NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3419 0.0000 0.0000 62.7791 32.6732 174.9200 2 V 3.5948 7.8990 116.4819 61.8161 32.4687 175.6526 3 D 4.2267 8.7534 112.7829 54.2979 38.0398 173.8288 4 F 4.0126 8.5317 129.6458 60.7342 39.2982 174.5362 5 N 4.4166 7.2028 117.5100 53.5998 38.6141 173.1411 6 G 4.2928 7.8029 113.7781 45.8091 0.0000 169.1645 7 Y 4.6310 8.9588 117.9167 56.2257 41.4941 174.6257 8 W 5.1856 8.6567 125.0644 54.8165 31.5973 175.4325 9 K 4.4371 8.6643 126.5444 55.6620 33.6741 175.2782 10 M 4.7723 8.4765 125.4167 55.2519 32.4059 175.0151 11 L 4.4529 8.8859 125.5481 56.7590 43.5905 175.7873 12 S 4.9010 7.4467 111.6713 57.7218 66.5578 172.4163 13 N 4.4461 7.6004 116.9325 54.0852 41.9449 174.1347 14 E 4.5970 8.3731 126.6038 55.0188 32.7735 176.2359 15 N 4.0425 8.6738 116.6887 53.9348 36.3908 176.6530 16 F 4.3663 7.9242 123.3731 61.3033 39.4155 176.0822 17 E 3.9969 8.2256 118.0981 59.1862 29.4154 178.6968 18 E 4.0979 8.1518 117.9271 59.0002 29.4945 178.4265 19 Y 4.1575 7.6668 119.9852 60.4710 38.8319 177.6346 20 L 3.7564 7.4140 118.6142 57.1227 41.6571 179.2510 21 R 3.8747 7.6781 118.3966 59.1352 29.7798 178.3723 22 A 4.0305 8.2170 120.4056 54.4383 18.4457 178.5822 23 L 4.2350 7.2314 114.7881 53.6449 42.1225 176.2436 24 D 4.3201 7.5156 117.4122 55.2597 38.9690 174.3397 25 V 4.0056 7.4712 111.7747 60.3608 32.8699 176.5353 26 N 4.6470 8.2957 117.5228 53.3698 40.2212 176.8868 27 V 3.6525 8.2362 115.3799 64.4967 31.4905 178.8405 28 A 4.0471 7.9601 120.0943 54.6175 18.2512 179.3733 29 L 4.0176 7.8304 118.8681 58.4409 42.3996 178.9287 30 R 4.1284 7.7684 117.9466 58.4661 29.7170 178.4441 31 K 4.0280 7.4359 119.3492 59.6136 32.5899 178.5453 32 I 3.8164 7.4428 119.5593 64.1830 36.9386 178.0923 33 A 3.7992 8.0351 120.8074 55.0804 18.4846 179.0683 34 N 4.5509 7.8866 114.3031 56.8886 39.0010 177.1269 35 L 4.0637 7.1089 116.5558 58.0323 40.5447 177.3582 36 L 4.3948 7.0504 117.2939 53.8594 42.7908 176.7974 37 K 4.1988 7.9914 119.9798 54.9443 34.5851 174.1622 38 P 4.4407 0.0000 0.0000 62.0301 32.6465 175.2250 39 D 4.5723 8.4031 121.5770 52.2694 41.1463 175.8192 40 K 4.5028 7.9679 123.9361 55.9609 34.3045 175.1734 41 E 4.5254 8.8338 124.7797 55.0639 33.2402 173.7178 42 I 4.4438 7.6053 127.9084 59.6166 39.9925 174.9097 43 V 4.4606 8.3232 124.5448 61.3429 35.2502 174.2592 44 Q 4.8279 8.4172 128.2169 55.3930 30.9619 173.6806 45 D 4.5397 8.7919 127.8616 55.6906 40.7505 176.4091 46 G 3.7551 7.7250 113.3324 45.1588 0.0000 172.7333 47 D 4.8713 8.5319 116.8472 53.8616 43.3216 175.7972 48 H 4.9877 7.8554 118.7203 54.5641 32.9205 171.7778 49 M 4.8246 8.8936 125.3980 53.6687 35.4285 174.0208 50 I 4.4715 8.6855 126.7273 59.5619 40.3380 174.5989 51 I 4.3463 8.1456 128.9671 60.0410 38.4720 174.8481 52 R 4.8583 8.5305 127.2667 54.6039 32.2376 175.7473 53 T 4.8564 8.0628 119.7884 61.7645 71.8341 174.1558 54 L 4.7912 8.5534 125.2913 52.6286 42.7542 175.6519 55 S 4.8520 8.2708 117.6786 56.0670 65.7771 175.9643 56 T 3.5591 8.5974 112.3959 63.5925 68.8940 173.9682 57 F 4.2770 7.6731 124.8001 57.2675 38.9496 175.4710 58 R 3.1491 8.2023 122.0135 56.3221 27.2292 173.7091 59 N 4.1182 8.3370 120.2325 53.7509 37.2742 175.1091 60 Y 4.3227 8.6934 126.3521 55.7984 37.8876 172.4853 61 I 4.7391 7.7302 121.9092 59.3289 39.7867 174.8234 62 M 5.0101 8.8955 125.3555 53.4294 36.1365 174.1097 63 D 5.1504 8.4211 119.5740 51.9195 43.0259 174.3994 64 F 4.8908 9.3871 117.7230 56.4729 44.4584 173.4608 65 Q 4.8103 8.3798 117.9104 54.2167 31.5441 175.6468 66 V 3.6012 8.3782 125.4874 63.7057 32.0868 177.3070 67 G 4.0766 8.7866 115.2078 45.2820 0.0000 173.0216 68 K 4.5003 7.2879 119.8187 53.8896 33.9248 174.9081 69 E 3.9898 8.7350 126.4959 56.8525 30.1217 175.7524 70 F 4.9441 9.5297 127.5111 56.3336 43.0439 173.1768 71 E 5.0136 7.6261 123.2698 54.5543 32.6576 174.5734 72 E 4.8915 8.5523 121.1926 54.9289 34.6113 174.0321 73 D 5.0571 9.1119 122.4246 52.5720 44.1958 175.1743 74 L 4.9802 8.3331 123.6045 53.1012 45.0340 177.1869 75 T 4.6169 8.7125 109.9462 60.9815 70.0524 174.3009 76 G 4.0231 8.1699 109.7596 45.0004 0.0000 173.1107 77 I 4.3932 7.5831 113.6775 60.6257 39.4082 175.6175 78 D 4.5883 9.7554 125.4009 58.2816 38.5200 176.4877 79 D 4.9623 7.1165 120.0819 55.2883 36.2861 174.6938 80 R 4.8479 7.7520 124.1952 55.0957 35.3872 173.5964 81 K 5.1660 8.8996 119.4971 53.9943 35.2472 175.2142 82 C 4.9988 8.5292 117.3129 57.0899 34.2225 172.2690 83 M 4.5550 8.7736 118.8868 54.0632 33.9226 175.3397 84 T 5.2372 8.8211 120.6932 61.0679 72.1874 173.4820 85 T 4.4157 8.2340 121.0114 61.8244 72.3711 172.9401 86 V 4.6648 8.0614 119.4978 59.0758 33.6908 175.0388 87 S 5.1134 8.4775 119.1049 56.4461 67.0196 171.8356 88 W 4.9329 8.8132 117.8074 54.8998 29.0436 175.2503 89 D 4.3828 9.2065 124.8841 56.6045 42.3749 175.7371 90 G 4.2035 7.5168 106.4866 45.7579 0.0000 174.0359 91 D 5.0240 9.0161 121.7959 53.1037 40.6021 174.3134 92 K 4.9421 7.6406 117.1567 55.8504 36.6189 176.3793 93 L 5.1741 8.6554 120.0634 53.8473 45.9015 175.7508 94 Q 5.0381 8.5377 121.1680 54.6683 34.0231 173.3436 95 C 5.1592 8.8807 114.9734 55.5835 33.1638 173.2388 96 V 4.2229 8.2254 123.2694 59.9356 32.2328 174.5121 97 Q 4.4710 8.1970 126.4330 55.0201 26.9848 174.6611 98 K 4.0903 9.6763 121.2411 56.7007 32.2206 175.7626 99 G 4.0998 7.8431 116.2638 45.1807 0.0000 170.0006 100 E 4.1012 8.5310 121.0899 56.7479 30.3989 176.5851 101 K 4.2163 8.4490 116.5280 57.0031 31.0321 176.0007 102 E 4.3482 8.6921 118.7457 57.7476 30.3375 177.1622 103 G 4.0829 7.7432 107.2702 42.8204 0.0000 169.2727 104 R 4.7599 9.2556 122.2998 53.5143 32.4969 174.2211 105 G 4.2604 7.9779 112.0838 43.7574 0.0000 171.3955 106 W 5.2791 7.7083 120.3771 55.0807 33.2030 174.8980 107 T 4.8625 8.8107 117.2268 62.0657 71.7261 173.2030 108 Q 5.1104 8.5000 126.3667 54.0105 32.5344 174.0421 109 W 4.4610 7.9669 131.2173 57.3478 34.0371 172.6870 110 I 4.3443 8.0041 124.2057 58.6735 39.2102 176.1872 111 E 4.3282 8.5286 128.7260 54.7579 29.9432 176.7359 112 G 3.7407 8.0780 111.6246 45.9489 0.0000 172.4138 113 D 4.7810 8.7779 119.9001 52.5809 41.2495 176.2524 114 E 4.9769 7.6163 116.8513 54.8522 33.1466 174.6566 115 L 4.4575 7.9071 121.9886 54.3754 43.1258 176.0648 116 H 4.9937 8.0013 116.4966 54.1268 28.2374 172.8323 117 L 4.7228 7.3227 122.5734 54.3974 44.7507 175.5175 118 E 4.8779 8.9007 122.1357 54.8632 34.0913 174.4432 119 M 5.1566 9.3992 123.2544 53.7044 35.1695 174.9958 120 R 5.2714 8.4859 121.0254 53.9063 33.7015 176.0506 121 A 4.3151 8.6887 117.5718 53.0606 21.2816 176.2359 122 E 3.8221 9.4590 120.9328 57.7057 28.1069 174.7462 123 G 4.1119 8.4552 103.7919 45.2070 0.0000 174.6204 124 V 4.2703 7.4704 114.2781 59.5300 32.7493 174.3924 125 T 4.5655 8.4028 121.7833 63.3415 68.8588 173.5706 126 C 4.8752 9.3016 127.9477 57.6138 34.5090 172.6291 127 K 4.9451 8.3301 121.5569 54.8034 36.4929 175.6139 128 Q 4.4322 7.9964 119.7911 54.3045 32.0305 174.6932 129 V 3.8773 8.0146 124.8473 61.1491 32.7518 175.1320 130 F 5.4449 8.1037 125.5532 55.9216 42.7988 174.4060 131 K 4.6364 9.1621 121.0992 54.1825 34.5783 174.8786 132 K 4.3821 8.6483 130.1724 56.8420 32.5275 177.8596 133 V 4.4271 8.3496 126.3786 60.8766 30.5120 176.0579 134 H 4.2724 8.1678 124.2426 56.5408 29.7732 174.4160 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 P 0.00 4.34 0.00 2.05 2.06 0.00 3.86 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 2 V 7.90 3.59 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 0.68 0.00 0.00 0.83 0.00 0.00 3 D 8.75 4.23 0.00 2.97 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 4 F 8.53 4.01 0.00 3.10 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 N 7.20 4.42 0.00 2.71 2.86 0.00 0.00 7.04 8.05 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 6 G 7.80 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 0.00 0.00 0.00 0.00 7 Y 8.96 4.63 0.00 2.92 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 8 W 8.66 5.19 0.00 3.03 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 9 K 8.66 4.44 0.00 1.86 1.73 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.45 7.81 10 M 8.48 4.77 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.76 0.00 11 L 8.89 4.45 0.00 1.84 1.68 0.91 0.96 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 12 S 7.45 4.90 0.00 3.69 3.73 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 13 N 7.60 4.45 0.00 2.52 2.62 0.00 0.00 6.55 6.41 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 14 E 8.37 4.60 0.00 2.15 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 15 N 8.67 4.04 0.00 2.94 3.01 0.00 0.00 6.66 8.17 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 16 F 7.92 4.37 0.00 3.12 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 17 E 8.23 4.00 0.00 2.13 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 0.00 2.42 2.46 0.00 18 E 8.15 4.10 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 19 Y 7.67 4.16 0.00 3.05 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 20 L 7.41 3.76 0.00 1.75 1.56 0.71 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 21 R 7.68 3.87 0.00 1.92 1.97 0.00 3.08 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 22 A 8.22 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 23 L 7.23 4.24 0.00 1.31 1.57 -0.05 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 24 D 7.52 4.32 0.00 2.71 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 25 V 7.47 4.01 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 0.75 0.00 0.00 0.97 0.00 0.00 26 N 8.30 4.65 0.00 2.83 2.75 0.00 0.00 6.87 7.69 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 27 V 8.24 3.65 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 0.81 0.00 0.00 0.94 0.00 0.00 28 A 7.96 4.05 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 L 7.83 4.02 0.00 1.86 1.90 1.19 1.00 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 30 R 7.77 4.13 0.00 1.87 2.03 0.00 3.12 0.00 0.00 3.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 31 K 7.44 4.03 0.00 2.01 1.81 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.62 7.81 32 I 7.44 3.82 1.64 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 1.49 1.09 0.54 0.00 0.00 33 A 8.04 3.80 1.43 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 0.00 0.00 34 N 7.89 4.55 0.00 3.06 2.97 0.00 0.00 6.91 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.11 4.06 0.00 1.84 1.80 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.05 4.39 0.00 1.79 1.58 0.61 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 37 K 7.99 4.20 0.00 1.63 1.60 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.39 7.81 38 P 0.00 4.44 0.00 2.09 2.04 0.00 3.57 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 39 D 8.40 4.57 0.00 2.76 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 40 K 7.97 4.50 0.00 1.47 1.41 0.00 1.52 0.00 0.00 1.44 0.00 0.00 2.45 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.15 1.16 7.81 41 E 8.83 4.53 0.00 1.68 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 1.47 1.47 0.00 42 I 7.61 4.44 1.60 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 0.67 0.18 0.76 0.00 0.00 43 V 8.32 4.46 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 0.88 0.00 0.00 0.79 0.00 0.00 44 Q 8.42 4.83 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 45 D 8.79 4.54 0.00 2.81 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 46 G 7.72 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 47 D 8.53 4.87 0.00 2.70 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 48 H 7.86 4.99 0.00 3.20 3.29 0.00 5.52 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 M 8.89 4.82 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 50 I 8.69 4.47 1.76 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 1.24 0.47 0.88 0.00 0.00 51 I 8.15 4.35 1.58 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.63 0.79 0.00 0.00 52 R 8.53 4.86 0.00 1.59 1.67 0.00 2.97 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 53 T 8.06 4.86 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 54 L 8.55 4.79 0.00 1.46 1.57 0.82 0.55 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 55 S 8.27 4.85 0.00 4.10 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 56 T 8.60 3.56 4.30 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 1.24 0.00 0.00 57 F 7.67 4.28 0.00 2.92 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 58 R 8.20 3.15 0.00 1.16 1.26 0.00 3.20 0.00 0.00 3.11 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.46 0.00 59 N 8.34 4.12 0.00 2.72 2.85 0.00 0.00 6.11 7.51 0.00 0.00 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 Y 8.69 4.32 0.00 3.16 2.83 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 61 I 7.73 4.74 1.85 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 1.32 0.99 0.87 0.00 0.00 62 M 8.90 5.01 0.00 1.70 1.35 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.65 0.00 63 D 8.42 5.15 0.00 2.73 2.62 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 64 F 9.39 4.89 0.00 2.82 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.38 4.81 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 7.08 0.00 0.00 0.00 0.00 0.00 2.60 2.52 0.00 66 V 8.38 3.60 2.07 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 1.02 0.00 0.00 0.90 0.00 0.00 67 G 8.79 4.08 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 0.00 0.00 0.00 68 K 7.29 4.50 0.00 1.78 1.75 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.51 7.81 69 E 8.74 3.99 0.00 2.03 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 2.32 2.36 0.00 70 F 9.53 4.94 0.00 2.97 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 71 E 7.63 5.01 0.00 1.84 1.54 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 2.10 2.25 0.00 72 E 8.55 4.89 0.00 2.11 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 2.64 2.81 0.00 73 D 9.11 5.06 0.00 2.49 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 74 L 8.33 4.98 0.00 1.71 1.65 1.15 0.37 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 75 T 8.71 4.62 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 1.19 0.00 0.00 76 G 8.17 4.02 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 0.00 0.00 0.00 77 I 7.58 4.39 2.07 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 1.57 1.31 1.18 0.00 0.00 78 D 9.76 4.59 0.00 2.85 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 79 D 7.12 4.96 0.00 2.85 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 80 R 7.75 4.85 0.00 1.81 1.83 0.00 3.24 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 81 K 8.90 5.17 0.00 1.60 1.79 0.00 1.74 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.24 7.81 82 C 8.53 5.00 0.00 2.93 2.99 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 83 M 8.77 4.55 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 84 T 8.82 5.24 4.33 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 0.89 0.00 0.00 85 T 8.23 4.42 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 1.19 0.00 0.00 86 V 8.06 4.66 1.75 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 -0.11 0.00 0.00 0.71 0.00 0.00 87 S 8.48 5.11 0.00 3.85 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 88 W 8.81 4.93 0.00 3.71 3.07 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 89 D 9.21 4.38 0.00 2.65 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 90 G 7.52 4.20 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 91 D 9.02 5.02 0.00 2.64 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 92 K 7.64 4.94 0.00 1.81 2.15 0.00 2.15 0.00 0.00 2.05 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.57 7.81 93 L 8.66 5.17 0.00 1.78 1.53 0.51 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 94 Q 8.54 5.04 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 95 C 8.88 5.16 0.00 2.74 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 96 V 8.23 4.22 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 0.76 0.00 0.00 0.91 0.00 0.00 97 Q 8.20 4.47 0.00 1.86 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 5.84 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 98 K 9.68 4.09 0.00 1.82 1.78 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.53 7.81 99 G 7.84 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 0.00 100 E 8.53 4.10 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 101 K 8.45 4.22 0.00 1.95 1.91 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.41 7.81 102 E 8.69 4.35 0.00 1.96 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 2.27 2.24 0.00 103 G 7.74 4.08 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 0.00 0.00 0.00 104 R 9.26 4.76 0.00 1.77 1.81 0.00 3.31 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 105 G 7.98 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 0.00 0.00 0.00 0.00 106 W 7.71 5.28 0.00 3.47 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 0.00 107 T 8.81 4.86 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 1.26 0.00 0.00 108 Q 8.50 5.11 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 7.02 0.00 0.00 0.00 0.00 0.00 2.65 2.57 0.00 109 W 7.97 4.46 0.00 3.57 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 0.00 110 I 8.00 4.34 1.66 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.89 0.76 0.00 0.00 111 E 8.53 4.33 0.00 2.32 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 2.44 2.92 0.00 112 G 8.08 3.74 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 0.00 0.00 0.00 113 D 8.78 4.78 0.00 2.88 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 0.00 114 E 7.62 4.98 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 115 L 7.91 4.46 0.00 1.20 1.19 0.88 -0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.00 4.99 0.00 3.10 2.94 0.00 5.65 0.00 0.00 0.00 0.00 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 7.32 4.72 0.00 1.71 1.21 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.90 4.88 0.00 1.93 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 2.12 2.22 0.00 119 M 9.40 5.16 0.00 1.71 1.71 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.78 0.00 120 R 8.49 5.27 0.00 2.05 1.90 0.00 3.22 0.00 0.00 3.14 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 121 A 8.69 4.32 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 0.00 122 E 9.46 3.82 0.00 2.12 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 2.17 2.30 0.00 123 G 8.46 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 0.00 124 V 7.47 4.27 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 0.88 0.00 0.00 1.05 0.00 0.00 125 T 8.40 4.57 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 1.21 0.00 0.00 126 C 9.30 4.88 0.00 3.14 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 0.00 127 K 8.33 4.95 0.00 1.61 1.61 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.75 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.39 7.81 128 Q 8.00 4.43 0.00 1.64 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.61 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 129 V 8.01 3.88 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 1.24 0.00 0.00 0.69 0.00 0.00 130 F 8.10 5.44 0.00 2.81 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 0.00 131 K 9.16 4.64 0.00 1.80 1.68 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.41 7.81 132 K 8.65 4.38 0.00 1.72 1.80 0.00 2.08 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.75 2.02 7.81 133 V 8.35 4.43 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.10 0.00 0.00 134 H 8.17 4.27 0.00 3.23 3.22 0.00 5.78 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00