NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 4.0332 8.3549 109.7265 45.4851 0.0000 175.3297 17 I 3.6399 7.3987 122.4845 63.2255 37.5978 176.1344 18 T 3.8598 7.6800 116.6047 63.2702 69.9307 174.0704 19 G 3.6920 7.3063 111.8214 44.2210 0.0000 171.3699 20 T 4.6615 7.4669 116.6631 61.7759 70.0022 174.7672 21 W 5.1898 8.7079 124.7558 55.1041 33.9089 173.8510 22 Y 6.0356 10.0655 119.2821 55.4278 41.6265 174.9516 23 N 5.6929 8.8666 119.9154 50.1181 40.3223 175.3666 24 Q 4.1153 8.7088 115.9377 58.0676 28.4510 176.8878 25 L 4.3603 8.1441 117.4097 54.6636 42.4905 177.1059 26 G 3.9579 8.4893 107.2786 45.6811 0.0000 173.8656 27 S 4.6939 8.6587 115.6932 58.3210 64.6707 173.2251 28 T 4.8581 8.7073 119.1425 61.7203 71.2588 173.0914 29 F 5.0624 8.7958 128.5450 56.5746 41.9652 173.8085 30 I 4.3004 8.5851 128.8067 59.5077 39.0868 175.1342 31 V 4.4768 7.8887 127.1099 61.0223 34.8750 174.3823 32 T 4.7520 8.8193 122.9020 61.7010 71.9294 172.8010 33 A 4.8282 8.1452 128.8829 50.0542 19.6059 177.1165 34 G 3.7220 10.0106 112.1524 46.0731 0.0000 173.7364 35 A 4.1509 8.5627 124.4981 54.0295 18.6432 178.0904 36 D 4.5658 8.0866 113.8652 53.2331 40.0422 176.9418 37 G 3.1597 8.3039 108.3456 45.4178 0.0000 173.0470 38 A 4.9503 7.9170 120.3403 50.5780 21.3338 177.0497 39 L 5.2612 8.6703 119.5067 53.1873 45.4671 176.0130 40 T 4.8015 8.9708 113.0431 59.4914 72.3895 174.4951 41 G 4.5087 7.8202 108.5709 46.3263 0.0000 170.9180 42 T 5.0949 7.6310 110.6368 60.1526 72.9078 172.7393 43 Y 5.1837 9.2075 123.5649 55.9564 42.7175 173.3968 44 E 5.4302 9.2842 127.1632 54.6201 32.6468 174.1506 45 S 5.1693 9.2650 121.8384 57.1701 63.0690 174.0631 46 A 4.2402 8.9553 130.1246 54.2073 18.5211 177.3451 47 V 4.3661 7.3607 107.2142 60.1875 35.6958 175.4096 48 G 3.6342 8.5281 107.8854 44.7297 0.0000 174.0983 49 N 4.5407 7.8827 116.1411 51.5500 37.0176 173.5496 50 A 4.8149 7.6597 121.7645 51.7793 22.4699 175.8627 51 E 4.6559 9.2464 115.1377 56.5387 32.2424 177.0977 52 S 3.9111 8.6025 116.7965 57.8765 61.9280 170.1132 53 R 4.7950 8.3551 116.7810 56.5063 30.5646 175.7882 54 Y 4.8522 8.8756 118.7516 56.1491 42.3753 174.9915 55 V 4.1292 8.5567 122.3963 62.6224 32.5809 174.7926 56 L 5.3461 8.0484 126.1102 53.6274 43.9995 175.1708 57 T 4.7384 8.1368 111.4592 61.8689 70.9364 172.7932 58 G 4.7775 8.2902 111.6970 47.2111 0.0000 172.0559 59 R 5.5948 8.4529 117.1767 55.1328 34.9609 173.8286 60 Y 5.2393 8.4056 117.5130 55.5994 41.4126 174.2428 61 D 4.2384 8.5662 121.0939 54.8187 41.3002 176.2295 62 S 4.4999 8.3625 120.1130 58.3164 63.9943 174.7468 63 A 4.6601 8.3292 124.0345 50.6366 19.1334 173.7307 64 P 4.5754 0.0000 0.0000 60.8555 33.1547 177.0372 65 A 4.2509 8.3187 121.6355 52.5740 18.5236 177.4210 66 T 4.5862 8.3151 109.1027 61.4793 69.1209 175.4250 67 D 4.3000 8.0119 120.2354 54.5299 39.7548 176.7609 68 G 4.1135 7.5943 108.5587 45.6495 0.0000 174.2611 69 S 4.3431 8.1157 115.4375 57.9593 63.3875 174.1115 70 G 4.0300 8.3034 109.8886 46.1123 0.0000 172.9940 71 T 4.7770 8.9335 116.9990 61.7310 69.9358 174.9697 72 A 4.7938 8.7311 129.2433 52.2971 20.0517 175.8450 73 L 4.9620 8.8394 120.1488 55.7109 44.6824 173.7319 74 G 5.1406 8.9223 104.6779 45.6749 0.0000 172.1236 75 W 5.7356 8.0916 116.3348 55.8860 31.6382 173.1717 76 T 5.2617 9.1327 116.5699 61.9329 72.5098 173.3949 77 V 4.4700 8.9454 124.0001 61.0930 34.9438 173.6642 78 A 4.6981 8.2702 129.3825 49.3302 20.5989 177.3912 79 W 4.0638 8.7905 126.0966 56.2495 27.8551 176.5833 80 K 5.2417 7.9602 119.7007 54.7229 34.7492 174.4862 81 N 4.9149 8.8186 122.0772 51.9865 39.8379 174.3419 82 N 3.9112 8.4785 114.0098 56.1211 38.7061 175.5352 83 Y 4.4919 7.0793 114.6432 59.1903 39.2685 175.4549 84 R 4.4692 8.8407 114.5822 55.6544 32.4189 172.8094 85 N 5.3224 8.6914 116.2261 51.8936 40.8025 173.8562 86 A 4.1662 9.0081 128.6693 52.5888 19.8324 176.2633 87 H 4.2315 8.9873 113.4415 56.0373 26.7009 173.6640 88 S 5.1858 7.4944 111.5992 57.6915 66.9254 174.1399 89 A 5.1373 8.9504 121.2334 51.0997 22.9718 175.3017 90 T 5.0598 9.2003 116.4851 61.7232 72.7411 173.1892 91 T 4.9004 8.2852 114.9015 59.6058 72.0004 172.6083 92 W 4.8181 8.4190 125.1393 54.8117 31.3364 174.8413 93 S 4.9912 8.5562 119.7382 56.6365 64.9229 172.9842 94 G 4.2771 8.3534 112.8270 46.5736 0.0000 171.7628 95 Q 5.2224 8.5595 118.8654 54.8009 32.7210 173.8297 96 Y 4.5756 9.5456 123.9126 56.9493 40.6721 174.1298 97 V 4.3145 8.3584 126.3056 61.1837 34.5542 175.1826 98 G 3.9680 8.0489 115.5846 44.2428 0.0000 170.0365 99 G 3.8787 9.0162 103.8681 43.9176 0.0000 172.5539 100 A 4.0082 8.8323 121.2096 54.7331 18.1535 177.8457 101 E 4.4559 7.9275 117.7274 54.0569 30.5814 174.6936 102 A 4.7044 8.4686 128.4764 51.7920 19.5363 176.3096 103 R 5.2050 8.9312 116.8424 55.0388 34.0055 173.9431 104 I 4.8278 8.8873 120.8656 59.8027 40.0095 174.3812 105 N 5.3552 8.7470 125.9555 52.0822 40.1301 174.6267 106 T 5.3334 8.7623 112.8114 60.1235 72.6438 173.0751 107 Q 4.9356 9.2755 120.6770 53.8249 32.7788 174.7730 108 W 5.3380 8.5853 118.6541 54.6157 32.4107 173.7703 109 L 5.3190 8.4785 120.2672 52.8996 44.5247 175.3272 110 L 4.9341 9.1848 126.1093 53.8089 44.2569 174.8517 111 T 4.9778 8.6090 123.9282 62.2817 70.5024 174.3054 112 S 5.0845 8.7027 122.0761 56.4065 65.5702 174.2702 113 G 3.9132 8.5805 111.5842 46.4582 0.0000 173.1461 114 T 4.7981 8.2578 114.3641 59.7512 72.4046 173.3083 115 T 4.3048 8.0593 112.0753 60.7645 69.7697 175.5400 116 E 3.9888 8.6746 120.5664 59.1992 29.7319 179.3824 117 A 4.1370 7.4634 121.0893 54.6970 18.5423 177.8114 118 N 4.9652 8.1104 109.4217 52.7064 40.0383 176.0567 119 A 4.0066 7.8235 122.8578 55.0323 18.5550 180.3758 120 F 4.3656 8.4426 110.1339 58.9001 37.9748 175.8396 121 K 4.3423 7.0666 121.0114 56.2123 32.6748 177.1714 122 S 4.3210 7.7787 115.3134 60.4136 63.8348 173.2443 123 T 5.0125 7.6349 117.3695 61.7122 70.7799 173.5476 124 L 4.6931 8.9705 127.3540 53.7189 43.6291 176.2465 125 V 4.4031 7.6611 120.8143 60.2745 34.6558 175.2732 126 G 3.0450 6.4275 106.6270 46.1376 0.0000 171.4404 127 H 5.3327 8.1786 114.0564 54.0707 31.7852 172.5771 128 D 5.3958 9.1225 119.2286 52.9532 44.7389 174.9221 129 T 5.2081 9.6735 118.6536 61.9088 71.7042 172.9182 130 F 5.7085 9.5077 125.5193 56.1244 41.9810 174.9249 131 T 5.6290 9.1930 112.1418 60.2424 73.1473 174.3400 132 K 4.0763 8.5998 119.5302 56.6111 32.2669 176.9362 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 16 G 8.35 4.03 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 0.00 0.00 0.00 17 I 7.40 3.64 1.33 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 -0.36 0.51 0.00 0.00 18 T 7.68 3.86 4.14 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 1.12 0.00 0.00 19 G 7.31 3.69 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 0.00 0.00 0.00 20 T 7.47 4.66 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 0.77 0.00 0.00 21 W 8.71 5.19 0.00 3.27 3.38 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 0.00 0.00 0.00 0.00 22 Y 10.07 6.04 0.00 2.91 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 23 N 8.87 5.69 0.00 2.30 1.42 0.00 0.00 6.48 7.44 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 24 Q 8.71 4.12 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 25 L 8.14 4.36 0.00 1.86 1.79 0.99 1.00 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 26 G 8.49 3.96 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 0.00 0.00 0.00 27 S 8.66 4.69 0.00 4.14 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 28 T 8.71 4.86 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 1.02 0.00 0.00 29 F 8.80 5.06 0.00 2.56 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 30 I 8.59 4.30 1.75 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.41 0.76 0.00 0.00 31 V 7.89 4.48 0.94 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 0.51 0.00 0.00 -0.30 0.00 0.00 32 T 8.82 4.75 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 33 A 8.15 4.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 10.01 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 35 A 8.56 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 36 D 8.09 4.57 0.00 2.76 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 37 G 8.30 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 0.00 0.00 0.00 38 A 7.92 4.95 1.34 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 0.00 0.00 39 L 8.67 5.26 0.00 1.90 1.59 0.76 0.90 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 40 T 8.97 4.80 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 1.22 0.00 0.00 41 G 7.82 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.63 5.09 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 1.31 0.00 0.00 43 Y 9.21 5.18 0.00 3.02 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 44 E 9.28 5.43 0.00 2.11 1.84 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 2.34 2.57 0.00 45 S 9.26 5.17 0.00 4.06 3.79 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 46 A 8.96 4.24 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 47 V 7.36 4.37 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 0.76 0.00 0.00 0.87 0.00 0.00 48 G 8.53 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 N 7.88 4.54 0.00 2.59 2.65 0.00 0.00 6.63 7.96 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 50 A 7.66 4.81 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 51 E 9.25 4.66 0.00 2.03 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 2.27 2.22 0.00 52 S 8.60 3.91 0.00 3.74 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 53 R 8.36 4.80 0.00 1.78 1.89 0.00 3.24 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 54 Y 8.88 4.85 0.00 2.91 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 55 V 8.56 4.13 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 0.81 0.00 0.00 0.95 0.00 0.00 56 L 8.05 5.35 0.00 1.88 1.70 0.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.14 4.74 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 1.26 0.00 0.00 58 G 8.29 4.78 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 59 R 8.45 5.59 0.00 1.75 1.80 0.00 3.34 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 60 Y 8.41 5.24 0.00 3.13 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 61 D 8.57 4.24 0.00 2.68 2.73 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 62 S 8.36 4.50 0.00 3.89 3.43 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 63 A 8.33 4.66 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 64 P 0.00 4.58 0.00 2.27 2.17 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 65 A 8.32 4.25 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 66 T 8.32 4.59 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 67 D 8.01 4.30 0.00 2.80 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 68 G 7.59 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 69 S 8.12 4.34 0.00 3.93 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 70 G 8.30 4.03 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 0.00 0.00 0.00 71 T 8.93 4.78 4.53 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 1.44 0.00 0.00 72 A 8.73 4.79 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 73 L 8.84 4.96 0.00 1.93 1.93 1.28 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.92 5.14 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 0.00 75 W 8.09 5.74 0.00 3.55 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 9.13 5.26 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 1.22 0.00 0.00 77 V 8.95 4.47 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 0.91 0.00 0.00 78 A 8.27 4.70 1.16 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 0.00 0.00 79 W 8.79 4.06 0.00 3.19 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 80 K 7.96 5.24 0.00 1.95 1.73 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.45 7.81 81 N 8.82 4.91 0.00 2.73 2.48 0.00 0.00 6.66 7.11 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 82 N 8.48 3.91 0.00 2.08 2.20 0.00 0.00 6.71 7.46 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 83 Y 7.08 4.49 0.00 2.87 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 84 R 8.84 4.47 0.00 1.95 2.12 0.00 3.10 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 1.61 1.72 0.00 85 N 8.69 5.32 0.00 2.66 2.57 0.00 0.00 6.93 7.96 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 86 A 9.01 4.17 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 87 H 8.99 4.23 0.00 3.34 3.36 0.00 5.64 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 88 S 7.49 5.19 0.00 3.99 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 89 A 8.95 5.14 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 9.20 5.06 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 -0.80 0.00 0.00 91 T 8.29 4.90 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 1.14 0.00 0.00 92 W 8.42 4.82 0.00 1.78 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 0.00 0.00 0.00 93 S 8.56 4.99 0.00 3.82 3.62 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 94 G 8.35 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 0.00 0.00 0.00 0.00 95 Q 8.56 5.22 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 96 Y 9.55 4.58 0.00 2.99 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 97 V 8.36 4.31 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 0.85 0.00 0.00 0.91 0.00 0.00 98 G 8.05 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 99 G 9.02 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 0.00 100 A 8.83 4.01 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 0.00 101 E 7.93 4.46 0.00 1.92 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 2.21 2.23 0.00 102 A 8.47 4.70 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 0.00 103 R 8.93 5.21 0.00 1.97 2.29 0.00 2.79 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 104 I 8.89 4.83 1.80 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.36 1.06 0.00 0.00 105 N 8.75 5.36 0.00 2.65 2.81 0.00 0.00 6.07 7.09 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 0.00 106 T 8.76 5.33 4.51 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 0.00 0.00 0.00 1.44 0.00 0.00 107 Q 9.28 4.94 0.00 1.88 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.71 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 108 W 8.59 5.34 0.00 2.67 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 0.00 0.00 0.00 0.00 109 L 8.48 5.32 0.00 1.55 1.54 0.87 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.18 4.93 0.00 1.49 1.62 0.87 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.61 4.98 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 1.20 0.00 0.00 112 S 8.70 5.08 0.00 3.68 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 0.00 113 G 8.58 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 0.00 114 T 8.26 4.80 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 1.20 0.00 0.00 115 T 8.06 4.30 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 1.21 0.00 0.00 116 E 8.67 3.99 0.00 2.11 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 2.41 2.38 0.00 117 A 7.46 4.14 1.28 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 0.00 0.00 118 N 8.11 4.97 0.00 2.65 2.63 0.00 0.00 6.83 8.51 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 0.00 119 A 7.82 4.01 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 0.00 120 F 8.44 4.37 0.00 3.14 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 0.00 121 K 7.07 4.34 0.00 1.46 1.04 0.00 1.36 0.00 0.00 1.48 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.30 0.94 7.81 122 S 7.78 4.32 0.00 4.20 4.14 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 0.00 123 T 7.63 5.01 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 1.19 0.00 0.00 124 L 8.97 4.69 0.00 1.76 1.82 0.93 0.89 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 0.00 125 V 7.66 4.40 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 0.54 0.00 0.00 0.69 0.00 0.00 126 G 6.43 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 H 8.18 5.33 0.00 3.20 3.13 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.12 5.40 0.00 3.22 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 0.00 0.00 0.00 0.00 129 T 9.67 5.21 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 1.46 0.00 0.00 130 F 9.51 5.71 0.00 2.98 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 9.19 5.63 4.45 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 1.45 0.00 0.00 132 K 8.60 4.08 0.00 1.55 1.46 0.00 1.25 0.00 0.00 0.84 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.55 7.81