NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9659 8.3549 109.7368 45.5031 0.0000 172.5446 2 L 4.3710 7.9776 118.6265 50.9527 43.3004 176.0478 3 S 4.4759 9.6591 119.0993 57.8918 66.0746 174.9648 4 D 4.6512 8.7844 122.0852 57.6798 40.5754 179.2957 5 G 3.7104 8.1575 105.5198 47.9720 0.0000 175.3804 6 E 3.9321 8.2920 121.0387 58.9068 29.3959 179.4015 7 W 4.4222 8.2707 119.2158 59.9316 29.1288 178.3162 8 Q 4.0590 8.5072 119.5285 59.2436 28.4069 178.3634 9 Q 4.0351 8.2634 119.0572 58.9262 28.8005 178.7091 10 V 3.7035 8.1196 119.5243 66.4062 31.3796 178.1290 11 L 4.2685 8.1862 116.6833 57.0985 41.6967 178.8371 12 N 4.4917 8.2643 117.6950 56.6944 38.9140 176.8386 13 V 3.6015 8.1865 120.0830 66.0478 31.5032 177.8081 14 W 4.1143 8.6521 127.8834 60.0942 30.1484 177.8309 15 G 3.7588 7.9608 105.6633 47.9182 0.0000 175.7315 16 K 3.8392 7.7826 119.8042 59.1654 32.3355 179.2709 17 V 2.8328 6.9073 117.8740 65.7511 31.1064 177.8082 18 E 3.8535 7.5940 116.6360 58.8537 29.2718 178.8355 19 A 4.1773 7.3262 119.8523 53.9528 19.8567 177.6717 20 D 4.6676 7.7851 116.4537 52.3025 42.6681 175.2651 21 I 3.6076 7.7709 123.5202 63.7816 38.5828 176.6859 22 A 4.1481 7.3892 122.6649 54.4559 18.3256 179.7218 23 G 3.5835 8.1683 105.5852 47.7361 0.0000 175.6534 24 H 4.1148 8.3529 119.2671 58.3016 28.7169 178.1226 25 G 3.5495 8.3256 107.8046 47.7666 0.0000 175.2297 26 Q 3.8617 8.3537 122.8729 59.0753 28.9739 178.5296 27 E 3.8885 8.1050 119.3126 59.1751 29.3367 179.5843 28 V 3.5080 7.9560 118.5407 66.0917 31.5829 178.1907 29 L 3.4070 7.7488 118.6210 57.4282 41.2140 179.5839 30 I 3.5837 7.8139 120.2083 64.2159 37.0535 178.2648 31 R 3.7813 8.0597 119.8033 59.3087 29.8566 178.1011 32 L 3.9378 7.8647 120.0717 58.4600 41.5630 179.1068 33 F 4.6134 8.1917 118.2522 60.6903 38.5950 177.9314 34 T 4.0923 8.2028 109.2950 64.7212 68.8910 176.9559 35 G 3.6089 7.9246 107.4385 46.2812 0.0000 173.7733 36 H 4.7910 7.9526 117.6854 52.1902 29.8220 171.9675 37 P 4.4441 0.0000 0.0000 64.4427 31.3823 177.5998 38 E 4.0827 8.2373 116.3879 59.4292 29.3816 179.1646 39 T 3.7992 8.1491 111.3505 64.5397 68.8854 176.2697 40 L 3.5227 7.8227 123.2330 57.9143 41.7579 178.7784 41 E 4.1392 7.7659 117.4737 58.7023 29.4365 178.8251 42 K 4.4499 8.0810 117.6014 57.0294 32.6019 176.7379 43 F 4.6413 8.0919 118.7971 55.4653 38.6332 175.8843 44 D 4.4213 8.6686 127.5015 57.0895 40.7815 178.8272 45 K 4.0227 7.8262 115.1530 57.6630 33.0875 176.9704 46 F 5.0629 7.9305 117.5980 57.1498 40.6227 176.5143 47 K 4.2029 7.6371 119.1177 58.1839 32.4907 177.6483 48 H 4.3491 8.0436 114.9174 57.5532 28.9140 175.8012 49 L 4.1648 7.4171 120.6435 54.1376 39.9721 176.7617 50 K 4.1110 8.7139 123.7292 58.5139 32.7051 178.3668 51 T 4.6857 8.3078 108.6803 59.3468 72.6730 174.6216 52 E 3.9174 8.6509 121.7946 59.3125 29.6103 178.9181 53 A 3.9840 7.9496 120.4464 55.2443 18.2824 179.2520 54 E 3.9375 7.9469 115.8424 59.7245 29.8826 179.1988 55 M 4.1355 7.9682 118.6989 58.3919 31.8538 178.7830 56 K 3.9212 8.3210 118.4939 59.0504 32.4528 177.8785 57 A 4.4831 7.6885 118.6483 51.7104 19.0410 177.0420 58 S 4.3412 7.4925 113.2683 57.4855 62.4468 174.6748 59 E 4.0553 8.7892 128.7623 59.2447 29.2151 178.6549 60 D 4.4316 8.1684 117.9882 56.9275 41.3120 177.8445 61 L 3.6987 8.0417 121.0259 57.8200 41.9915 178.7661 62 K 3.8583 7.7853 119.7409 59.2892 32.1039 178.4430 63 K 3.8955 8.2900 119.9664 60.0313 32.0969 178.1316 64 H 4.3549 8.8763 118.8885 59.2000 29.7845 177.2454 65 G 3.6615 8.5614 107.9922 48.2225 0.0000 175.6965 66 T 3.9008 8.1491 118.3628 66.2751 68.4747 176.8632 67 V 3.6532 7.7466 120.1295 65.9189 31.4805 178.2157 68 V 3.6161 8.0738 118.2248 66.2723 31.4984 178.1457 69 L 4.2298 8.1378 118.5450 57.8361 41.4241 179.7051 70 T 3.9932 8.1754 115.8521 66.4795 68.3889 176.3911 71 A 3.9988 8.1277 122.6144 55.1810 18.4110 179.4067 72 L 3.7136 8.2246 119.1373 58.0892 42.1110 179.3473 73 G 3.0704 8.6223 106.1783 47.5011 0.0000 175.7410 74 G 3.6418 7.8376 107.1144 47.5215 0.0000 175.4817 75 I 3.8388 7.5656 122.1566 64.1863 37.1008 178.5426 76 L 3.9794 7.8535 120.0891 57.6594 41.1906 179.4778 77 K 3.9445 7.6839 116.5107 58.0912 32.2589 178.5637 78 K 3.9660 7.8936 118.4884 55.7931 32.6264 176.5171 79 K 2.0000 8.3440 118.3553 56.3392 29.7589 175.9697 80 G 3.9176 7.8555 106.1464 45.7666 0.0000 173.8511 81 H 4.5364 7.4004 119.2232 55.4027 27.5330 174.9393 82 H 5.4248 7.3471 110.7630 54.2077 29.7952 175.8544 83 E 3.9194 8.6417 122.2420 60.2380 28.9998 178.7111 84 A 3.9927 7.9229 118.4693 55.2122 18.9272 178.9845 85 E 4.0923 8.0850 116.6882 59.2129 29.6247 178.9746 86 L 3.9857 8.4111 120.7739 57.5168 42.2229 178.3043 87 K 3.8206 8.2480 120.2368 59.3591 31.9816 176.7554 88 P 4.2618 0.0000 0.0000 65.8539 31.0051 178.3276 89 L 4.0202 7.5139 116.2460 57.5085 41.5954 178.9551 90 A 4.1202 8.2501 121.0674 55.6372 18.2094 179.8196 91 Q 3.9064 8.3302 116.6218 58.9982 28.7169 179.0391 92 S 4.0174 8.3960 115.6817 61.7852 63.1010 176.3260 93 H 4.1188 8.7104 119.8718 58.1223 28.2417 177.7469 94 A 2.5800 7.8216 122.6341 54.8696 18.0055 179.7627 95 T 3.7516 7.5294 112.8554 65.5857 68.8146 176.3656 96 K 4.0306 7.4290 120.0266 58.9861 32.6928 177.2901 97 H 4.3560 7.9089 113.9109 55.8901 29.4198 175.3787 98 K 3.5711 7.4007 116.6708 56.3278 28.9295 176.4895 99 I 4.2885 7.9526 119.5030 58.9945 37.8686 175.0352 100 P 4.5186 0.0000 0.0000 62.2822 32.0125 177.5843 101 I 3.5210 8.5924 120.5895 64.1263 37.6609 177.9051 102 K 3.5614 8.0297 120.0304 59.9782 31.6944 178.0444 103 Y 4.1412 7.9701 116.6658 60.7901 37.7712 178.2069 104 L 4.1373 7.8373 119.8593 57.4060 41.7266 178.7237 105 E 3.9502 8.0871 119.4560 59.3790 29.5115 178.7185 106 F 4.5095 8.0320 117.8886 61.0436 39.0706 177.7003 107 I 3.8153 8.3044 118.0279 63.8705 37.8270 178.1133 108 S 4.2148 8.3564 116.3285 61.7882 62.7082 176.2633 109 D 4.4732 8.4579 121.3480 57.3979 40.5385 178.7199 110 A 4.0484 8.3361 121.4071 55.2124 18.3138 179.7278 111 I 3.6612 7.9316 118.1825 64.6225 37.2832 178.6475 112 I 3.8549 7.7010 120.0832 64.6667 36.8927 177.9225 113 H 4.1485 8.4738 118.9830 59.4315 29.6950 177.3934 114 V 3.5202 8.2474 120.3853 65.9240 31.3881 177.9177 115 L 3.8138 7.9938 118.7283 58.1417 41.2214 179.2502 116 H 4.3632 8.1436 115.9798 58.9388 28.3927 177.8950 117 S 4.1330 7.9949 114.3910 61.0983 62.3266 175.8466 118 K 4.1055 8.1563 119.9351 57.6615 33.1054 176.6558 119 H 4.9719 7.9885 116.2213 53.8203 29.4886 171.9537 120 P 4.5825 0.0000 0.0000 63.6474 31.8951 177.4024 121 G 3.9805 9.1600 110.4683 45.6907 0.0000 172.9672 122 D 4.9530 8.4340 117.8286 53.6741 41.6362 175.9718 123 F 4.9965 8.0073 120.1759 55.0149 39.4452 174.9525 124 G 3.8062 8.0824 112.4519 43.3758 0.0000 170.8365 125 A 3.9019 8.3716 122.0914 54.9706 18.2644 179.6461 126 D 4.2154 8.0063 116.8745 56.5876 39.3596 178.4423 127 A 3.9732 7.8535 122.0085 54.8287 18.3876 179.1591 128 Q 3.5737 7.9759 118.4629 58.9308 28.9367 178.6386 129 G 3.5618 8.0654 106.5049 47.7608 0.0000 175.5087 130 A 3.8399 8.0726 123.7727 54.9684 18.3915 179.3662 131 M 4.0261 8.3841 117.0815 59.0645 32.2131 178.5355 132 T 3.8928 8.1815 115.9630 66.6274 68.6264 176.5698 133 K 3.9544 8.1732 120.2289 59.5731 32.0430 179.2114 134 A 3.8395 7.9926 120.8151 55.1450 18.2207 179.7531 135 L 4.0720 8.2464 117.7397 57.8803 41.6863 179.6103 136 E 3.9886 8.5986 119.0663 59.1618 29.3057 179.0460 137 L 3.9492 8.1491 120.4930 58.0829 42.1839 178.4820 138 F 4.1396 8.4222 120.5931 61.5691 39.2158 176.9757 139 R 3.5227 8.3172 118.1209 59.4173 29.8673 178.0003 140 N 4.2338 8.6464 117.0581 56.7872 38.8182 176.6489 141 D 4.3436 8.3548 120.6363 57.2350 40.8406 178.7551 142 I 3.4796 7.5547 120.1588 64.2521 36.9527 178.2058 143 A 3.7849 8.0531 121.6643 55.0089 18.1223 179.4636 144 A 3.9399 7.9357 119.2014 55.3942 18.5922 180.0897 145 K 4.0196 7.8389 117.0162 59.6933 32.1083 179.1846 146 Y 4.2361 8.6206 117.5835 61.0691 37.8398 178.6560 147 K 3.9737 8.5485 120.8533 59.4364 32.0784 178.1261 148 E 3.9479 8.0112 118.5307 59.4588 29.6310 178.3431 149 L 4.3355 7.7343 115.3273 54.4112 41.9456 177.4119 150 G 3.8816 7.8111 106.7765 46.1759 0.0000 173.2273 151 F 4.2900 8.2941 122.1989 58.0104 39.9094 175.6059 152 Q 3.3878 7.7935 125.7177 56.3960 28.6535 173.4497 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 G 8.35 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 0.00 0.00 0.00 2 L 7.98 4.37 0.00 0.45 0.64 0.50 -0.69 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 3 S 9.66 4.48 0.00 4.03 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 4 D 8.78 4.65 0.00 2.77 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 5 G 8.16 3.71 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 0.00 6 E 8.29 3.93 0.00 2.01 1.74 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 2.23 2.27 0.00 7 W 8.27 4.42 0.00 3.52 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 8 Q 8.51 4.06 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 9 Q 8.26 4.04 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.53 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 10 V 8.12 3.70 2.50 0.00 0.00 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 0.87 0.00 0.00 11 L 8.19 4.27 0.00 1.75 1.80 0.90 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.26 4.49 0.00 2.94 3.02 0.00 0.00 6.64 7.03 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 13 V 8.19 3.60 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 0.95 0.00 0.00 1.18 0.00 0.00 14 W 8.65 4.11 0.00 3.63 3.25 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 0.00 15 G 7.96 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 16 K 7.78 3.84 0.00 1.52 1.49 0.00 1.49 0.00 0.00 1.06 0.00 0.00 3.06 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.25 1.35 7.81 17 V 6.91 2.83 0.67 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 0.04 0.00 0.00 0.13 0.00 0.00 18 E 7.59 3.85 0.00 1.86 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 2.30 2.15 0.00 19 A 7.33 4.18 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 20 D 7.79 4.67 0.00 2.71 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 21 I 7.77 3.61 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.28 0.89 0.00 0.00 22 A 7.39 4.15 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 23 G 8.17 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.35 4.11 0.00 3.15 3.22 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.33 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.35 3.86 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.74 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 E 8.10 3.89 0.00 1.96 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 2.25 2.41 0.00 28 V 7.96 3.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.94 0.00 0.00 29 L 7.75 3.41 0.00 1.46 0.74 0.81 0.43 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 30 I 7.81 3.58 1.77 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.73 0.87 0.00 0.00 31 R 8.06 3.78 0.00 1.92 2.10 0.00 3.03 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 32 L 7.86 3.94 0.00 1.77 1.45 1.07 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.19 4.61 0.00 2.98 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.20 4.09 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 35 G 7.92 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.95 4.79 0.00 3.07 2.94 0.00 5.64 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.44 0.00 2.15 2.10 0.00 3.83 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 2.09 1.99 0.00 38 E 8.24 4.08 0.00 2.30 2.30 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 2.18 2.55 0.00 39 T 8.15 3.80 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 40 L 7.82 3.52 0.00 1.36 1.73 -0.12 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.77 4.14 0.00 2.20 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 2.38 2.54 0.00 42 K 8.08 4.45 0.00 1.97 1.78 0.00 1.95 0.00 0.00 1.80 0.00 0.00 3.21 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.77 2.01 7.81 43 F 8.09 4.64 0.00 3.29 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 44 D 8.67 4.42 0.00 2.76 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 45 K 7.83 4.02 0.00 1.61 1.73 0.00 1.35 0.00 0.00 1.49 0.00 0.00 2.67 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.83 0.21 7.81 46 F 7.93 5.06 0.00 2.80 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 47 K 7.64 4.20 0.00 1.72 1.93 0.00 1.51 0.00 0.00 1.77 0.00 0.00 3.24 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.70 7.81 48 H 8.04 4.35 0.00 3.28 3.50 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.42 4.16 0.00 1.59 1.60 0.79 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.71 4.11 0.00 1.89 1.86 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.37 7.81 51 T 8.31 4.69 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 1.25 0.00 0.00 52 E 8.65 3.92 0.00 2.04 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 2.35 2.36 0.00 53 A 7.95 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 54 E 7.95 3.94 0.00 2.15 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 2.36 2.36 0.00 55 M 7.97 4.14 0.00 2.04 2.24 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 2.78 2.52 0.00 56 K 8.32 3.92 0.00 1.84 1.92 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.47 7.81 57 A 7.69 4.48 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 58 S 7.49 4.34 0.00 4.05 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.79 4.06 0.00 2.05 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 2.32 0.00 60 D 8.17 4.43 0.00 2.90 2.92 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 61 L 8.04 3.70 0.00 1.43 1.65 0.70 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.79 3.86 0.00 1.79 1.98 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 63 K 8.29 3.90 0.00 2.02 2.13 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 64 H 8.88 4.35 0.00 3.64 3.67 0.00 5.85 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.56 3.66 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 0.00 0.00 0.00 66 T 8.15 3.90 4.43 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 1.23 0.00 0.00 67 V 7.75 3.65 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 1.05 0.00 0.00 1.02 0.00 0.00 68 V 8.07 3.62 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 1.14 0.00 0.00 0.98 0.00 0.00 69 L 8.14 4.23 0.00 1.79 1.83 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.18 3.99 4.47 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 1.26 0.00 0.00 71 A 8.13 4.00 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 72 L 8.22 3.71 0.00 1.61 1.81 0.05 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.62 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 0.00 0.00 0.00 74 G 7.84 3.64 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 0.00 0.00 0.00 75 I 7.57 3.84 1.89 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 1.55 1.01 0.96 0.00 0.00 76 L 7.85 3.98 0.00 1.21 1.53 0.06 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.68 3.94 0.00 1.74 1.77 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.43 7.81 78 K 7.89 3.97 0.00 1.84 1.79 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.58 1.74 7.81 79 K 8.34 2.00 0.00 1.17 0.74 0.00 1.37 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.44 0.83 7.81 80 G 7.86 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.40 4.54 0.00 3.15 3.23 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.35 5.42 0.00 3.27 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.64 3.92 0.00 2.12 2.02 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 2.40 2.48 0.00 84 A 7.92 3.99 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 85 E 8.09 4.09 0.00 2.24 2.02 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 2.39 2.43 0.00 86 L 8.41 3.99 0.00 1.72 1.68 0.71 0.36 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 87 K 8.25 3.82 0.00 1.98 1.82 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.49 7.81 88 P 0.00 4.26 0.00 2.33 2.31 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.14 0.00 89 L 7.51 4.02 0.00 1.97 1.78 1.03 0.85 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 90 A 8.25 4.12 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 91 Q 8.33 3.91 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 92 S 8.40 4.02 0.00 3.94 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 93 H 8.71 4.12 0.00 3.50 3.57 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.82 2.58 0.29 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 95 T 7.53 3.75 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 1.10 0.00 0.00 96 K 7.43 4.03 0.00 1.53 1.60 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.20 1.34 7.81 97 H 7.91 4.36 0.00 3.01 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.40 3.57 0.00 1.92 1.99 0.00 1.79 0.00 0.00 2.40 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.30 7.81 99 I 7.95 4.29 2.08 0.00 0.00 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 1.47 0.94 1.18 0.00 0.00 100 P 0.00 4.52 0.00 1.71 1.71 0.00 2.45 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.89 0.00 101 I 8.59 3.52 1.75 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.06 0.86 0.00 0.00 102 K 8.03 3.56 0.00 1.74 1.62 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.18 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 0.57 7.81 103 Y 7.97 4.14 0.00 3.20 3.11 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 0.00 104 L 7.84 4.14 0.00 1.78 1.74 0.66 1.00 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 0.00 105 E 8.09 3.95 0.00 1.98 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 2.39 2.39 0.00 106 F 8.03 4.51 0.00 3.27 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 0.00 107 I 8.30 3.82 2.04 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.40 1.14 0.00 0.00 108 S 8.36 4.21 0.00 4.19 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.46 4.47 0.00 3.00 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 0.00 110 A 8.34 4.05 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 0.00 111 I 7.93 3.66 2.11 0.00 0.00 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 1.58 0.71 0.99 0.00 0.00 112 I 7.70 3.85 2.14 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.37 1.16 0.00 0.00 113 H 8.47 4.15 0.00 3.32 3.50 0.00 5.79 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 0.00 114 V 8.25 3.52 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 0.97 0.00 0.00 1.00 0.00 0.00 115 L 7.99 3.81 0.00 1.20 0.53 0.45 0.60 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 0.00 116 H 8.14 4.36 0.00 3.41 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.99 4.13 0.00 3.72 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 0.00 118 K 8.16 4.11 0.00 1.53 1.45 0.00 1.51 0.00 0.00 1.22 0.00 0.00 2.51 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.26 1.46 7.81 119 H 7.99 4.97 0.00 3.25 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.58 0.00 2.19 2.08 0.00 3.48 0.00 0.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 121 G 9.16 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 0.00 122 D 8.43 4.95 0.00 2.62 2.78 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 0.00 123 F 8.01 5.00 0.00 2.78 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.08 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.37 3.90 1.26 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 0.00 126 D 8.01 4.22 0.00 2.93 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 0.00 127 A 7.85 3.97 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 0.00 128 Q 7.98 3.57 0.00 1.19 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 129 G 8.07 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.07 3.84 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 0.00 131 M 8.38 4.03 0.00 2.41 2.32 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.80 0.00 132 T 8.18 3.89 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 1.23 0.00 0.00 133 K 8.17 3.95 0.00 1.79 1.67 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.49 7.81 134 A 7.99 3.84 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 0.00 135 L 8.25 4.07 0.00 1.90 1.83 1.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.60 3.99 0.00 2.15 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 2.46 0.00 137 L 8.15 3.95 0.00 1.89 1.97 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.42 4.14 0.00 3.13 3.34 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 0.00 139 R 8.32 3.52 0.00 2.11 2.02 0.00 3.19 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 140 N 8.65 4.23 0.00 2.92 2.78 0.00 0.00 7.28 8.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.35 4.34 0.00 2.76 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 0.00 142 I 7.55 3.48 1.45 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.07 0.24 0.00 0.00 143 A 8.05 3.78 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 0.00 144 A 7.94 3.94 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 0.00 145 K 7.84 4.02 0.00 1.99 1.94 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.63 7.81 146 Y 8.62 4.24 0.00 3.09 3.11 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 0.00 147 K 8.55 3.97 0.00 1.84 1.98 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 148 E 8.01 3.95 0.00 2.04 2.25 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 2.34 2.38 0.00 149 L 7.73 4.34 0.00 1.82 1.66 0.83 0.70 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 0.00 150 G 7.81 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 0.00 0.00 0.00 151 F 8.29 4.29 0.00 2.73 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 0.00 152 Q 7.79 3.39 0.00 1.91 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.42 0.00 0.00 0.00 0.00 0.00 1.16 1.73 0.00