1965 7.8334 115.2771 55.4585 32.6649 176.0154 26 D 4.3271 7.5622 117.3406 55.0334 40.1169 173.2969 27 L 5.2450 7.9726 115.8982 53.1599 43.3120 177.7422 28 S 4.4757 8.3192 116.5829 57.4128 66.0462 175.4535 29 F 4.2102 8.4094 120.6974 60.3454 38.6464 177.7367 30 A 4.0693 8.1923 120.4901 55.2868 18.2083 179.2794 31 E 4.0624 8.1349 115.3698 59.2263 29.6689 179.2482 32 I 3.7193 7.5072 119.6186 64.2479 37.5736 177.9415 33 A 4.2764 8.2216 121.5303 53.4574 18.0592 177.0666 34 D 4.4288 7.4743 117.6644 56.2675 41.3784 176.4691 35 G 4.0995 9.1087 114.9674 45.5466 0.0000 174.0267 36 T 4.0485 7.6711 108.8707 62.1604 69.3270 176.2758 37 G 3.9435 8.3999 108.9689 45.1914 0.0000 172.7746 38 L 4.7145 7.4646 118.3650 52.1364 44.7052 176.8573 39 A 4.2068 8.2208 122.7433 51.8666 20.3700 178.5270 40 E 3.8990 8.9106 123.0150 59.4040 29.7736 179.3132 41 A 3.9467 8.0229 120.3073 55.0345 18.4557 179.2925 42 F 3.8909 8.0487 118.5148 61.4949 39.7224 177.4113 43 V 3.6593 8.1671 118.0276 66.2831 31.2871 177.9973 44 T 3.8089 7.9653 115.2327 66.6839 68.2661 176.4308 45 A 3.8440 7.7801 122.1339 54.8279 18.3136 179.6052 46 A 4.1338 7.5160 120.6355 54.8579 17.9826 179.6292 47 L 3.9965 7.9227 117.5008 57.9060 41.4908 178.9202 48 L 4.5404 7.7576 115.7990 54.4737 41.6654 177.5563 49 G 3.9033 8.0146 107.0746 45.6801 0.0000 174.3912 50 Q 4.4928 8.4234 116.4814 55.4745 30.0273 175.1642 51 Q 4.3988 7.3584 115.8527 54.0674 32.9936 172.8804 52 A 4.8014 8.2906 120.9834 50.8592 20.4041 176.8843 53 L 4.6396 8.6127 122.2876 53.1678 43.6589 175.1049 54 P 4.5022 0.0000 0.0000 62.2187 32.4713 177.3553 55 A 3.9878 8.7260 122.8387 55.5710 18.2086 179.9202 56 D 4.2705 8.0405 116.7110 57.4112 41.0474 178.6720 57 A 4.0014 7.9911 120.6414 55.0253 18.4506 179.2732 58 A 3.9800 8.3700 119.6742 55.5323 18.3815 180.1437 59 R 3.9509 8.3557 116.7974 59.1859 30.1097 179.3614 60 L 3.9796 7.8599 118.8727 58.0033 41.7931 180.0299 61 V 3.7824 8.0769 112.5060 63.9568 31.4464 178.5484 62 G 3.8551 8.5069 105.9699 48.1465 0.0000 175.4422 63 A 4.0339 8.2331 123.7724 54.6669 18.1757 179.8735 64 K 3.9797 7.9416 115.9309 58.6821 32.2073 178.5091 65 L 4.4540 7.5713 115.7236 53.0927 43.1416 175.4028 66 D 4.3285 7.4819 116.5930 55.1115 39.7366 173.2900 67 L 4.4878 8.0677 118.4297 53.5888 43.5429 177.6423 68 D 4.6990 8.2288 121.6516 52.8937 41.9048 177.3332 69 E 4.0142 8.5443 118.5833 59.6135 29.3341 179.3179 70 D 4.4312 8.0581 118.4286 57.1236 40.9048 178.8695 71 S 4.1386 8.4372 116.0868 61.5725 62.6497 176.6091 72 I 3.7366 7.5963 121.4709 64.1229 37.0389 178.0144 73 L 4.2257 8.0417 121.1240 58.2803 42.1038 178.7614 74 L 3.9577 8.2037 119.2728 58.1216 41.5836 179.5983 75 L 4.1168 8.1220 118.1276 57.1013 41.2892 178.6868 76 Q 4.6371 7.8183 117.8212 55.5232 29.4608 175.9891 77 M 4.4797 7.1585 119.8408 55.0933 33.1502 176.3619 78 I 4.0775 8.6915 124.3821 60.5125 38.0791 174.2210 79 P 4.5908 0.0000 0.0000 62.3952 32.5736 176.5614 80 L 4.2747 8.3501 123.5172 54.3127 41.3766 176.6246 81 R 4.1227 8.2289 124.7810 56.0162 30.7593 175.2410 82 G 3.0063 8.1045 107.8486 45.0084 0.0000 173.3114 83 C 4.2937 8.1165 122.0947 58.6829 30.6849 174.2903 84 I 4.1843 7.3913 121.8901 59.9992 37.9011 174.8309 85 D 4.4598 8.8671 125.5341 57.0634 41.5415 176.5062 86 D 4.6331 7.2353 115.3669 52.9887 41.3911 173.9316 87 R 4.2556 8.2182 126.8763 56.4156 29.2254 177.0261 88 I 4.0114 7.1780 116.4954 58.2566 38.8578 173.8895 89 P 4.3756 0.0000 0.0000 63.0774 31.6832 176.5651 90 T 4.1567 8.3811 111.7012 62.9419 69.8116 174.8976 91 D 4.6292 7.9491 122.6069 52.7966 42.7177 174.5439 92 P 4.2762 0.0000 0.0000 66.1523 31.2109 178.7547 93 T 3.8903 7.9749 112.7388 67.0670 68.6326 176.1586 94 M 4.5316 8.2177 120.5294 58.6254 32.0380 178.0037 95 Y 4.0270 9.0078 120.5562 60.8948 38.8459 178.6037 96 K 4.1700 7.9842 118.6960 58.9404 32.0990 179.5048 97 F 4.1754 7.5596 118.5162 60.5773 38.7914 176.6504 98 Y 4.0301 8.1075 118.7449 60.9625 38.4358 177.6953 99 E 3.6345 8.0442 120.1349 59.6245 29.5739 178.6195 100 M 4.1621 8.0929 118.5356 58.4379 31.9964 178.7419 101 L 3.9343 7.6613 118.4961 57.9645 41.5870 179.6496 102 Q 3.8359 7.6248 116.7653 58.2298 28.5517 178.4205 103 V 3.7563 7.3978 118.2536 64.5130 32.2745 176.6369 104 Y 4.6911 8.0645 113.9996 57.5630 38.5689 177.8676 105 G 3.6174 8.1194 109.2897 48.0164 0.0000 176.2474 106 T 4.0174 7.8145 111.6616 64.5851 68.9210 176.9268 107 T 3.9726 7.8798 118.3937 66.3253 68.5687 176.4724 108 L 3.9783 8.3792 121.3870 57.6950 41.6921 179.1312 109 K 3.7145 8.1068 119.1582 59.6804 32.0752 178.2695 110 A 4.0432 8.4473 120.9578 55.4827 18.2895 179.6931 111 L 4.0330 8.4267 117.7573 57.7123 41.6577 179.7288 112 V 3.8227 8.2410 118.7936 66.4006 31.1156 177.9259 113 H 5.1396 8.1562 117.1727 58.5076 28.3912 177.4160 114 E 3.9519 8.0182 119.7880 59.3124 29.5937 178.6419 115 K 3.9809 8.3562 117.4041 57.7914 32.2227 177.4473 116 F 3.9993 8.7920 115.3769 59.7035 41.2090 174.9479 117 G 3.9427 6.9037 104.6588 44.6237 0.0000 171.1950 118 D 4.7820 8.8672 120.5648 53.0030 41.9576 176.8079 119 G 3.7648 7.7934 114.7861 45.5805 0.0000 170.8820 120 I 4.7891 7.5410 113.5594 59.1218 41.6667 174.7474 121 I 4.4838 8.1926 124.2870 60.5425 37.6816 175.9367 122 S 4.2275 8.9727 122.8918 58.0137 62.9974 173.6001 123 A 4.2061 8.3852 127.3473 51.8354 19.3101 176.7591 124 I 4.3749 8.0587 118.0687 64.2193 39.6415 176.6441 125 N 4.7965 7.8693 122.4479 52.0904 37.7799 172.4069 126 F 5.4522 8.1137 123.3425 56.4516 42.9934 172.6617 127 K 4.5821 8.1545 123.4196 55.1757 36.1244 174.8079 128 L 5.7471 8.3141 120.6040 53.3941 44.0217 174.8725 129 D 4.7785 8.3184 117.5449 52.1428 43.0384 173.8671 130 V 4.8438 8.3465 119.6513 61.1508 33.9208 174.6484 131 K 4.6883 8.8242 126.9453 54.3181 35.4273 175.2649 132 K 4.6563 8.6940 126.2211 56.1036 33.3149 176.0667 133 V 4.5322 8.9284 126.6036 60.6333 34.9547 174.3127 134 A 4.3562 8.8833 129.2395 52.8465 19.2130 176.0432 135 D 4.6213 9.2497 122.4749 52.3436 41.8321 175.4285 136 P 4.4760 0.0000 0.0000 65.5381 31.4974 176.6752 137 E 4.4360 8.0554 115.5531 55.8457 29.5248 175.7906 138 G 3.8497 8.2021 108.4550 47.4453 0.0000 175.0056 139 G 3.8276 8.8379 109.0516 43.8204 0.0000 171.2559 140 E 5.1540 8.3823 116.9431 54.6011 32.6249 175.9008 141 R 4.7547 9.2829 121.6070 54.3619 33.5476 174.6839 142 A 4.9203 8.5694 124.4994 50.7482 20.5929 176.5816 143 V 4.1446 8.8012 124.1545 61.6900 33.0766 174.6084 144 I 4.9168 8.3834 129.4548 60.0814 38.9143 175.2803 145 T 4.5494 8.7100 124.4595 61.7742 70.6789 173.3462 146 L 4.8309 8.5493 126.6564 53.0426 43.8090 175.6874 147 D 4.5926 8.4407 123.3337 52.4549 43.6340 174.1998 148 G 4.6702 8.5233 111.9834 43.7958 0.0000 170.6851 149 K 4.3340 8.5689 123.4438 56.0864 33.2109 175.4253 150 Y 4.6028 8.7858 128.8056 57.6348 40.2627 173.8955 151 L 4.5307 8.5461 127.9861 52.0332 43.4476 174.3476 152 P 4.4668 0.0000 0.0000 62.6866 32.4471 176.0939 153 T 4.3118 8.7099 119.5420 63.0179 69.0991 174.4281 154 K 4.6081 8.5410 125.9122 53.5357 34.5983 174.3741 155 P 4.3759 0.0000 0.0000 63.0343 32.0108 176.1858 156 F 4.5404 7.7681 114.1617 57.1884 37.9822 174.5534 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 8.30 4.39 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.37 3.62 1.88 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.40 4.85 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.52 2.27 0.00 4 S 8.62 5.16 0.00 3.81 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 5 Q 9.03 4.77 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 6 I 8.31 4.46 1.87 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 1.29 0.65 0.91 0.00 0.00 7 N 7.83 4.79 0.00 2.75 2.67 0.00 0.00 6.91 7.65 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 8 R 8.64 3.98 0.00 2.06 2.30 0.00 3.10 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.43 4.43 0.00 2.90 2.91 0.00 0.00 6.87 7.48 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 10 I 7.52 3.72 1.87 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 1.14 0.91 0.00 0.00 11 R 7.89 4.07 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.55 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 12 L 8.01 4.02 0.00 1.70 1.70 0.91 0.77 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 13 D 8.22 4.36 0.00 2.95 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 14 L 7.87 3.93 0.00 1.80 1.81 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.19 4.21 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 16 D 8.06 4.30 0.00 2.93 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 17 A 7.92 3.99 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 18 I 7.97 3.66 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.63 0.95 0.00 0.00 19 L 8.31 4.26 0.00 1.84 1.75 0.99 0.94 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 20 L 7.92 3.94 0.00 1.78 1.80 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 S 7.96 4.03 0.00 3.94 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 22 K 8.51 3.70 0.00 1.82 1.88 0.00 1.13 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 1.28 1.26 7.81 23 A 7.64 4.01 1.32 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 0.00 0.00 0.00 24 K 8.06 3.87 0.00 1.89 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.61 7.81 25 K 7.83 4.20 0.00 1.71 1.82 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.56 7.81 26 D 7.56 4.33 0.00 2.78 2.68 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 27 L 7.97 5.25 0.00 1.55 1.48 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.32 4.48 0.00 4.05 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 29 F 8.41 4.21 0.00 3.21 3.13 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 30 A 8.19 4.07 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 31 E 8.13 4.06 0.00 2.24 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 2.45 2.32 0.00 32 I 7.51 3.72 1.93 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 0.66 0.95 0.00 0.00 33 A 8.22 4.28 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 34 D 7.47 4.43 0.00 2.83 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 35 G 9.11 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 0.00 0.00 0.00 0.00 36 T 7.67 4.05 4.29 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 1.27 0.00 0.00 37 G 8.40 3.94 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 0.00 0.00 0.00 38 L 7.46 4.71 0.00 1.72 1.66 1.04 0.49 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 39 A 8.22 4.21 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 40 E 8.91 3.90 0.00 2.09 2.00 0.00 0.00 0.00 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 2.48 0.00 41 A 8.02 3.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.05 3.89 0.00 3.18 3.22 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 43 V 8.17 3.66 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 1.06 0.00 0.00 1.13 0.00 0.00 44 T 7.97 3.81 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 0.34 0.00 0.00 45 A 7.78 3.84 1.19 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 0.00 0.00 46 A 7.52 4.13 1.23 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 0.00 0.00 47 L 7.92 4.00 0.00 2.00 1.85 1.13 0.53 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 48 L 7.76 4.54 0.00 1.54 1.64 0.75 0.92 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 49 G 8.01 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 0.00 0.00 0.00 0.00 50 Q 8.42 4.49 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.44 6.65 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 51 Q 7.36 4.40 0.00 1.40 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.94 0.00 0.00 0.00 0.00 0.00 1.96 1.27 0.00 52 A 8.29 4.80 1.32 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 0.00 0.00 0.00 53 L 8.61 4.64 0.00 1.66 1.65 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.50 0.00 2.09 1.99 0.00 3.69 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 2.13 2.13 0.00 55 A 8.73 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.04 4.27 0.00 2.71 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 57 A 7.99 4.00 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 58 A 8.37 3.98 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.36 3.95 0.00 1.86 2.00 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 60 L 7.86 3.98 0.00 1.89 1.73 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.08 3.78 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 1.07 0.00 0.00 1.03 0.00 0.00 62 G 8.51 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 0.00 0.00 0.00 63 A 8.23 4.03 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 64 K 7.94 3.98 0.00 1.90 1.88 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.68 7.81 65 L 7.57 4.45 0.00 1.73 1.67 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.48 4.33 0.00 2.79 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 67 L 8.07 4.49 0.00 1.65 1.57 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.23 4.70 0.00 2.95 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 69 E 8.54 4.01 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 70 D 8.06 4.43 0.00 2.72 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 71 S 8.44 4.14 0.00 4.09 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 72 I 7.60 3.74 1.88 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 1.58 0.56 0.96 0.00 0.00 73 L 8.04 4.23 0.00 1.90 1.84 0.93 0.43 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 74 L 8.20 3.96 0.00 1.88 1.72 0.92 0.59 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 75 L 8.12 4.12 0.00 1.91 1.73 0.94 0.82 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 76 Q 7.82 4.64 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.87 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 77 M 7.16 4.48 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.86 0.00 78 I 8.69 4.08 1.87 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 1.30 0.54 0.92 0.00 0.00 79 P 0.00 4.59 0.00 2.11 2.03 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 1.95 1.93 0.00 80 L 8.35 4.27 0.00 1.67 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.23 4.12 0.00 1.81 1.87 0.00 3.23 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 82 G 8.10 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 0.00 0.00 0.00 83 C 8.12 4.29 0.00 3.06 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 84 I 7.39 4.18 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.55 0.94 0.00 0.00 85 D 8.87 4.46 0.00 2.62 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 86 D 7.24 4.63 0.00 2.59 2.47 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 0.00 0.00 0.00 0.00 87 R 8.22 4.26 0.00 1.98 2.04 0.00 3.21 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 1.50 1.62 0.00 88 I 7.18 4.01 1.76 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.73 0.72 0.00 0.00 89 P 0.00 4.38 0.00 2.19 2.05 0.00 3.31 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 90 T 8.38 4.16 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 1.19 0.00 0.00 91 D 7.95 4.63 0.00 2.85 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.28 0.00 2.23 2.12 0.00 3.69 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 93 T 7.97 3.89 4.48 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 1.34 0.00 0.00 94 M 8.22 4.53 0.00 2.12 2.33 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 2.71 2.62 0.00 95 Y 9.01 4.03 0.00 3.19 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 96 K 7.98 4.17 0.00 1.44 1.51 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.55 7.81 97 F 7.56 4.18 0.00 3.29 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 Y 8.11 4.03 0.00 2.92 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 99 E 8.04 3.63 0.00 1.86 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 2.29 2.37 0.00 100 M 8.09 4.16 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.61 0.00 101 L 7.66 3.93 0.00 1.51 1.55 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.62 3.84 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 1.68 2.40 0.00 103 V 7.40 3.76 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 0.15 0.00 0.00 0.86 0.00 0.00 104 Y 8.06 4.69 0.00 3.23 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 0.00 105 G 8.12 3.62 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 0.00 0.00 0.00 106 T 7.81 4.02 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 107 T 7.88 3.97 4.59 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 1.34 0.00 0.00 108 L 8.38 3.98 0.00 1.85 1.72 0.95 0.68 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 0.00 109 K 8.11 3.71 0.00 1.83 2.02 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.49 7.81 110 A 8.45 4.04 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 0.00 111 L 8.43 4.03 0.00 1.71 1.77 0.95 0.76 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 0.00 112 V 8.24 3.82 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 0.94 0.00 0.00 0.84 0.00 0.00 113 H 8.16 5.14 0.00 3.41 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.02 3.95 0.00 2.00 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 2.30 2.34 0.00 115 K 8.36 3.98 0.00 1.74 1.25 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.52 7.81 116 F 8.79 4.00 0.00 2.39 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 6.90 3.94 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 0.00 0.00 0.00 118 D 8.87 4.78 0.00 2.76 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 7.79 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 0.00 120 I 7.54 4.79 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 1.18 1.18 0.92 0.00 0.00 121 I 8.19 4.48 1.82 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.62 0.96 0.00 0.00 122 S 8.97 4.23 0.00 3.86 3.88 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 0.00 123 A 8.39 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 8.06 4.37 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.97 0.93 0.00 0.00 125 N 7.87 4.80 0.00 2.80 2.75 0.00 0.00 6.52 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 0.00 126 F 8.11 5.45 0.00 3.14 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 0.00 127 K 8.15 4.58 0.00 1.61 1.69 0.00 1.22 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.15 1.18 7.81 128 L 8.31 5.75 0.00 1.76 1.43 1.03 0.86 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 0.00 129 D 8.32 4.78 0.00 2.66 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.35 4.84 2.09 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 0.88 0.00 0.00 0.91 0.00 0.00 131 K 8.82 4.69 0.00 1.72 1.65 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.45 7.81 132 K 8.69 4.66 0.00 1.79 1.72 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.45 7.81 133 V 8.93 4.53 2.09 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 0.90 0.00 0.00 0.94 0.00 0.00 134 A 8.88 4.36 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 0.00 135 D 9.25 4.62 0.00 2.72 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 0.00 136 P 0.00 4.48 0.00 2.08 2.14 0.00 3.72 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 2.04 2.15 0.00 137 E 8.06 4.44 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 138 G 8.20 3.85 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 0.00 0.00 0.00 139 G 8.84 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 0.00 0.00 0.00 140 E 8.38 5.15 0.00 1.83 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 141 R 9.28 4.75 0.00 1.78 1.80 0.00 3.27 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 142 A 8.57 4.92 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 0.00 143 V 8.80 4.14 2.09 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 0.96 0.00 0.00 0.94 0.00 0.00 144 I 8.38 4.92 1.97 0.00 0.00 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 1.41 0.85 0.90 0.00 0.00 145 T 8.71 4.55 4.40 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 1.17 0.00 0.00 146 L 8.55 4.83 0.00 1.64 1.96 0.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.44 4.59 0.00 2.59 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 0.00 148 G 8.52 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 8.57 4.33 0.00 1.98 1.72 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.45 7.81 150 Y 8.79 4.60 0.00 2.94 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 0.00 151 L 8.55 4.53 0.00 1.43 1.43 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.47 0.00 2.04 1.97 0.00 3.49 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.93 0.00 153 T 8.71 4.31 4.29 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 1.27 0.00 0.00 154 K 8.54 4.61 0.00 1.75 1.75 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.44 7.81 155 P 0.00 4.38 0.00 2.03 1.95 0.00 3.66 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 2.04 2.10 0.00 156 F 7.77 4.54 0.00 3.07 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