NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 L 4.4291 8.1849 120.6437 54.5658 43.0046 176.6008 9 Q 4.0211 8.6470 122.3503 55.0381 29.2455 173.7204 10 S 4.6957 8.4143 111.9216 58.4037 66.0390 172.6397 11 Q 4.8581 7.6004 120.2115 54.1004 30.8115 174.8183 12 F 4.8829 8.7281 123.9413 55.8457 43.5205 174.3521 13 F 4.8219 9.2131 120.6507 55.5990 41.6892 176.3288 14 I 3.6439 8.7105 118.8702 64.8473 37.1286 177.3119 15 E 3.9979 8.1738 117.8977 59.7910 29.4987 178.6050 16 H 4.9343 8.3989 116.2625 58.9066 28.7759 177.8617 17 I 3.9481 7.9228 121.1841 64.6191 36.8437 178.2868 18 L 3.9637 8.0104 118.2059 57.6904 41.6544 178.4359 19 Q 4.1910 7.9441 116.4408 56.8413 29.3377 176.9514 20 I 3.4237 7.4590 116.3782 62.3491 38.9955 175.9755 21 L 4.2513 7.7505 119.5349 53.3874 42.1713 175.6269 22 P 4.3228 0.0000 0.0000 64.6343 31.9748 176.5786 23 H 4.1430 7.9910 116.2712 56.2965 29.1628 174.2756 24 R 4.7428 8.0830 120.2896 54.0176 34.3236 173.7272 25 Y 4.3113 8.6154 119.9203 57.8909 38.9442 174.0426 26 P 3.8436 0.0000 0.0000 63.1570 31.9829 175.7193 27 M 4.5377 8.4939 115.6492 55.7800 33.3985 175.4942 28 L 4.5479 7.8908 121.5692 54.1058 41.7949 175.6825 29 L 4.8406 9.1751 127.5249 54.2070 42.3882 176.6949 30 V 4.5260 7.7163 117.6273 61.3851 33.9596 174.4395 31 D 4.6838 8.8572 127.0748 55.8439 42.2982 176.9244 32 R 4.4778 7.0696 116.1316 54.9460 33.9057 173.6295 33 I 4.5902 8.6103 126.4158 59.9884 38.8041 176.2762 34 T 4.3522 8.7859 117.7104 62.7895 70.3556 174.8948 35 E 4.8824 7.8325 117.9002 54.6296 33.3855 174.4158 36 L 4.9195 8.5264 123.0834 54.3605 45.5790 174.5735 37 Q 4.7510 9.1166 125.9675 53.6298 31.0588 175.3392 38 A 4.1487 8.8343 127.2490 54.0358 18.7036 177.0194 39 N 4.6251 9.4173 118.9717 53.9763 37.1432 173.9732 40 Q 4.7497 8.0009 115.0877 56.2981 31.3117 175.1875 41 K 5.1632 7.7130 115.7803 55.8045 36.8024 173.8932 42 I 5.0753 8.9781 120.6954 59.4630 42.0610 173.7431 43 V 4.9191 8.9441 128.0691 61.2121 34.3341 174.2576 44 A 5.3844 9.2044 128.7779 51.2589 23.5141 173.5812 45 Y 5.0222 8.6382 115.2062 55.9336 41.8949 173.8457 46 K 4.9208 8.6784 121.8742 54.5327 35.2540 175.0316 47 N 4.8277 9.5548 125.9252 53.3901 39.5466 174.4816 48 I 4.6031 8.7756 124.4912 59.9781 38.3699 174.7157 49 T 4.9593 9.4158 121.4381 59.9120 70.7738 174.5863 50 F 4.0050 8.9455 127.7427 61.1279 39.6552 176.4936 51 N 4.9261 7.6228 116.2609 53.6415 38.4788 174.0038 52 E 4.8311 8.5158 116.3146 53.7650 32.4590 177.1167 53 D 4.3188 8.7432 121.8684 57.3772 41.3439 178.4590 54 V 3.3619 7.6730 118.3604 66.2002 31.1773 177.7702 55 F 4.4503 7.7532 116.2615 59.9273 38.4294 177.1676 56 N 4.4495 8.0023 116.1090 55.3952 38.7159 175.7830 57 G 4.0414 8.0622 106.6686 45.6575 0.0000 172.2873 58 H 3.9534 7.7108 118.9174 53.6976 30.0727 171.5565 59 F 5.3373 8.9700 121.3656 52.8346 42.7550 173.2138 60 P 4.5488 0.0000 0.0000 64.5386 31.3245 177.2005 61 N 4.5443 9.4601 118.5892 53.7419 37.0587 174.9684 62 K 4.5577 8.0833 119.3452 53.6517 32.6000 170.8211 63 P 5.0723 0.0000 0.0000 62.5836 32.1226 176.3692 64 I 4.8992 8.8391 126.1744 58.9255 40.0662 175.3884 65 F 4.1146 9.7917 131.1879 57.5101 39.9237 173.3601 66 P 3.8735 0.0000 0.0000 62.3564 32.0792 177.2924 67 G 3.1041 8.5179 109.7370 48.0964 0.0000 176.1714 68 V 3.7910 7.5446 113.7194 63.6943 31.4560 178.0930 69 L 4.1815 7.5662 118.5208 56.6808 41.5523 179.2240 70 I 4.1190 7.8262 119.8319 64.4857 37.1291 178.2109 71 V 3.6996 7.9049 118.6823 65.9930 31.3345 177.3637 72 E 4.2296 8.3572 119.1912 59.6380 29.4747 179.1896 73 G 3.4929 8.2875 106.9761 47.3351 0.0000 175.5451 74 M 3.6766 7.8558 120.6833 57.9574 31.8734 178.6992 75 A 3.8672 8.2046 121.1528 55.2631 18.5370 179.7664 76 Q 3.7997 8.0353 116.5978 58.9154 28.6610 179.1770 77 S 4.1681 7.9293 116.4405 61.5836 62.9176 176.9446 78 G 3.7222 8.1729 108.5186 47.7717 0.0000 175.9916 79 G 3.6011 8.2976 108.4015 47.2653 0.0000 175.7507 80 F 3.8472 8.2745 122.9965 60.8634 39.4217 176.9631 81 L 3.8981 7.9921 119.8084 58.0779 41.7587 178.6595 82 A 2.0000 7.8547 120.8192 54.3278 17.9910 179.4704 83 F 3.8413 7.7078 119.1423 61.6478 39.6208 177.6184 84 T 4.2985 7.5120 110.2878 64.1606 68.2796 176.6821 85 S 4.1626 7.5515 117.6131 61.0388 62.8323 176.2961 86 L 3.8021 6.9943 121.0970 56.6822 41.5551 177.9831 87 W 4.4848 7.5051 114.7871 55.3805 30.4142 177.7410 88 G 3.9165 7.7539 109.1382 44.9839 0.0000 173.1031 89 F 4.5250 8.7427 119.8204 57.2198 37.9497 174.7123 90 D 4.6964 7.9767 123.5501 50.4726 42.4583 172.8876 91 P 4.3819 0.0000 0.0000 64.5211 31.2489 178.0033 92 E 3.9393 8.0383 116.4544 59.2845 29.7648 178.8675 93 I 3.6662 7.7359 119.8838 64.0859 37.1303 178.3052 94 A 3.5715 7.8031 122.0103 54.5542 17.8768 179.3071 95 K 3.9872 7.6741 114.6547 58.6402 32.8575 177.5641 96 T 4.4057 7.4188 108.8529 61.2693 69.2060 173.5377 97 K 4.9357 7.7241 121.6854 55.5241 33.9514 175.5000 98 I 4.5978 8.9772 115.6959 59.1009 41.7972 174.0014 99 V 4.7297 7.8722 121.0118 61.3468 34.0078 173.8070 100 Y 4.8272 8.8312 125.8179 55.9670 40.2408 175.3607 101 F 4.4131 9.1242 123.1030 58.6018 39.2390 174.1724 102 M 4.7372 9.5480 123.2125 56.8041 33.6119 176.2838 103 T 4.9091 7.8701 106.6349 60.2216 73.0406 172.3575 104 I 5.2417 8.2174 121.9450 60.0344 40.9798 174.4201 105 D 4.7511 9.2774 125.4903 52.5698 45.8407 175.1420 106 K 4.0385 8.4662 116.7504 57.6300 29.7341 175.7843 107 V 4.8725 7.5158 110.0372 59.4882 33.2697 176.5387 108 K 4.4320 8.1017 124.9948 54.5838 35.6694 174.3466 109 F 5.1901 8.8015 125.5957 56.4301 40.0110 175.2731 110 R 4.5788 9.2307 123.0292 57.1454 31.9285 177.2093 111 I 4.6786 7.6442 117.7306 58.2538 40.6888 173.2345 112 P 4.4886 0.0000 0.0000 63.3068 32.0790 175.4917 113 V 4.7313 8.5616 121.9856 61.6733 33.7273 174.4680 114 T 5.1016 8.8601 116.8872 58.7805 72.7140 171.4877 115 P 4.4056 0.0000 0.0000 64.8336 31.6165 176.9911 116 G 4.0037 9.3454 111.7029 45.0294 0.0000 173.3723 117 D 4.5489 7.9344 120.3216 53.9416 42.4175 175.7729 118 R 4.5317 8.3900 123.2459 54.8390 30.9191 175.6034 119 L 4.2978 8.7044 131.2156 54.0971 43.0894 174.7858 120 E 4.7222 9.1637 129.3707 55.1094 31.2366 174.1689 121 Y 5.2122 8.9576 125.6930 57.2224 40.1667 174.3529 122 H 5.2085 9.7319 121.9098 54.2640 31.5243 172.5822 123 L 5.3428 8.9516 123.8129 52.8336 44.8580 175.7511 124 E 5.1576 9.2063 121.8509 54.2909 33.3962 175.4444 125 V 4.0303 8.9139 124.6015 63.2885 31.3673 175.7136 126 L 4.3947 9.0825 129.0440 56.8345 42.8447 177.4606 127 K 4.3354 7.4896 115.7810 55.7465 35.3892 173.6664 128 H 4.8872 8.4114 121.8000 53.6567 31.7711 173.0900 129 K 4.0565 8.4478 122.3727 55.5558 35.0696 177.1520 130 G 3.7843 8.1672 118.5674 47.3599 0.0000 175.3612 131 M 4.3470 8.8491 127.5256 56.2152 32.5266 175.0005 132 I 4.7726 7.7454 121.0675 59.9925 38.5547 174.7116 133 W 4.8248 9.4561 128.4911 54.7276 32.0225 174.7467 134 Q 5.0477 9.6106 127.1998 54.7342 30.2334 174.5741 135 V 5.0263 8.9226 120.2428 59.7536 35.4968 175.2080 136 G 4.4067 9.1292 109.2286 44.5662 0.0000 172.8935 137 G 4.9137 8.2336 107.8215 45.9965 0.0000 171.8428 138 T 5.2935 7.8140 110.7425 60.0209 72.9800 173.0355 139 A 5.4173 8.9356 124.5101 50.7224 21.8541 176.0059 140 Q 5.0437 9.2552 119.1623 54.1944 33.9475 174.5416 141 V 4.5658 8.3727 121.5644 61.3364 34.6781 175.0941 142 D 4.2039 9.7147 128.7023 55.4429 39.3682 174.2151 143 G 3.9395 8.3109 103.8892 45.4112 0.0000 173.5796 144 K 4.4781 7.4895 119.5809 54.1474 34.0021 175.8912 145 V 4.1865 8.2935 122.9927 63.1536 31.6302 175.8542 146 V 4.3368 8.6256 120.8663 62.4216 33.2815 175.8100 147 A 5.0840 7.6715 119.8616 50.9594 22.5081 174.9669 148 E 5.2307 8.7455 119.6631 54.8416 33.5144 175.0500 149 A 4.8134 8.6840 122.0252 50.9721 23.4956 174.7900 150 E 5.1815 9.0001 122.0588 54.3431 32.7377 174.7775 151 L 5.2140 9.1960 125.7062 54.4092 44.7921 174.2585 152 K 5.1288 9.1507 121.3500 54.7495 34.9378 174.7209 153 A 5.2574 9.2903 128.6167 50.2629 22.9753 174.0246 154 M 5.2634 9.1545 119.7094 53.8286 35.0924 174.8045 155 I 4.7446 8.6067 127.1023 60.9218 38.5266 175.3175 156 A 4.8643 9.0974 127.4154 49.9201 22.9702 174.9245 157 E 4.3348 8.9511 122.8853 56.0111 30.4124 176.7412 158 R 4.1248 9.3087 127.9995 56.7264 30.7767 176.7181 159 E 4.2334 8.6087 120.8885 56.4888 29.8455 175.2889 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 8 L 8.18 4.43 0.00 1.76 1.84 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.65 4.02 0.00 1.47 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.86 0.00 0.00 0.00 0.00 0.00 2.19 2.03 0.00 10 S 8.41 4.70 0.00 3.86 3.75 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 11 Q 7.60 4.86 0.00 1.90 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 12 F 8.73 4.88 0.00 2.75 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 F 9.21 4.82 0.00 3.03 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 14 I 8.71 3.64 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.46 0.96 0.00 0.00 15 E 8.17 4.00 0.00 1.88 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 2.30 2.47 0.00 16 H 8.40 4.93 0.00 3.68 3.92 0.00 5.64 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 17 I 7.92 3.95 2.02 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 1.30 0.73 0.90 0.00 0.00 18 L 8.01 3.96 0.00 1.83 1.76 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 7.94 4.19 0.00 2.33 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 20 I 7.46 3.42 1.72 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.30 0.00 0.00 0.00 21 L 7.75 4.25 0.00 1.63 1.64 0.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.32 0.00 2.01 2.20 0.00 3.73 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 1.70 1.90 0.00 23 H 7.99 4.14 0.00 3.10 3.43 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 24 R 8.08 4.74 0.00 1.78 1.83 0.00 3.32 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.53 0.00 25 Y 8.62 4.31 0.00 2.95 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 26 P 0.00 3.84 0.00 1.68 0.87 0.00 3.60 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 27 M 8.49 4.54 0.00 1.94 2.01 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 2.46 2.47 0.00 28 L 7.89 4.55 0.00 1.61 1.64 0.98 0.97 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 29 L 9.18 4.84 0.00 1.64 1.79 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.72 4.53 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 0.78 0.00 0.00 0.85 0.00 0.00 31 D 8.86 4.68 0.00 2.37 2.52 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 32 R 7.07 4.48 0.00 1.31 0.83 0.00 3.22 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.31 0.00 33 I 8.61 4.59 1.80 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.23 0.95 0.00 0.00 34 T 8.79 4.35 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 1.33 0.00 0.00 35 E 7.83 4.88 0.00 2.03 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 2.27 2.17 0.00 36 L 8.53 4.92 0.00 1.85 1.78 1.21 0.90 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 37 Q 9.12 4.75 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 38 A 8.83 4.15 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 39 N 9.42 4.63 0.00 2.93 3.00 0.00 0.00 6.83 7.27 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 40 Q 8.00 4.75 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 41 K 7.71 5.16 0.00 1.96 1.90 0.00 1.50 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.49 7.81 42 I 8.98 5.08 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.64 1.03 0.00 0.00 43 V 8.94 4.92 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 0.72 0.00 0.00 0.87 0.00 0.00 44 A 9.20 5.38 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 45 Y 8.64 5.02 0.00 2.93 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 46 K 8.68 4.92 0.00 2.09 1.58 0.00 1.91 0.00 0.00 1.43 0.00 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.33 1.40 7.81 47 N 9.55 4.83 0.00 2.81 2.79 0.00 0.00 6.95 6.99 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 48 I 8.78 4.60 2.02 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.92 1.08 0.00 0.00 49 T 9.42 4.96 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 1.38 0.00 0.00 50 F 8.95 4.01 0.00 3.01 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 51 N 7.62 4.93 0.00 2.80 2.88 0.00 0.00 7.02 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 52 E 8.52 4.83 0.00 2.14 1.80 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 2.34 2.57 0.00 53 D 8.74 4.32 0.00 2.85 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 54 V 7.67 3.36 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.57 0.00 0.00 55 F 7.75 4.45 0.00 3.03 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 56 N 8.00 4.45 0.00 2.84 2.90 0.00 0.00 6.77 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 57 G 8.06 4.04 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 0.00 0.00 0.00 58 H 7.71 3.95 0.00 2.85 2.75 0.00 5.53 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 59 F 8.97 5.34 0.00 3.14 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 60 P 0.00 4.55 0.00 2.12 2.10 0.00 3.97 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.38 0.00 61 N 9.46 4.54 0.00 2.94 3.03 0.00 0.00 6.78 7.61 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 62 K 8.08 4.56 0.00 1.80 1.76 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.45 7.81 63 P 0.00 5.07 0.00 1.64 2.08 0.00 3.82 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 64 I 8.84 4.90 2.07 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.98 1.07 0.00 0.00 65 F 9.79 4.11 0.00 3.19 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 66 P 0.00 3.87 0.00 1.66 1.40 0.00 2.21 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.23 0.00 67 G 8.52 3.10 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 68 V 7.54 3.79 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 0.75 0.00 0.00 0.77 0.00 0.00 69 L 7.57 4.18 0.00 1.14 1.50 0.40 0.61 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 70 I 7.83 4.12 2.41 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.26 1.23 0.00 0.00 71 V 7.90 3.70 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 1.18 0.00 0.00 1.09 0.00 0.00 72 E 8.36 4.23 0.00 2.32 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 2.33 2.40 0.00 73 G 8.29 3.49 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 0.00 74 M 7.86 3.68 0.00 2.10 2.30 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.77 0.00 75 A 8.20 3.87 1.09 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 0.00 0.00 76 Q 8.04 3.80 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 1.86 2.32 0.00 77 S 7.93 4.17 0.00 3.93 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 78 G 8.17 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.30 3.60 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 0.00 0.00 0.00 80 F 8.27 3.85 0.00 3.11 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 81 L 7.99 3.90 0.00 1.85 1.77 1.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.85 2.00 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 83 F 7.71 3.84 0.00 3.10 2.76 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 84 T 7.51 4.30 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 0.76 0.00 0.00 85 S 7.55 4.16 0.00 3.83 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 0.00 86 L 6.99 3.80 0.00 1.03 0.13 1.06 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 87 W 7.51 4.48 0.00 2.68 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 88 G 7.75 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 89 F 8.74 4.52 0.00 3.16 3.16 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 0.00 0.00 0.00 0.00 90 D 7.98 4.70 0.00 2.78 2.58 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 91 P 0.00 4.38 0.00 2.10 1.91 0.00 3.85 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.45 0.00 92 E 8.04 3.94 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 93 I 7.74 3.67 1.85 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.71 -0.21 0.00 0.00 94 A 7.80 3.57 0.52 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 95 K 7.67 3.99 0.00 1.82 1.82 0.00 1.49 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.59 1.28 7.81 96 T 7.42 4.41 4.28 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 1.14 0.00 0.00 97 K 7.72 4.94 0.00 1.59 1.79 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.64 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.61 7.81 98 I 8.98 4.60 1.53 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.52 0.77 0.00 0.00 99 V 7.87 4.73 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 0.79 0.00 0.00 0.88 0.00 0.00 100 Y 8.83 4.83 0.00 3.02 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 0.00 101 F 9.12 4.41 0.00 3.04 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 0.00 102 M 9.55 4.74 0.00 1.91 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.52 0.00 103 T 7.87 4.91 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 1.25 0.00 0.00 104 I 8.22 5.24 1.81 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 0.90 0.00 0.00 105 D 9.28 4.75 0.00 2.57 2.49 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 0.00 106 K 8.47 4.04 0.00 1.87 1.85 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.44 7.81 107 V 7.52 4.87 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 0.75 0.00 0.00 0.42 0.00 0.00 108 K 8.10 4.43 0.00 1.70 1.52 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.43 7.81 109 F 8.80 5.19 0.00 3.01 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 0.00 110 R 9.23 4.58 0.00 1.83 2.00 0.00 3.26 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 111 I 7.64 4.68 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.65 0.96 0.00 0.00 112 P 0.00 4.49 0.00 2.16 2.14 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 113 V 8.56 4.73 2.32 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 0.94 0.00 0.00 1.06 0.00 0.00 114 T 8.86 5.10 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 1.33 0.00 0.00 115 P 0.00 4.41 0.00 1.98 2.11 0.00 3.52 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.14 0.00 116 G 9.35 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 0.00 0.00 0.00 117 D 7.93 4.55 0.00 2.76 2.55 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 0.00 118 R 8.39 4.53 0.00 1.69 1.72 0.00 2.88 0.00 0.00 2.84 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.33 0.00 119 L 8.70 4.30 0.00 1.60 1.43 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 120 E 9.16 4.72 0.00 1.95 1.89 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 2.25 2.38 0.00 121 Y 8.96 5.21 0.00 3.02 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 0.00 122 H 9.73 5.21 0.00 3.14 3.27 0.00 5.56 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.95 5.34 0.00 1.59 1.59 0.98 0.70 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 0.00 124 E 9.21 5.16 0.00 1.89 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 0.00 2.26 2.27 0.00 125 V 8.91 4.03 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 0.77 0.00 0.00 1.28 0.00 0.00 126 L 9.08 4.39 0.00 1.63 1.71 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.49 4.34 0.00 1.73 1.53 0.00 1.61 0.00 0.00 1.82 0.00 0.00 2.77 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.18 1.23 7.81 128 H 8.41 4.89 0.00 1.40 1.94 0.00 5.74 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.45 4.06 0.00 1.57 1.54 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.23 1.25 7.81 130 G 8.17 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 0.00 0.00 0.00 131 M 8.85 4.35 0.00 2.44 2.21 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.58 0.00 132 I 7.75 4.77 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.70 0.94 0.00 0.00 133 W 9.46 4.82 0.00 3.20 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 0.00 134 Q 9.61 5.05 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.53 0.00 135 V 8.92 5.03 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 0.85 0.00 0.00 0.98 0.00 0.00 136 G 9.13 4.41 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 0.00 137 G 8.23 4.91 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 0.00 138 T 7.81 5.29 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 1.23 0.00 0.00 139 A 8.94 5.42 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 9.26 5.04 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 141 V 8.37 4.57 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 0.92 0.00 0.00 0.92 0.00 0.00 142 D 9.71 4.20 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 0.00 143 G 8.31 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.49 4.48 0.00 1.99 1.72 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.34 7.81 145 V 8.29 4.19 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 0.86 0.00 0.00 0.93 0.00 0.00 146 V 8.63 4.34 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.06 0.00 0.00 147 A 7.67 5.08 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 0.00 148 E 8.75 5.23 0.00 1.82 1.79 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 2.20 2.21 0.00 149 A 8.68 4.81 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 0.00 150 E 9.00 5.18 0.00 2.05 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 2.22 2.24 0.00 151 L 9.20 5.21 0.00 2.22 1.92 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 152 K 9.15 5.13 0.00 1.90 1.75 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.41 7.81 153 A 9.29 5.26 1.04 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 0.00 0.00 154 M 9.15 5.26 0.00 2.16 1.98 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 2.67 0.00 155 I 8.61 4.74 2.07 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 1.22 0.00 0.00 156 A 9.10 4.86 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 0.00 157 E 8.95 4.33 0.00 2.00 1.92 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 2.29 2.40 0.00 158 R 9.31 4.12 0.00 1.75 1.87 0.00 3.10 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 159 E 8.61 4.23 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00