NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2304 8.4445 119.1061 54.1653 29.2403 174.8799 4 L 3.7867 7.5993 121.5924 53.3529 41.9842 176.8891 5 T 4.1037 8.2093 117.8736 61.0209 68.9190 174.3346 6 E 3.9420 8.8078 122.7461 59.6862 28.9680 178.6227 7 E 3.9567 8.3333 120.0984 58.9111 29.2738 177.6395 8 Q 4.4895 7.8452 116.2901 56.7523 29.3501 175.3941 9 I 4.3223 8.8039 119.0260 63.6823 39.3513 177.5649 10 A 4.1899 8.2535 121.5927 56.1603 18.0253 178.7080 11 E 4.2469 8.1949 115.9356 59.1091 29.2836 178.9332 12 F 4.2544 8.2920 117.4870 59.1496 40.1032 175.7363 13 K 4.7253 9.1284 117.6308 58.3509 34.1803 178.2639 14 E 4.1576 9.2342 116.5128 58.0618 29.5528 177.5399 15 A 4.6663 7.9075 120.9301 52.9516 21.3188 178.2774 16 F 3.9790 8.1904 116.8143 60.9945 39.4537 176.5358 17 S 4.1086 8.9804 117.3830 61.3298 63.1577 176.4722 18 L 4.1137 7.5729 120.2485 57.7769 42.1591 177.5365 19 F 4.4884 7.7186 115.7349 57.2724 39.2058 176.1632 20 D 4.4564 8.6869 123.0530 51.4910 38.9613 175.3922 21 K 3.5251 7.4962 121.9358 59.9256 33.4614 177.3676 22 D 4.5843 8.2668 117.9480 58.9804 37.8060 179.0757 23 G 3.9279 6.8188 105.1303 47.7277 0.0000 174.7321 24 D 4.3265 9.8209 119.0590 52.8343 39.5172 176.8278 25 G 5.0724 8.1204 122.2873 45.0959 0.0000 171.7358 26 T 5.0070 7.7143 108.8276 59.4551 71.9395 173.0073 27 I 4.6621 8.3090 116.2747 59.2909 40.4601 176.9733 28 T 4.1606 9.8671 115.2685 62.4356 69.1875 173.5201 29 T 4.1222 8.8312 115.4703 66.1678 68.6252 176.3707 30 K 3.8094 8.0271 119.8118 60.1071 32.1896 179.0365 31 E 3.9381 8.1158 118.3012 59.1107 29.3036 179.1302 32 L 3.9327 8.2552 120.7639 58.1572 42.3564 178.9494 33 G 3.9534 8.1718 105.2579 48.5572 0.0000 175.4846 34 T 3.8517 8.0094 118.1696 66.1181 68.4082 177.0810 35 V 2.8462 7.6345 120.3399 66.0052 31.3802 178.0564 36 M 3.9511 8.0957 118.2336 58.5248 31.8374 178.4087 37 R 4.6563 7.8725 119.0827 58.9525 30.0965 178.7673 38 S 4.0253 7.4780 112.4415 61.8396 62.7399 176.3183 39 L 4.1304 7.0126 117.6015 54.8423 41.0134 177.7974 40 G 3.8537 8.5892 107.6109 45.5345 0.0000 173.1842 41 Q 4.6826 7.5888 119.6143 55.0038 31.8036 173.9424 42 N 4.6284 7.9856 114.7875 52.5177 37.8291 172.4565 43 P 4.5872 0.0000 0.0000 61.8914 33.0859 175.9675 44 T 4.3067 8.0427 108.2065 60.6471 69.7516 175.4309 45 E 3.9207 8.7630 122.1465 58.9366 29.5031 178.0956 46 A 4.6202 7.8277 119.1535 52.2269 21.4493 177.2572 47 E 4.1272 8.3681 115.8743 57.9401 29.4619 178.1530 48 L 3.9500 7.6075 118.9924 58.9222 41.7168 177.4222 49 Q 4.1949 8.5187 118.8789 56.9795 28.4025 178.8641 50 D 4.7107 7.1700 122.5952 57.1826 42.4049 179.2640 51 M 4.1881 7.7004 117.0139 58.3448 32.0367 178.6490 52 I 3.8442 7.5862 118.0006 64.0334 38.3106 177.0003 53 N 4.3453 9.2356 116.3079 55.9458 38.7686 175.5612 54 E 4.3111 7.6542 117.3461 57.5775 31.0763 177.0333 55 V 4.2966 7.6458 112.5551 60.3290 31.3044 177.1858 56 D 4.5372 7.7954 119.1392 54.3150 40.5989 177.0360 57 A 4.7112 8.4063 124.0427 52.3652 21.3588 175.6617 58 D 5.2340 7.8304 119.1646 54.4585 42.4169 178.5090 59 G 3.9128 8.6915 109.2602 47.8014 0.0000 173.1183 60 N 4.1259 9.3845 114.8457 52.7038 37.4572 172.7794 61 G 3.9799 6.9121 111.7812 45.7553 0.0000 170.6366 62 T 4.7380 7.3751 113.9297 59.9469 70.8476 172.6420 63 I 4.7050 8.1836 127.4683 59.1722 41.2680 175.1490 64 D 4.8436 8.5861 128.4953 52.8929 41.6698 176.9340 65 F 3.3024 9.2079 116.1035 60.5507 38.7566 175.3931 66 P 4.2242 0.0000 0.0000 65.8555 30.6280 178.3188 67 E 3.8560 10.6416 117.4185 59.4386 29.2411 178.9417 68 F 4.4206 7.3890 118.3501 60.1742 39.9393 177.0234 69 L 3.7978 8.5552 120.5862 58.3849 42.0457 179.0091 70 T 4.0212 8.0773 116.0819 66.2601 68.8655 176.2940 71 M 3.9969 7.6495 118.8200 57.9241 32.0878 176.9818 72 M 4.1971 7.4866 116.8392 56.0952 31.7094 176.4242 73 A 4.6867 7.5518 118.7655 51.7238 20.3176 178.1981 74 R 4.1164 7.8552 115.4864 58.5145 30.2565 177.4597 75 K 4.6782 7.6854 117.4710 56.2256 33.1980 175.9938 76 M 4.5355 8.0138 115.7591 56.4983 34.4439 176.7500 77 K 3.9733 8.1078 116.9438 58.0170 32.0661 175.4957 78 D 4.4043 6.9967 116.2058 54.7677 42.4591 175.3993 79 T 3.8137 8.0047 115.2896 63.2130 67.8273 173.0806 80 D 5.0086 8.5198 127.6053 53.5823 42.5457 177.7523 81 S 4.2733 7.9219 118.7201 61.3834 62.6357 175.8426 82 E 3.8871 8.0880 122.0634 59.3051 29.7781 178.6215 83 E 4.1599 8.1965 117.9646 59.3854 29.7280 178.5742 84 E 4.0140 8.3392 118.2216 59.9820 29.4559 179.6347 85 I 4.1123 7.7689 118.7101 63.9705 36.9922 177.7109 86 R 4.5865 8.4329 118.4942 57.5346 29.9099 177.3654 87 E 4.3366 8.0707 116.1446 58.4022 30.5392 177.6274 88 A 4.3492 8.7580 121.6828 55.0336 18.4852 179.2321 89 F 3.3383 8.4414 119.3013 61.5826 39.3293 177.5891 90 R 3.9548 7.8122 116.0684 58.9819 29.8271 179.0577 91 V 3.6536 7.4250 117.5871 65.9042 31.6968 177.5580 92 F 4.0685 8.2871 116.0962 59.9793 40.3961 176.1561 93 D 4.5288 7.3666 118.6357 54.3168 37.0466 176.9219 94 K 4.1647 7.9780 118.2519 57.7524 32.6071 177.5534 95 D 4.7442 7.8835 116.7234 52.1064 40.5311 176.4621 96 G 3.8406 8.3143 107.8356 46.5114 0.0000 173.5423 97 N 4.7610 8.0236 112.5473 51.5921 37.3989 176.8958 98 G 3.9763 8.0887 105.0208 46.7573 0.0000 173.3859 99 Y 5.1107 7.9006 116.0616 56.2168 41.4125 175.0350 100 I 4.7586 9.0574 122.7590 59.6138 39.8985 174.9988 101 S 5.0334 8.7125 119.9557 55.9118 65.8618 174.8726 102 A 3.6420 8.9980 123.0253 56.0718 17.7616 179.4032 103 A 3.9799 8.1242 119.0136 55.5363 18.3772 179.4139 104 E 3.9728 8.2364 113.9300 59.4502 29.7698 178.4274 105 L 4.2452 8.8866 122.6656 57.7937 41.8643 178.4314 106 R 3.9186 8.2833 119.8363 60.5419 30.3797 177.6400 107 H 4.1877 8.6480 118.0945 59.4203 29.4183 177.2664 108 V 3.3976 8.4639 120.3472 66.0718 31.5047 178.3164 109 M 4.2283 8.7589 119.0247 57.8887 30.9652 178.4589 110 T 4.6428 7.7567 111.3074 63.5620 69.4075 176.7082 111 N 4.7835 8.0874 117.6921 55.8023 38.6538 175.4179 112 L 4.2855 7.4727 114.9666 54.5259 41.5175 177.2016 113 G 3.8503 9.4334 106.5909 45.8348 0.0000 173.0959 114 E 4.4992 8.0187 120.0867 53.8731 31.2605 175.2671 115 K 4.4137 8.5107 125.3936 55.0545 32.1171 175.4666 116 L 4.7235 8.1144 123.7713 52.7712 44.0473 176.5545 117 T 4.1721 8.3454 117.3546 61.4229 67.8303 174.9217 118 D 4.3841 8.8410 127.5540 57.6441 40.6020 179.0820 119 E 4.0306 8.3231 119.0509 59.3504 29.4701 178.2852 120 E 4.3643 8.0198 114.7178 57.0137 29.7915 177.9273 121 V 4.1384 7.4260 119.0062 64.9687 32.2364 177.1068 122 D 4.5017 7.6992 116.5683 56.4701 40.1954 178.1775 123 Q 4.1169 7.7671 119.6179 59.3853 29.1035 176.8133 124 M 4.2739 8.5175 120.4894 57.1236 31.7824 178.9634 125 I 3.5906 7.2278 121.1321 64.8037 37.9959 177.2702 126 R 3.8951 7.7589 118.2805 60.0811 29.6072 177.8370 127 E 4.0061 8.0218 118.3297 58.7034 29.7830 178.3345 128 A 4.2840 7.7099 119.4945 52.8419 19.2789 176.9091 129 D 4.7373 7.8757 117.9881 53.9978 41.9618 175.8391 130 I 4.2755 8.8260 126.9584 61.9991 38.9805 176.2000 131 D 4.6388 8.2580 117.6562 52.4636 39.7590 178.0948 132 G 3.8879 7.9090 108.1974 46.2102 0.0000 175.1792 133 D 4.4403 7.7655 116.9856 53.3339 38.7629 177.4419 134 G 4.1228 8.4369 105.9898 46.4910 0.0000 173.6813 135 Q 4.6916 7.7326 114.2393 54.5455 32.1818 174.4559 136 V 4.6572 8.5077 114.5508 60.3095 33.5662 175.5025 137 N 5.0170 9.0090 123.0186 51.5124 39.8629 175.2134 138 Y 3.0520 8.2421 118.9898 61.4940 38.4615 177.7371 139 E 3.6518 8.0909 117.3183 60.2336 29.5397 179.2887 140 E 3.9665 9.5040 117.7305 59.3647 29.7139 179.1514 141 F 4.1721 8.5993 121.9775 61.3764 39.4084 177.1227 142 V 3.3596 8.3066 118.9237 66.0255 31.0617 178.0241 143 Q 3.8217 7.8263 117.6262 59.0158 28.4169 177.8473 144 M 3.8732 7.8440 118.2087 59.8850 32.2624 177.2926 145 M 3.8388 7.6760 117.0989 58.1264 32.1959 177.7015 146 T 3.9855 7.6999 111.9775 63.7620 69.4120 174.6102 147 A 3.8180 7.2916 124.3011 52.0000 18.7534 177.3109 148 K 4.1122 8.5737 122.9271 56.5801 32.2897 176.0873 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 Q 8.44 4.23 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 4 L 7.60 3.79 0.00 1.74 1.51 0.92 0.62 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 5 T 8.21 4.10 4.23 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 1.23 0.00 0.00 6 E 8.81 3.94 0.00 2.24 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 0.00 2.37 2.38 0.00 7 E 8.33 3.96 0.00 2.08 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 2.44 2.43 0.00 8 Q 7.85 4.49 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.51 0.00 0.00 0.00 0.00 0.00 1.94 2.39 0.00 9 I 8.80 4.32 1.99 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.06 0.96 0.00 0.00 10 A 8.25 4.19 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 11 E 8.19 4.25 0.00 2.29 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 12 F 8.29 4.25 0.00 3.38 3.44 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 13 K 9.13 4.73 0.00 2.13 1.96 0.00 1.84 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.72 7.81 14 E 9.23 4.16 0.00 2.11 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 0.00 2.42 2.48 0.00 15 A 7.91 4.67 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 16 F 8.19 3.98 0.00 2.83 3.27 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 17 S 8.98 4.11 0.00 3.96 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 18 L 7.57 4.11 0.00 1.91 2.13 1.03 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.72 4.49 0.00 2.86 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 20 D 8.69 4.46 0.00 2.37 2.44 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 21 K 7.50 3.53 0.00 1.60 1.66 0.00 1.83 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.49 7.81 22 D 8.27 4.58 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 23 G 6.82 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 0.00 0.00 0.00 24 D 9.82 4.33 0.00 2.81 2.66 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 0.00 0.00 0.00 0.00 25 G 8.12 5.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.71 5.01 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 1.22 0.00 0.00 27 I 8.31 4.66 1.68 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.97 -0.13 0.00 0.00 28 T 9.87 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 1.22 0.00 0.00 29 T 8.83 4.12 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 1.22 0.00 0.00 30 K 8.03 3.81 0.00 1.83 1.89 0.00 1.55 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.62 7.81 31 E 8.12 3.94 0.00 2.10 1.88 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 2.42 2.28 0.00 32 L 8.26 3.93 0.00 1.78 1.83 1.14 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.17 3.95 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 0.00 0.00 0.00 34 T 8.01 3.85 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 1.31 0.00 0.00 35 V 7.63 2.85 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 0.82 0.00 0.00 0.69 0.00 0.00 36 M 8.10 3.95 0.00 2.11 2.21 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 2.88 2.77 0.00 37 R 7.87 4.66 0.00 1.78 1.95 0.00 3.14 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 38 S 7.48 4.03 0.00 3.88 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 39 L 7.01 4.13 0.00 1.71 1.55 0.24 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.59 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 41 Q 7.59 4.68 0.00 2.21 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.92 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 42 N 7.99 4.63 0.00 2.79 2.80 0.00 0.00 5.95 7.75 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 43 P 0.00 4.59 0.00 2.21 2.12 0.00 3.75 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 1.99 1.97 0.00 44 T 8.04 4.31 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 1.21 0.00 0.00 45 E 8.76 3.92 0.00 1.97 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 2.32 2.34 0.00 46 A 7.83 4.62 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 47 E 8.37 4.13 0.00 2.04 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 2.31 2.31 0.00 48 L 7.61 3.95 0.00 1.89 1.70 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.52 4.19 0.00 2.34 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.19 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 50 D 7.17 4.71 0.00 2.68 2.67 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 51 M 7.70 4.19 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.55 0.00 52 I 7.59 3.84 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 1.03 0.00 0.00 53 N 9.24 4.35 0.00 2.74 2.93 0.00 0.00 7.28 7.53 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 54 E 7.65 4.31 0.00 2.37 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 2.38 0.00 55 V 7.65 4.30 2.37 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 0.72 0.00 0.00 1.12 0.00 0.00 56 D 7.80 4.54 0.00 2.68 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 57 A 8.41 4.71 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 58 D 7.83 5.23 0.00 2.79 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 59 G 8.69 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 0.00 0.00 0.00 60 N 9.38 4.13 0.00 2.58 2.78 0.00 0.00 6.98 7.86 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 61 G 6.91 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 T 7.38 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 1.23 0.00 0.00 63 I 8.18 4.70 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.42 1.08 0.00 0.00 64 D 8.59 4.84 0.00 3.08 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 65 F 9.21 3.30 0.00 2.93 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 66 P 0.00 4.22 0.00 2.39 2.09 0.00 4.03 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 67 E 10.64 3.86 0.00 2.20 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 2.38 2.92 0.00 68 F 7.39 4.42 0.00 2.92 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 69 L 8.56 3.80 0.00 1.65 1.71 0.78 1.05 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 70 T 8.08 4.02 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 1.17 0.00 0.00 71 M 7.65 4.00 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 72 M 7.49 4.20 0.00 1.48 1.72 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 1.81 0.00 73 A 7.55 4.69 1.14 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 0.00 0.00 74 R 7.86 4.12 0.00 2.05 1.98 0.00 3.27 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 75 K 7.69 4.68 0.00 1.64 1.70 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.41 7.81 76 M 8.01 4.54 0.00 2.30 1.86 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 77 K 8.11 3.97 0.00 1.66 1.96 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.46 7.81 78 D 7.00 4.40 0.00 2.61 2.45 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 79 T 8.00 3.81 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 1.23 0.00 0.00 80 D 8.52 5.01 0.00 2.66 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 81 S 7.92 4.27 0.00 4.09 4.13 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 82 E 8.09 3.89 0.00 2.03 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 2.39 2.56 0.00 83 E 8.20 4.16 0.00 2.13 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 2.42 2.48 0.00 84 E 8.34 4.01 0.00 2.27 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 0.00 2.45 2.54 0.00 85 I 7.77 4.11 2.16 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 1.40 0.97 0.98 0.00 0.00 86 R 8.43 4.59 0.00 1.89 2.09 0.00 2.96 0.00 0.00 2.91 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.31 0.00 87 E 8.07 4.34 0.00 2.19 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 2.30 2.67 0.00 88 A 8.76 4.35 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.44 3.34 0.00 3.36 3.33 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 90 R 7.81 3.95 0.00 1.81 2.01 0.00 3.23 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.94 0.00 91 V 7.42 3.65 2.33 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 0.54 0.00 0.00 0.97 0.00 0.00 92 F 8.29 4.07 0.00 2.64 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 93 D 7.37 4.53 0.00 2.06 2.28 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 94 K 7.98 4.16 0.00 2.06 1.83 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.64 1.55 7.81 95 D 7.88 4.74 0.00 2.70 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 96 G 8.31 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 0.00 0.00 0.00 97 N 8.02 4.76 0.00 3.06 3.19 0.00 0.00 6.90 6.80 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 98 G 8.09 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 99 Y 7.90 5.11 0.00 2.90 2.90 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 0.00 100 I 9.06 4.76 1.99 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.26 0.91 0.00 0.00 101 S 8.71 5.03 0.00 3.91 3.95 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 0.00 102 A 9.00 3.64 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 0.00 103 A 8.12 3.98 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 0.00 104 E 8.24 3.97 0.00 2.48 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 2.47 2.37 0.00 105 L 8.89 4.25 0.00 1.83 1.86 1.13 0.13 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 0.00 106 R 8.28 3.92 0.00 1.90 2.30 0.00 3.35 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 107 H 8.65 4.19 0.00 3.34 3.41 0.00 5.84 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 0.00 108 V 8.46 3.40 1.65 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 0.50 0.00 0.00 0.82 0.00 0.00 109 M 8.76 4.23 0.00 2.07 2.38 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.97 0.00 110 T 7.76 4.64 4.23 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 1.31 0.00 0.00 111 N 8.09 4.78 0.00 2.60 2.86 0.00 0.00 6.90 7.85 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 0.00 112 L 7.47 4.29 0.00 1.65 1.67 0.85 0.86 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 0.00 113 G 9.43 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 0.00 114 E 8.02 4.50 0.00 2.09 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 2.24 2.31 0.00 115 K 8.51 4.41 0.00 1.78 1.77 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.38 7.81 116 L 8.11 4.72 0.00 1.63 1.58 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.35 4.17 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 1.25 0.00 0.00 118 D 8.84 4.38 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 0.00 119 E 8.32 4.03 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 2.33 2.50 0.00 120 E 8.02 4.36 0.00 1.95 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 2.35 2.32 0.00 121 V 7.43 4.14 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 1.18 0.00 0.00 0.97 0.00 0.00 122 D 7.70 4.50 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 7.77 4.12 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 124 M 8.52 4.27 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.60 0.00 125 I 7.23 3.59 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.75 0.97 0.00 0.00 126 R 7.76 3.90 0.00 2.15 1.90 0.00 3.11 0.00 0.00 3.10 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 127 E 8.02 4.01 0.00 2.05 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 2.32 2.34 0.00 128 A 7.71 4.28 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 0.00 129 D 7.88 4.74 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 0.00 130 I 8.83 4.28 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 1.36 0.76 0.91 0.00 0.00 131 D 8.26 4.64 0.00 2.81 2.90 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 0.00 132 G 7.91 3.89 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 0.00 0.00 0.00 133 D 7.77 4.44 0.00 2.90 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 0.00 134 G 8.44 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 0.00 0.00 0.00 135 Q 7.73 4.69 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 136 V 8.51 4.66 2.29 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 0.79 0.00 0.00 1.07 0.00 0.00 137 N 9.01 5.02 0.00 2.68 3.03 0.00 0.00 6.15 7.05 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 0.00 138 Y 8.24 3.05 0.00 2.06 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 0.00 139 E 8.09 3.65 0.00 2.31 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 2.38 2.38 0.00 140 E 9.50 3.97 0.00 2.33 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 2.68 2.58 0.00 141 F 8.60 4.17 0.00 3.26 3.15 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 0.00 142 V 8.31 3.36 1.82 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 0.78 0.00 0.00 -0.34 0.00 0.00 143 Q 7.83 3.82 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.48 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 144 M 7.84 3.87 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 145 M 7.68 3.84 0.00 1.82 1.60 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 146 T 7.70 3.99 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 1.16 0.00 0.00 147 A 7.29 3.82 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 0.00 148 K 8.57 4.11 0.00 1.70 1.67 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.40 7.81