NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2502 8.2033 119.6913 56.6806 30.0721 174.4886 2 E 3.6809 9.2106 116.8741 55.1940 26.8368 171.7507 3 G 3.0345 6.7264 108.3317 45.1071 0.0000 172.1592 4 D 4.6217 8.3024 126.0566 52.2768 41.9198 173.9618 5 P 4.3918 0.0000 0.0000 66.4466 31.0980 178.0862 6 E 3.9151 8.3674 116.7713 58.1547 29.5216 178.7471 7 A 4.3325 7.8959 121.0968 54.6895 19.0606 179.7448 8 G 3.6602 8.2635 104.1162 47.6097 0.0000 175.6636 9 A 2.6055 7.8798 123.3358 54.6704 18.1005 179.4767 10 K 3.7590 7.8738 115.7759 59.6108 32.5025 178.3010 11 A 4.1017 7.7792 120.5024 55.2700 18.3566 179.1680 12 F 4.0683 8.8779 119.2141 61.5378 39.2552 177.0500 13 N 4.2277 7.8328 115.7690 56.6342 38.2254 176.9797 14 Q 4.0956 7.6597 116.8591 59.3971 28.6645 178.2610 15 C 3.8260 8.2312 119.2322 62.0589 26.7008 175.3255 16 Q 4.6108 7.8039 120.7949 57.5738 28.0271 178.3137 17 T 4.0982 7.4502 115.5892 65.4738 68.9299 174.6316 18 C 4.6009 7.4392 113.9897 60.3443 32.3810 174.0202 19 H 5.2710 8.4523 115.5731 54.5313 31.4807 174.3673 20 V 4.9396 8.0718 116.9426 60.9278 34.9007 172.8908 21 I 4.8851 9.7509 123.9547 59.6824 39.7165 174.9317 22 V 5.3820 8.7001 126.4601 60.1353 34.7266 174.7834 23 D 3.3700 8.1155 127.0427 51.9884 40.2422 176.5219 24 D 4.5619 8.1929 118.3739 56.2198 40.9170 178.1082 25 S 4.1680 7.7379 113.9066 61.1237 63.5206 174.7130 26 G 3.9960 7.5243 107.6956 45.3895 0.0000 173.2166 27 T 4.4236 8.4623 117.6461 61.8430 69.9360 174.2502 28 T 4.6382 8.3060 122.6345 63.4020 69.1445 174.6833 29 I 4.1460 8.4574 126.9619 61.9747 38.4004 176.0651 30 A 4.3120 7.4098 119.0412 51.2933 21.4590 174.9178 31 G 4.5321 8.1899 107.8111 43.5043 0.0000 172.9994 32 R 4.5461 7.6804 117.5734 56.1631 31.3378 175.2343 33 N 4.0402 8.2932 110.3769 54.5076 37.3523 173.3720 34 A 4.6015 7.7773 119.1398 50.9024 20.7101 177.5678 35 K 4.5998 8.4261 120.2751 56.2163 33.3416 177.2230 36 T 3.9794 8.1859 117.1956 65.8177 68.4244 173.4493 37 G 3.8835 7.7344 108.2826 42.2579 0.0000 170.1733 38 P 3.9675 0.0000 0.0000 61.4538 31.9939 175.5536 39 N 4.5789 8.4151 118.4124 53.8222 39.3293 174.8531 40 L 4.2044 8.7823 124.9284 55.2973 42.1895 176.0378 41 Y 4.1680 9.1951 123.0926 58.8934 38.7886 175.9248 42 G 3.5826 7.8888 115.4942 45.2606 0.0000 174.4104 43 V 3.6367 7.6122 121.3282 64.1276 31.4753 176.8646 44 V 3.7977 7.3667 120.4207 64.0256 31.3390 175.9384 45 G 3.9850 9.1578 115.4633 45.6160 0.0000 173.1380 46 R 4.4115 8.0082 120.5922 55.7842 31.8573 175.4143 47 T 4.7149 8.4178 120.5044 62.7578 69.4874 174.4164 48 A 4.0487 8.4003 127.9395 52.9401 19.3169 177.8234 49 G 2.4543 8.7708 111.9224 46.8037 0.0000 173.8566 50 T 4.5684 7.6061 103.2355 60.5775 70.5238 173.6310 51 Q 4.1218 8.6775 124.7021 56.2995 29.2817 176.4209 52 A 4.1325 9.0618 129.2060 55.7019 18.6042 178.1957 53 D 4.5014 8.2098 114.1237 57.0165 41.2733 177.0938 54 F 4.3274 7.8188 121.1374 58.4859 39.4372 174.6676 55 K 4.4194 8.1364 126.4037 56.0599 32.3675 176.3911 56 G 3.7386 5.4007 106.1134 45.0178 0.0000 173.3864 57 Y 4.5818 7.6980 116.9180 57.6370 38.7177 177.0570 58 G 4.1006 8.7852 110.0425 44.0579 0.0000 174.8093 59 E 4.2092 8.7506 119.3970 59.0913 29.3936 179.9770 60 G 3.6447 7.7305 106.1326 48.0948 0.0000 175.3514 61 M 4.2048 8.2447 120.7208 58.2244 32.2785 178.3711 62 K 3.9352 8.0139 117.9640 59.6769 32.2234 179.3687 63 E 4.0129 8.5006 118.7172 59.2619 29.4416 179.2878 64 A 4.3642 8.6884 121.5216 54.6744 18.4047 179.9386 65 G 3.7258 8.1310 105.5921 47.1178 0.0000 175.9133 66 A 4.1690 7.9300 121.7411 54.0930 18.4294 178.9644 67 K 4.2492 7.3409 114.1470 56.1024 32.4186 176.9414 68 G 4.0973 7.7047 109.9857 45.3489 0.0000 173.1991 69 L 4.2445 7.8147 121.5504 53.5025 43.6432 175.5073 70 A 5.2679 7.9136 126.8429 49.3205 21.3081 174.6834 71 W 4.5657 7.7550 121.5159 57.5302 29.6863 175.3608 72 D 5.1611 8.4241 123.7164 50.4410 42.3377 176.0858 73 E 2.5400 7.8121 119.5901 59.5456 29.4010 178.3813 74 E 3.7313 8.1509 117.4668 60.7950 29.7500 178.7523 75 H 4.4033 8.8463 115.4746 58.4788 28.9633 177.8309 76 F 4.3814 8.2976 122.8375 61.5007 37.6654 177.4146 77 V 3.3585 7.8292 117.6948 65.9300 31.0066 177.8968 78 Q 4.2839 7.3868 115.6116 58.3964 28.3216 177.6010 79 Y 3.8711 7.3196 120.6072 60.5074 38.8663 177.5576 80 V 3.5442 7.2604 111.3483 62.8276 31.3840 177.8766 81 Q 4.1868 6.9552 117.9309 56.3763 30.1407 175.1825 82 D 4.3934 7.5518 112.7092 51.2016 43.0910 173.7952 83 P 3.7395 0.0000 0.0000 65.5594 31.2421 177.2204 84 T 3.9853 7.8082 115.9775 67.1629 69.0536 175.8045 85 K 4.0384 9.0803 121.3786 59.3450 32.2760 178.0913 86 F 4.0595 8.6394 121.0155 61.8498 39.2448 177.6048 87 L 4.1499 9.1594 118.2652 57.3993 41.2996 179.9463 88 K 4.0933 8.4748 119.1595 59.7474 31.9511 178.6487 89 E 3.8748 8.1171 116.7616 59.8990 29.4795 178.2790 90 Y 3.9173 7.6887 119.4959 61.0334 38.8646 178.1815 91 T 3.9226 7.5227 113.2775 62.7436 67.6048 175.6548 92 G 3.8331 8.4050 108.6699 44.9401 0.0000 172.4624 93 D 4.6212 7.6005 118.9665 52.7358 42.0048 175.9961 94 A 4.2338 8.6438 129.1543 53.5136 18.7935 177.5635 95 K 4.5308 9.2634 115.7044 56.2393 32.9335 176.3802 96 A 4.3949 7.8568 120.2981 52.5492 18.2709 177.6220 97 K 4.6836 8.6823 119.9079 54.5860 36.0764 175.1367 98 G 4.5958 8.8555 112.2094 44.7149 0.0000 173.1070 99 K 4.4881 8.9309 120.1204 56.5489 33.0406 177.3126 100 M 4.3415 7.9960 118.8986 55.4529 30.9571 176.1360 101 T 4.3758 8.0375 119.9998 59.3877 67.7436 174.2566 102 F 4.8047 7.2865 123.3702 57.6959 42.8333 173.2415 103 K 4.0348 6.6701 124.3757 54.3357 35.3054 175.7903 104 L 4.0608 8.9629 128.1681 53.7507 42.1954 177.3978 105 K 3.8466 8.5513 126.2583 59.3745 32.2142 178.6281 106 K 4.1402 7.8261 119.0171 56.1108 33.0038 177.7663 107 E 4.1194 8.8580 124.6514 58.9481 29.7151 178.7166 108 A 4.0945 7.9924 120.6097 55.2029 18.4951 178.7125 109 D 4.4220 8.2884 116.8833 57.8013 40.8334 178.8636 110 A 4.1237 7.6157 119.3162 56.0512 18.2456 179.3561 111 H 4.3683 8.0489 114.1053 59.1988 28.7271 177.9587 112 N 4.4981 8.4742 118.3060 56.3099 38.4112 177.5182 113 I 3.8583 8.2916 121.5123 64.3257 37.2537 178.0309 114 W 3.9018 8.9733 129.3581 60.4773 30.2962 177.7899 115 A 3.8109 7.9680 120.5467 55.4034 17.9380 178.8560 116 Y 4.0556 7.9151 118.0164 60.9027 38.7226 178.4793 117 L 3.4179 8.1861 120.1112 57.7086 41.4119 179.5553 118 Q 3.6255 7.3393 117.1460 58.5509 28.5776 178.1433 119 Q 4.0134 7.7199 119.9202 57.7732 29.2056 176.7192 120 V 4.1000 7.3303 110.3387 60.6085 34.5495 175.5381 121 A 4.5163 7.8678 123.2786 51.5873 18.8555 176.9309 122 V 3.7250 7.1208 121.1125 60.8217 32.6995 174.7817 123 R 3.8330 7.9690 128.5627 55.3302 30.0259 174.5527 124 P 4.3835 0.0000 0.0000 63.1801 31.0868 176.0863 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 Q 8.20 4.25 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.34 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 2 E 9.21 3.68 0.00 2.23 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 0.00 2.22 2.38 0.00 3 G 6.73 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 0.00 0.00 0.00 4 D 8.30 4.62 0.00 2.75 2.61 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 5 P 0.00 4.39 0.00 2.47 2.35 0.00 3.80 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 6 E 8.37 3.92 0.00 2.09 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 0.00 2.33 2.46 0.00 7 A 7.90 4.33 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 8.26 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 9 A 7.88 2.61 0.58 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 10 K 7.87 3.76 0.00 1.71 1.98 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.50 7.81 11 A 7.78 4.10 1.46 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 0.00 0.00 0.00 12 F 8.88 4.07 0.00 3.24 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 N 7.83 4.23 0.00 3.07 2.84 0.00 0.00 6.62 7.62 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 14 Q 7.66 4.10 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.03 0.00 0.00 0.00 0.00 0.00 2.68 2.29 0.00 15 C 8.23 3.83 0.00 1.69 2.54 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 0.00 0.00 0.00 16 Q 7.80 4.61 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.84 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 17 T 7.45 4.10 4.05 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 1.13 0.00 0.00 18 C 7.44 4.60 0.00 2.50 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 19 H 8.45 5.27 0.00 2.89 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.07 4.94 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 1.05 0.00 0.00 21 I 9.75 4.89 2.05 0.00 0.00 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 1.06 0.78 0.93 0.00 0.00 22 V 8.70 5.38 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.92 0.00 0.00 23 D 8.12 3.37 0.00 2.46 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 0.00 0.00 0.00 24 D 8.19 4.56 0.00 2.70 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 25 S 7.74 4.17 0.00 3.92 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.52 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 27 T 8.46 4.42 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 1.16 0.00 0.00 28 T 8.31 4.64 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 29 I 8.46 4.15 1.82 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 1.15 0.33 0.85 0.00 0.00 30 A 7.41 4.31 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.19 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 0.00 0.00 0.00 0.00 32 R 7.68 4.55 0.00 1.74 1.88 0.00 3.33 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 33 N 8.29 4.04 0.00 2.81 2.82 0.00 0.00 7.12 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 34 A 7.78 4.60 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 35 K 8.43 4.60 0.00 1.74 1.86 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.43 7.81 36 T 8.19 3.98 4.18 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 1.21 0.00 0.00 37 G 7.73 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 38 P 0.00 3.97 0.00 1.99 0.94 0.00 3.35 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 39 N 8.42 4.58 0.00 2.75 3.01 0.00 0.00 7.04 7.78 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 40 L 8.78 4.20 0.00 1.81 1.60 1.14 0.25 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 41 Y 9.20 4.17 0.00 2.81 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 42 G 7.89 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 43 V 7.61 3.64 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.68 0.00 0.00 44 V 7.37 3.80 1.78 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 0.60 0.00 0.00 0.12 0.00 0.00 45 G 9.16 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 0.00 0.00 0.00 46 R 8.01 4.41 0.00 2.19 2.10 0.00 3.25 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 47 T 8.42 4.71 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 48 A 8.40 4.05 1.05 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 49 G 8.77 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.61 4.57 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 1.28 0.00 0.00 51 Q 8.68 4.12 0.00 2.45 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.71 0.00 52 A 9.06 4.13 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 53 D 8.21 4.50 0.00 2.78 2.81 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 54 F 7.82 4.33 0.00 2.89 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 55 K 8.14 4.42 0.00 1.56 1.64 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.29 7.81 56 G 5.40 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 57 Y 7.70 4.58 0.00 3.10 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.79 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 59 E 8.75 4.21 0.00 2.05 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 0.00 2.45 2.36 0.00 60 G 7.73 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 61 M 8.24 4.20 0.00 2.36 2.35 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 3.04 0.00 62 K 8.01 3.94 0.00 1.90 1.84 0.00 2.01 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.70 7.81 63 E 8.50 4.01 0.00 2.08 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 2.34 2.55 0.00 64 A 8.69 4.36 1.51 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 65 G 8.13 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 0.00 0.00 0.00 66 A 7.93 4.17 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 67 K 7.34 4.25 0.00 1.99 1.73 0.00 1.52 0.00 0.00 1.44 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.38 7.81 68 G 7.70 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 69 L 7.81 4.24 0.00 1.53 1.27 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.91 5.27 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 71 W 7.75 4.57 0.00 3.63 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 72 D 8.42 5.16 0.00 2.82 2.74 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 73 E 7.81 2.54 0.00 1.55 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 2.33 2.14 0.00 74 E 8.15 3.73 0.00 2.06 2.13 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 2.30 2.43 0.00 75 H 8.85 4.40 0.00 3.21 3.32 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.30 4.38 0.00 2.94 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 77 V 7.83 3.36 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 0.90 0.00 0.00 0.79 0.00 0.00 78 Q 7.39 4.28 0.00 2.45 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.75 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 79 Y 7.32 3.87 0.00 2.50 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 80 V 7.26 3.54 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 0.38 0.00 0.00 0.62 0.00 0.00 81 Q 6.96 4.19 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.18 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 82 D 7.55 4.39 0.00 2.59 2.47 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 0.00 83 P 0.00 3.74 0.00 2.08 1.61 0.00 3.52 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.43 0.00 84 T 7.81 3.99 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 85 K 9.08 4.04 0.00 2.04 1.93 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.47 7.81 86 F 8.64 4.06 0.00 3.46 3.50 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 0.00 0.00 0.00 0.00 87 L 9.16 4.15 0.00 2.04 1.88 1.31 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.47 4.09 0.00 1.96 1.85 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.49 1.70 7.81 89 E 8.12 3.87 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 90 Y 7.69 3.92 0.00 2.30 2.54 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 0.00 0.00 0.00 91 T 7.52 3.92 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 1.31 0.00 0.00 92 G 8.40 3.83 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 0.00 0.00 0.00 93 D 7.60 4.62 0.00 2.63 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 94 A 8.64 4.23 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 95 K 9.26 4.53 0.00 1.75 1.87 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.35 7.81 96 A 7.86 4.39 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 97 K 8.68 4.68 0.00 1.89 1.66 0.00 1.61 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.55 7.81 98 G 8.86 4.60 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 99 K 8.93 4.49 0.00 1.93 1.98 0.00 2.06 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.54 7.81 100 M 8.00 4.34 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 101 T 8.04 4.38 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 1.30 0.00 0.00 102 F 7.29 4.80 0.00 2.88 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 0.00 103 K 6.67 4.03 0.00 1.37 1.38 0.00 1.67 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.23 7.81 104 L 8.96 4.06 0.00 1.67 1.62 1.06 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.55 3.85 0.00 1.72 1.80 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.33 7.81 106 K 7.83 4.14 0.00 2.08 1.82 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.49 7.81 107 E 8.86 4.12 0.00 2.10 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 2.45 2.50 0.00 108 A 7.99 4.09 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 0.00 109 D 8.29 4.42 0.00 2.96 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 0.00 110 A 7.62 4.12 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 0.00 111 H 8.05 4.37 0.00 3.41 3.48 0.00 5.62 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 0.00 112 N 8.47 4.50 0.00 2.97 3.16 0.00 0.00 6.95 7.01 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 0.00 113 I 8.29 3.86 2.40 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.15 1.30 0.00 0.00 114 W 8.97 3.90 0.00 3.41 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.97 3.81 1.47 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 0.00 0.00 0.00 116 Y 7.92 4.06 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 0.00 117 L 8.19 3.42 0.00 1.08 1.00 0.51 0.71 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 0.00 118 Q 7.34 3.63 0.00 1.81 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.02 0.00 0.00 0.00 0.00 0.00 1.76 1.38 0.00 119 Q 7.72 4.01 0.00 1.94 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 120 V 7.33 4.10 1.77 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 0.35 0.00 0.00 -0.01 0.00 0.00 121 A 7.87 4.52 0.98 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 0.00 122 V 7.12 3.73 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 0.68 0.00 0.00 0.67 0.00 0.00 123 R 7.97 3.83 0.00 1.46 1.70 0.00 3.30 0.00 0.00 3.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 124 P 0.00 4.38 0.00 2.20 2.01 0.00 3.88 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00