NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5347 8.3044 120.2866 55.2901 33.9781 173.9260 3 V 4.2377 8.0473 121.3584 59.8247 33.8568 172.8773 4 W 4.6619 9.1659 135.0000 57.5305 31.5921 174.8683 5 T 4.1818 8.5731 124.4125 61.4791 67.0464 172.5855 6 P 4.5415 0.0000 0.0000 63.1853 32.2676 175.5966 7 V 4.0610 7.4397 119.6381 62.6619 32.9308 175.3372 8 N 4.2047 8.6413 125.2697 54.9599 36.1079 173.6788 9 N 4.8887 7.5698 108.5465 52.9591 40.1114 174.1963 10 K 4.1275 8.3780 116.4948 56.5069 32.8165 176.7887 11 M 4.8985 8.3574 121.1417 53.9455 35.0679 175.3305 12 F 4.6042 8.1846 116.2629 57.3685 41.0392 176.4456 13 E 3.4712 8.3408 122.3070 57.1597 27.9574 175.5289 14 T 3.8476 8.3562 122.0430 66.4994 68.9585 174.2448 15 F 4.5328 9.0323 124.1597 57.5931 36.6418 176.4321 16 S 4.4773 8.2466 114.9612 60.4251 62.9753 174.5090 17 Y 4.3976 8.2844 117.2817 58.1880 38.2216 175.1018 18 L 4.6825 7.5807 119.9737 52.1347 43.6223 174.4894 19 P 4.4225 0.0000 0.0000 61.9315 31.7576 175.0129 20 P 4.3003 0.0000 0.0000 62.8272 31.7599 176.4294 21 L 3.9812 8.3549 122.8661 54.7724 42.1369 177.9602 22 T 4.2384 8.2041 114.0977 61.1508 71.1456 175.2662 23 D 4.3372 8.5484 120.9032 57.5468 40.7515 178.7773 24 E 3.9277 8.0745 119.3081 59.4013 29.8387 178.7826 25 Q 3.9410 8.0088 118.1714 58.7562 28.6701 178.7148 26 I 3.6940 8.0744 120.9980 64.3407 37.1169 178.1140 27 A 4.0197 8.1974 121.4308 55.3264 18.2215 179.5416 28 A 3.9563 8.0788 119.0766 55.4401 18.4286 179.9337 29 Q 4.0946 8.0758 116.3895 59.0885 28.8097 179.1032 30 V 3.7451 8.2306 119.4492 66.1594 31.5495 177.6917 31 D 4.4376 8.5037 118.9243 57.6087 40.7208 178.2919 32 Y 4.1401 8.0633 119.7673 60.6495 38.8462 177.8900 33 I 3.9126 7.9674 120.8016 64.6785 37.3123 178.5835 34 V 3.5318 7.8979 118.5439 65.9699 31.1591 177.8741 35 A 3.9154 8.1126 119.7931 54.6129 18.2582 178.3799 36 N 4.0614 7.1572 111.8192 52.1403 38.7234 175.6944 37 G 3.7640 7.2807 108.3058 46.1393 0.0000 174.0812 38 W 4.9691 7.5213 118.8809 56.0458 30.7242 176.2718 39 I 4.5043 8.8972 123.2881 59.3083 37.9275 173.9927 40 P 4.9310 0.0000 0.0000 63.1715 32.9368 174.8288 41 C 5.0051 8.9282 120.3527 58.4533 35.6216 172.3315 42 L 5.3466 8.7427 123.5190 53.1474 44.5185 175.2202 43 E 5.6138 9.2497 121.3699 54.8368 34.0028 174.6685 44 F 5.6615 9.1266 116.3970 55.8305 42.1575 173.0554 45 A 4.4930 8.3693 120.1781 50.1481 22.5922 176.2517 46 E 4.2635 8.6339 118.7194 55.7338 30.5703 177.6512 47 A 4.2789 8.8767 122.9766 55.9093 18.3669 179.7632 48 D 4.5316 8.1275 113.0154 56.2743 41.0804 177.1637 49 K 4.5932 7.9498 117.2800 56.0311 32.6653 176.8038 50 A 3.8525 7.6173 124.1294 53.8996 18.9177 178.2565 51 Y 4.6495 7.4179 111.2410 55.5731 40.2331 175.7727 52 V 3.8540 8.3103 122.2756 63.8691 31.9873 175.2467 53 S 4.7489 8.7881 119.4386 56.7399 66.3196 173.7292 54 N 5.1719 8.5639 114.4187 52.6491 39.2106 176.0722 55 E 3.9584 8.2428 120.9642 59.8653 29.4319 179.2112 56 S 4.0181 8.7966 115.3970 60.5827 62.8604 176.0509 57 A 2.5800 7.6379 123.3473 53.6354 17.7165 179.0496 58 I 3.5692 6.9541 116.9133 63.7630 38.0302 177.1389 59 R 4.2727 7.5760 116.3462 55.7455 30.5234 176.2446 60 F 5.0782 7.1407 118.0608 55.8708 41.3121 177.3959 61 G 3.9838 8.2239 115.7209 46.2066 0.0000 175.2140 62 S 4.5952 8.4266 113.7255 58.4307 61.9260 174.4140 63 V 4.4621 7.2217 107.2099 61.1442 33.3260 177.7078 64 S 4.4931 8.2219 115.2723 59.6867 63.5512 173.5380 65 C 4.0512 8.1154 119.0552 61.6421 27.9810 173.1320 66 L 3.6111 8.4479 122.9764 55.5867 39.0420 173.1376 67 Y 4.3983 7.7825 119.5510 55.9979 39.9090 174.5892 68 Y 4.8599 7.2289 123.3039 56.3273 42.3449 174.7122 69 D 4.5027 8.8869 123.3298 55.1638 41.8118 176.9640 70 N 4.4227 8.8791 116.2900 54.2099 36.0176 176.0260 71 R 3.9482 7.9557 118.8621 59.2969 30.3605 177.1347 72 Y 4.3920 7.6984 114.8513 57.8539 38.4123 175.1452 73 W 5.0535 8.6949 124.5994 55.5689 32.5261 174.5441 74 T 4.3762 8.0214 116.8727 62.4398 69.7066 174.5042 75 M 4.6353 8.5215 126.5873 55.2740 33.1819 175.2398 76 W 4.7776 9.5239 135.0000 56.2926 31.2631 176.8334 77 K 3.4366 8.5624 128.9001 57.5900 30.5703 178.0620 78 L 4.9244 8.2529 125.0039 52.6859 45.1135 174.0529 79 P 4.3568 0.0000 0.0000 63.4386 32.2793 177.4634 80 M 4.2966 8.5879 122.9842 53.7228 30.4331 175.6523 81 F 4.4937 7.3674 118.7966 58.7693 40.0325 176.4943 82 G 3.9814 9.1230 112.5350 45.5201 0.0000 173.0240 83 C 4.2697 7.8670 120.4641 59.6798 31.6828 173.1705 84 R 4.5444 8.6562 124.1694 55.5191 31.1275 174.4737 85 D 4.8322 7.7814 118.4205 51.5343 42.6106 174.6301 86 P 4.3226 0.0000 0.0000 65.9009 31.2612 178.5759 87 M 4.1511 8.2954 117.5125 58.2800 31.8030 178.7198 88 Q 4.0167 7.9309 118.6013 58.8773 28.8946 179.0181 89 V 3.6105 7.7523 118.6978 66.0788 31.7741 177.8951 90 L 4.0403 7.9157 118.6826 57.9512 41.4121 179.7897 91 R 3.9860 8.2917 118.1175 59.2671 29.8972 178.9962 92 E 4.1263 8.3110 118.4914 59.1789 29.4341 179.2776 93 I 3.5267 7.8244 120.0299 64.3194 37.2159 178.4732 94 V 3.4777 7.6365 118.4834 65.9568 31.3459 177.8667 95 A 3.9485 8.0230 120.4288 55.2083 18.2546 179.1996 96 C 2.0000 7.6487 117.6363 62.0958 31.1224 175.9799 97 T 3.7300 7.5619 111.2802 64.3831 67.9854 176.4221 98 K 3.8191 7.7101 121.7215 59.3233 32.3212 178.4543 99 A 3.9724 7.5692 119.9348 53.5208 19.8487 177.6473 100 F 4.7362 7.7530 115.4774 55.1126 39.1369 173.9884 101 P 4.4257 0.0000 0.0000 64.3065 31.8838 177.8663 102 D 4.6275 8.0661 116.6724 53.9415 41.2057 175.5599 103 A 4.7786 7.3486 120.9592 50.4208 21.1928 177.0725 104 Y 4.1972 8.5821 117.9231 57.9442 39.4138 175.3189 105 V 5.2109 8.9806 123.2878 61.1276 35.2025 174.2988 106 R 4.9784 9.4874 123.8861 54.2535 33.0093 173.8436 107 L 4.7800 8.1702 123.7192 54.0425 43.6972 175.7252 108 V 4.8026 8.7161 118.4125 59.4687 36.3703 174.2062 109 A 4.8914 8.0433 121.6703 50.4256 22.7841 175.1703 110 F 5.2302 9.0242 119.6991 55.6981 42.7166 174.1302 111 D 5.3587 8.8457 122.6566 52.6999 42.4109 176.5577 112 N 4.7428 9.1711 123.1101 54.2307 38.3810 176.3411 113 Q 4.2028 8.7341 118.8468 58.8911 29.0559 177.6248 114 K 4.0248 8.3061 114.8128 57.1208 32.9013 176.6208 115 Q 3.4417 8.0497 118.1335 55.9262 26.9453 172.5168 116 V 4.5124 7.8072 117.4266 60.0005 35.0178 174.1975 117 Q 4.3233 8.6790 123.0701 56.4154 29.3630 175.4870 118 I 4.2888 8.2723 124.3592 60.9812 40.1701 174.5765 119 M 4.7482 7.0289 117.6021 54.2622 34.8135 173.8823 120 G 4.2116 8.3422 103.4073 45.8901 0.0000 172.6229 121 F 5.0716 7.7407 117.5493 55.2941 41.6889 173.0925 122 L 4.5034 8.8022 122.9784 55.5481 42.0492 176.7719 123 V 4.5357 9.0132 118.0978 61.4400 34.0779 175.6585 124 Q 4.6287 7.8403 121.2068 54.3758 32.4519 173.3089 125 R 4.3416 8.1501 121.5283 52.9259 32.7626 173.6042 126 P 4.2205 0.0000 0.0000 62.7397 31.7564 177.6448 127 K 4.0749 8.4153 119.4963 59.3777 32.1534 178.3269 128 T 4.0995 7.7827 106.7608 62.4016 69.3094 174.6812 129 A 4.2259 7.7506 126.5125 52.8382 18.5971 177.3585 130 R 4.7057 8.8591 120.5517 55.9927 31.4512 175.5368 131 D 5.0118 8.4043 116.9884 52.7540 39.7288 175.4447 132 F 5.4227 7.8797 112.1732 54.8073 41.1188 173.3834 133 Q 4.4490 8.2791 119.5907 52.9229 31.5266 174.1900 134 P 4.3769 0.0000 0.0000 62.2890 32.2605 177.0145 135 A 3.9310 8.8415 123.6124 55.6316 18.1506 179.1144 136 N 4.6739 8.0318 109.0018 53.5290 37.8772 175.4652 137 K 4.4123 7.8367 117.8163 56.3814 32.8406 177.4056 138 R 3.5198 7.5809 121.1823 57.7313 30.0818 176.7599 139 S 5.1297 7.5206 110.2758 56.4411 65.7824 174.2492 140 V 3.9907 8.6214 115.0165 61.7372 32.1323 175.5766 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.05 4.24 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 0.92 0.00 0.00 0.97 0.00 0.00 4 W 9.17 4.66 0.00 3.49 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.57 4.18 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 6 P 0.00 4.54 0.00 2.23 2.19 0.00 3.78 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 1.96 1.96 0.00 7 V 7.44 4.06 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 0.78 0.00 0.00 0.91 0.00 0.00 8 N 8.64 4.20 0.00 2.88 2.91 0.00 0.00 6.52 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 9 N 7.57 4.89 0.00 2.66 2.69 0.00 0.00 7.31 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.38 4.13 0.00 1.94 1.56 0.00 0.61 0.00 0.00 0.65 0.00 0.00 2.59 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.28 1.26 7.81 11 M 8.36 4.90 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.66 0.00 12 F 8.18 4.60 0.00 3.14 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 13 E 8.34 3.47 0.00 2.13 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 2.20 2.13 0.00 14 T 8.36 3.85 4.18 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 0.11 0.00 0.00 15 F 9.03 4.53 0.00 3.30 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 16 S 8.25 4.48 0.00 4.14 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.28 4.40 0.00 3.02 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 18 L 7.58 4.68 0.00 1.85 1.61 0.86 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.42 0.00 2.03 2.00 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 2.03 2.14 0.00 20 P 0.00 4.30 0.00 2.06 2.04 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 21 L 8.35 3.98 0.00 1.59 1.49 0.31 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.20 4.24 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 1.18 0.00 0.00 23 D 8.55 4.34 0.00 2.70 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 24 E 8.07 3.93 0.00 2.02 1.91 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 2.35 2.39 0.00 25 Q 8.01 3.94 0.00 2.27 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 26 I 8.07 3.69 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.69 1.09 0.00 0.00 27 A 8.20 4.02 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 28 A 8.08 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.08 4.09 0.00 2.48 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.39 1.93 0.00 30 V 8.23 3.75 2.31 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 1.10 0.00 0.00 1.08 0.00 0.00 31 D 8.50 4.44 0.00 2.98 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 32 Y 8.06 4.14 0.00 3.23 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.97 3.91 2.18 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.07 1.10 0.00 0.00 34 V 7.90 3.53 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.96 0.00 0.00 35 A 8.11 3.92 1.21 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 0.00 0.00 36 N 7.16 4.06 0.00 1.44 1.42 0.00 0.00 7.03 7.62 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 37 G 7.28 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 38 W 7.52 4.97 0.00 3.39 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.90 4.50 2.13 0.00 0.00 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 1.53 0.99 0.77 0.00 0.00 40 P 0.00 4.93 0.00 2.13 2.20 0.00 3.92 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 41 C 8.93 5.01 0.00 3.13 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 42 L 8.74 5.35 0.00 1.86 1.63 0.88 0.84 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 43 E 9.25 5.61 0.00 2.03 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 0.00 2.36 2.32 0.00 44 F 9.13 5.66 0.00 3.06 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.37 4.49 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.63 4.26 0.00 2.17 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 2.29 2.27 0.00 47 A 8.88 4.28 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.13 4.53 0.00 2.70 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 49 K 7.95 4.59 0.00 1.49 1.66 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.41 7.81 50 A 7.62 3.85 0.54 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 0.00 0.00 51 Y 7.42 4.65 0.00 2.90 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.31 3.85 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 0.64 0.00 0.00 0.79 0.00 0.00 53 S 8.79 4.75 0.00 4.08 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.56 5.17 0.00 2.74 2.84 0.00 0.00 6.57 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.24 3.96 0.00 2.15 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 0.00 2.39 2.38 0.00 56 S 8.80 4.02 0.00 4.04 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 57 A 7.64 2.58 1.15 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 58 I 6.95 3.57 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.85 0.00 0.00 59 R 7.58 4.27 0.00 1.90 2.01 0.00 3.20 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 60 F 7.14 5.08 0.00 3.01 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.22 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.43 4.60 0.00 3.86 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 63 V 7.22 4.46 1.85 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 0.66 0.00 0.00 0.47 0.00 0.00 64 S 8.22 4.49 0.00 4.10 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 0.00 65 C 8.12 4.05 0.00 2.96 2.95 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 0.00 0.00 0.00 66 L 8.45 3.61 0.00 1.77 1.76 0.94 0.99 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 67 Y 7.78 4.40 0.00 2.90 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 68 Y 7.23 4.86 0.00 2.80 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 69 D 8.89 4.50 0.00 2.78 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 70 N 8.88 4.42 0.00 3.05 3.23 0.00 0.00 6.98 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.96 3.95 0.00 1.51 1.68 0.00 3.07 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.70 4.39 0.00 3.06 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 W 8.69 5.05 0.00 3.08 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 74 T 8.02 4.38 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 0.93 0.00 0.00 75 M 8.52 4.64 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.77 0.00 76 W 9.52 4.78 0.00 3.69 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.56 3.44 0.00 1.69 0.80 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.69 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.80 0.21 7.81 78 L 8.25 4.92 0.00 1.60 1.57 1.00 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 79 P 0.00 4.36 0.00 0.66 1.82 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.13 0.00 80 M 8.59 4.30 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.54 0.00 81 F 7.37 4.49 0.00 3.10 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 82 G 9.12 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 7.87 4.27 0.00 3.07 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.66 4.54 0.00 1.80 1.87 0.00 3.21 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 85 D 7.78 4.83 0.00 2.72 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 86 P 0.00 4.32 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.30 4.15 0.00 2.08 2.24 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 88 Q 7.93 4.02 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 89 V 7.75 3.61 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.97 0.00 0.00 90 L 7.92 4.04 0.00 1.92 1.72 0.95 1.00 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 91 R 8.29 3.99 0.00 2.04 2.01 0.00 3.15 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 1.67 1.88 0.00 92 E 8.31 4.13 0.00 2.24 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 0.00 2.62 2.65 0.00 93 I 7.82 3.53 2.01 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 1.35 0.86 0.86 0.00 0.00 94 V 7.64 3.48 2.21 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 0.97 0.00 0.00 0.94 0.00 0.00 95 A 8.02 3.95 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.65 2.00 0.00 1.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 7.56 3.73 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 1.13 0.00 0.00 98 K 7.71 3.82 0.00 1.82 1.94 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.39 7.81 99 A 7.57 3.97 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 0.00 100 F 7.75 4.74 0.00 2.80 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 0.00 101 P 0.00 4.43 0.00 2.12 2.11 0.00 3.26 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.07 4.63 0.00 2.69 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 0.00 103 A 7.35 4.78 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 0.00 104 Y 8.58 4.20 0.00 2.56 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 0.00 105 V 8.98 5.21 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 0.84 0.00 0.00 0.89 0.00 0.00 106 R 9.49 4.98 0.00 1.79 1.87 0.00 2.31 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.33 0.00 107 L 8.17 4.78 0.00 1.49 0.71 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.72 4.80 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 0.41 0.00 0.00 0.56 0.00 0.00 109 A 8.04 4.89 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 0.00 110 F 9.02 5.23 0.00 3.00 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 0.00 111 D 8.85 5.36 0.00 2.34 2.43 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 0.00 112 N 9.17 4.74 0.00 2.93 3.05 0.00 0.00 6.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 8.73 4.20 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.31 4.02 0.00 1.75 1.87 0.00 2.12 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 Q 8.05 3.44 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 116 V 7.81 4.51 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 0.48 0.00 0.00 0.91 0.00 0.00 117 Q 8.68 4.32 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.87 0.00 0.00 0.00 0.00 0.00 2.15 1.94 0.00 118 I 8.27 4.29 1.24 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.61 -0.68 0.00 0.00 119 M 7.03 4.75 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.62 0.00 120 G 8.34 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 0.00 0.00 0.00 0.00 121 F 7.74 5.07 0.00 3.23 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.80 4.50 0.00 1.58 1.61 0.58 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.01 4.54 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 0.76 0.00 0.00 0.92 0.00 0.00 124 Q 7.84 4.63 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.15 4.34 0.00 1.15 1.51 0.00 2.21 0.00 0.00 2.79 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.28 0.00 126 P 0.00 4.22 0.00 2.11 2.20 0.00 2.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 127 K 8.42 4.07 0.00 1.75 1.91 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.39 7.81 128 T 7.78 4.10 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 1.22 0.00 0.00 129 A 7.75 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.86 4.71 0.00 1.82 1.92 0.00 3.20 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.83 0.00 131 D 8.40 5.01 0.00 2.91 2.96 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 0.00 132 F 7.88 5.42 0.00 3.20 3.08 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 0.00 0.00 0.00 133 Q 8.28 4.45 0.00 1.84 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.04 0.00 0.00 0.00 0.00 0.00 2.28 2.02 0.00 134 P 0.00 4.38 0.00 2.34 2.11 0.00 3.54 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.84 0.00 135 A 8.84 3.93 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 0.00 136 N 8.03 4.67 0.00 2.82 2.93 0.00 0.00 5.87 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.84 4.41 0.00 1.59 1.70 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.28 7.81 138 R 7.58 3.52 0.00 1.42 0.66 0.00 3.01 0.00 0.00 3.04 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.49 0.00 139 S 7.52 5.13 0.00 4.07 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.62 3.99 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 0.61 0.00 0.00 0.96 0.00 0.00