NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3422 8.2893 120.3461 54.8200 33.8754 174.6461 2 V 3.8027 7.6670 117.8725 60.0699 32.1537 170.2761 3 V 3.8761 9.1096 126.3276 61.8827 33.1555 176.3086 4 E 4.5045 8.3957 124.7859 56.1672 30.0931 175.2395 5 H 4.2366 7.7146 120.7742 55.3266 30.5859 173.8224 6 P 4.2378 0.0000 0.0000 66.2562 31.1548 178.3963 7 E 4.1294 8.0220 116.3750 59.2758 29.1593 179.2356 8 F 3.5432 8.2173 117.4030 60.1587 38.8663 177.3271 9 L 4.4080 7.7142 118.8128 57.2356 41.6497 179.0995 10 K 4.3357 7.8915 115.9478 56.8783 31.3577 177.3685 11 A 4.1112 7.7036 123.9884 53.4512 18.5109 177.7421 12 G 4.2646 8.5223 111.8201 46.6374 0.0000 174.5962 13 K 4.3014 7.6831 116.1903 57.6503 32.5807 176.9854 14 E 4.7619 7.5965 114.2685 54.5394 31.6965 173.3786 15 P 4.4102 0.0000 0.0000 62.3056 32.3549 177.9746 16 G 3.6990 7.2592 108.2338 44.9981 0.0000 170.5546 17 L 5.0475 7.9209 122.1312 53.2981 44.9504 177.1566 18 Q 4.5206 8.8424 124.2440 54.0332 32.4824 174.4212 19 I 4.7433 7.5642 123.1563 59.1956 41.0199 174.4748 20 W 5.5678 9.2819 123.9185 55.1131 34.1222 173.9402 21 R 4.7337 8.9759 122.5375 54.3112 32.5894 174.9225 22 V 4.2366 8.6258 126.5965 62.8612 31.4518 175.7346 23 E 4.2879 9.1782 127.3862 55.0562 31.4490 174.5309 24 K 3.4348 9.0161 124.5354 57.6540 29.2776 175.2314 25 F 3.9934 7.2842 112.4806 57.7866 37.0180 175.3608 26 D 4.6722 7.5043 116.8853 53.1115 44.5883 173.7704 27 L 4.4421 7.7878 125.5979 54.3046 42.7602 176.4471 28 V 4.6684 8.4716 122.2039 60.3404 35.0355 172.5595 29 P 4.7769 0.0000 0.0000 62.6242 31.8418 176.4043 30 V 3.9146 8.0014 124.3691 61.8326 32.6174 174.0865 31 P 4.3990 0.0000 0.0000 62.5841 32.1332 177.4104 32 T 3.0140 8.7452 113.6818 64.5333 68.3334 175.3393 33 N 4.4488 7.9663 116.9456 54.1121 37.9092 175.3539 34 L 4.5343 8.2530 119.2665 54.5118 41.9925 175.4732 35 Y 3.9652 7.4802 117.3651 59.0609 38.2359 175.6634 36 G 3.6223 8.4623 112.8806 45.4223 0.0000 172.6521 37 D 4.8341 7.0101 119.4377 52.8947 40.9344 175.4946 38 F 4.3670 8.4101 123.9069 55.1929 41.5505 175.3791 39 F 5.7629 9.4657 123.2586 57.1206 39.0359 176.5966 40 T 4.3331 9.4686 114.7482 63.3906 69.8605 175.4940 41 G 4.3009 8.5526 109.9772 46.1711 0.0000 172.7889 42 D 5.5845 8.6027 119.0689 52.5069 46.2869 173.8898 43 A 5.3263 8.5492 120.7971 50.7152 22.0908 175.2475 44 Y 5.3815 9.4669 118.3941 56.2539 42.6081 174.7363 45 V 5.2030 9.5103 119.7375 61.6102 35.3175 174.0950 46 I 5.2569 9.6393 128.0343 59.5030 41.1758 173.9896 47 L 5.2563 9.2302 128.8661 53.3128 44.7682 174.8620 48 K 4.5855 9.0598 129.0255 55.3805 33.7083 175.0874 49 T 4.9752 8.7925 125.6553 62.1514 70.4480 173.9041 50 V 4.3857 8.3683 127.0458 60.7244 34.5122 174.3766 51 Q 4.4419 8.6290 129.0506 55.7688 29.3481 175.4720 52 L 4.3868 8.5437 127.7238 53.7819 42.6774 178.6530 53 R 3.9668 8.4709 118.1362 59.1948 29.5145 177.4624 54 N 4.5145 8.0587 112.9096 53.1006 37.1031 175.5831 55 G 3.9488 7.9755 108.6196 45.7015 0.0000 173.4949 56 N 4.7560 8.2939 118.5811 52.8706 41.1991 173.3802 57 L 5.0526 8.2093 118.5135 52.8689 44.7835 175.9424 58 Q 4.5282 8.8070 122.7791 54.5874 31.5217 173.8308 59 Y 5.4720 8.4012 122.3088 56.4427 41.9972 174.3519 60 D 5.1001 9.0577 122.1144 52.9150 45.1634 174.3337 61 L 5.2907 9.0682 124.8527 53.6594 43.8414 175.4361 62 H 5.5267 9.8301 122.1424 54.0683 31.9113 172.4157 63 Y 5.3106 8.8423 122.6207 55.1745 40.1155 174.3886 64 W 5.0959 9.0500 134.7809 55.8729 32.8457 174.7073 65 L 4.6397 7.9432 127.6785 52.5401 42.8317 176.5230 66 G 3.1203 7.8595 111.1348 45.8501 0.0000 173.6474 67 N 4.3235 8.6075 119.8108 56.3423 39.1200 175.8068 68 E 4.4566 8.1036 114.6389 56.0592 29.8453 176.2599 69 C 4.7974 7.5191 113.3425 57.4666 30.4099 174.4370 70 S 4.4805 8.9179 117.9589 57.9372 64.8860 175.3152 71 Q 4.1449 8.9018 124.0024 58.7208 28.8300 177.7400 72 D 4.2715 8.2447 119.9231 56.3455 39.1370 178.4064 73 E 3.9157 7.9272 119.7232 59.0597 29.1482 179.1267 74 S 4.2635 8.2346 114.5561 61.3643 63.0864 176.8449 75 G 3.5425 8.4474 109.4431 47.2824 0.0000 175.4991 76 A 3.6299 8.0217 123.1903 54.6506 18.3904 179.2204 77 A 4.1067 8.2515 119.2773 55.6236 18.4892 179.7191 78 A 2.9622 7.5288 118.7538 55.0716 18.3256 179.9716 79 I 3.5199 7.5824 118.2242 64.5108 37.1336 178.7102 80 F 4.4711 8.3431 118.9413 60.9936 38.7368 177.9192 81 T 4.0189 8.1487 115.5460 66.5436 68.0746 177.0145 82 V 3.6639 7.6638 120.2292 65.7717 31.3946 178.2867 83 Q 4.1007 8.3483 118.2089 58.9720 28.7595 178.2854 84 L 4.0473 8.4834 120.4602 57.7762 41.0746 179.1404 85 D 4.3360 8.0248 117.3479 57.5492 41.2433 177.9744 86 D 4.4161 7.8833 119.4425 57.7165 40.9947 178.1873 87 Y 4.1455 8.5773 120.2204 59.9938 38.7312 176.7837 88 L 4.4597 8.1711 119.4785 54.5737 43.3392 176.0829 89 N 4.2352 8.6362 112.0460 55.0531 36.6230 175.0816 90 G 4.1427 8.4665 102.0292 46.6479 0.0000 175.4057 91 R 4.1123 7.8769 119.8592 58.5011 30.4020 177.4581 92 A 4.6179 7.7096 118.5394 52.0530 19.4775 177.1729 93 V 4.2574 8.2105 120.1778 61.5065 33.4120 174.9035 94 Q 4.8909 8.6518 127.1219 55.6172 29.9583 174.8893 95 H 4.8515 9.5254 120.8834 53.9139 32.5567 172.4064 96 R 3.3370 8.4975 123.6626 54.5590 31.1429 175.0529 97 E 4.4938 8.2655 126.9878 54.5743 31.8796 175.8453 98 V 3.9994 8.1326 124.7603 61.2471 33.7972 175.0052 99 Q 4.4532 7.5405 127.4995 57.6287 29.0480 176.6249 100 G 4.0098 9.5076 115.0238 45.2450 0.0000 173.2243 101 F 4.8941 7.5936 117.6525 57.0013 39.8875 175.3826 102 E 4.5344 8.3424 119.0832 56.1213 30.5393 177.8976 103 S 4.4905 8.9314 116.6990 57.6361 65.4895 175.0685 104 A 3.9515 8.6291 125.7303 56.0320 17.8677 180.0089 105 T 3.5948 7.9292 113.3039 67.0286 68.3139 176.2863 106 F 3.4485 7.2120 120.5094 61.0745 39.1712 176.8711 107 L 4.1503 8.1000 118.8739 57.5157 41.1831 179.6123 108 G 3.6393 8.2025 105.1395 47.6034 0.0000 175.0529 109 Y 4.5034 6.9799 118.6078 59.6422 37.8378 176.3409 110 F 4.4643 7.2492 118.2618 56.2972 39.1655 175.9147 111 K 4.1284 8.7996 126.3767 59.5150 32.1562 179.1060 112 S 4.3984 8.0252 110.7884 58.1453 63.2137 173.0347 113 G 3.9713 7.6693 109.9552 46.1623 0.0000 173.4495 114 L 3.9268 7.9901 124.5277 53.8957 42.8503 175.6024 115 K 4.3330 8.8425 127.7068 54.7686 35.0042 174.2906 116 Y 5.5382 8.0712 122.9342 56.5075 40.7340 175.2673 117 K 4.7161 9.0444 120.7761 55.2320 36.1148 175.9470 118 K 4.6775 8.3266 123.5948 57.1549 33.2220 175.4456 119 G 3.7071 9.1688 107.3079 44.7893 0.0000 172.1602 120 G 4.4115 8.2788 105.9708 42.6251 0.0000 173.4513 121 V 3.5345 7.8803 121.3287 61.0320 31.8979 176.0839 122 A 4.1274 8.1346 124.6574 51.9007 18.9654 177.3277 123 S 4.2898 8.2571 114.0889 58.0496 63.0654 174.5788 124 G 3.5004 8.3270 113.7648 47.2232 0.0000 174.1476 125 F 4.6835 7.4091 122.9855 58.0930 38.8644 174.9314 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 M 8.29 4.34 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 2 V 7.67 3.80 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.96 0.00 0.00 3 V 9.11 3.88 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 0.04 0.00 0.00 0.61 0.00 0.00 4 E 8.40 4.50 0.00 1.94 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 2.22 2.24 0.00 5 H 7.71 4.24 0.00 3.07 3.04 0.00 5.90 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 P 0.00 4.24 0.00 2.10 2.09 0.00 3.23 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 7 E 8.02 4.13 0.00 1.83 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 2.44 2.44 0.00 8 F 8.22 3.54 0.00 2.72 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 0.00 0.00 0.00 9 L 7.71 4.41 0.00 1.89 1.82 1.07 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.89 4.34 0.00 1.98 1.99 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.66 7.81 11 A 7.70 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.52 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.68 4.30 0.00 1.84 1.95 0.00 1.82 0.00 0.00 1.82 0.00 0.00 3.15 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.57 1.61 7.81 14 E 7.60 4.76 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 15 P 0.00 4.41 0.00 2.04 2.00 0.00 3.74 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 2.01 2.16 0.00 16 G 7.26 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.92 5.05 0.00 1.43 1.44 0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.84 4.52 0.00 1.85 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.51 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 19 I 7.56 4.74 0.81 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.28 0.79 0.00 0.00 20 W 9.28 5.57 0.00 3.28 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 21 R 8.98 4.73 0.00 1.69 1.66 0.00 3.08 0.00 0.00 2.96 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.50 0.00 22 V 8.63 4.24 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 0.87 0.00 0.00 1.16 0.00 0.00 23 E 9.18 4.29 0.00 1.96 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 2.16 2.39 0.00 24 K 9.02 3.43 0.00 1.84 1.81 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.21 1.35 7.81 25 F 7.28 3.99 0.00 3.22 3.09 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 26 D 7.50 4.67 0.00 2.99 2.63 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 27 L 7.79 4.44 0.00 1.06 1.18 -0.04 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.47 4.67 2.26 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 1.15 0.00 0.00 1.02 0.00 0.00 29 P 0.00 4.78 0.00 2.14 2.33 0.00 3.93 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.23 0.00 30 V 8.00 3.91 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 0.76 0.00 0.00 1.02 0.00 0.00 31 P 0.00 4.40 0.00 2.24 1.98 0.00 3.74 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 32 T 8.75 3.01 3.82 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 0.95 0.00 0.00 33 N 7.97 4.45 0.00 2.78 2.91 0.00 0.00 5.93 7.79 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 34 L 8.25 4.53 0.00 1.79 1.62 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 7.48 3.97 0.00 2.88 2.95 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 0.00 0.00 0.00 36 G 8.46 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 0.00 0.00 0.00 37 D 7.01 4.83 0.00 2.34 2.34 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 38 F 8.41 4.37 0.00 2.52 2.24 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 39 F 9.47 5.76 0.00 3.42 3.33 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 40 T 9.47 4.33 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 1.43 0.00 0.00 41 G 8.55 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 0.00 0.00 0.00 42 D 8.60 5.58 0.00 2.79 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 43 A 8.55 5.33 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 44 Y 9.47 5.38 0.00 3.47 3.33 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 45 V 9.51 5.20 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 1.16 0.00 0.00 1.15 0.00 0.00 46 I 9.64 5.26 2.43 0.00 0.00 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 1.75 0.74 1.13 0.00 0.00 47 L 9.23 5.26 0.00 2.06 1.90 1.16 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 48 K 9.06 4.59 0.00 1.36 1.60 0.00 1.46 0.00 0.00 0.82 0.00 0.00 2.68 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.90 1.28 7.81 49 T 8.79 4.98 4.49 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 1.24 0.00 0.00 50 V 8.37 4.39 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 0.77 0.00 0.00 0.93 0.00 0.00 51 Q 8.63 4.44 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 52 L 8.54 4.39 0.00 2.00 1.55 0.93 0.74 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 53 R 8.47 3.97 0.00 1.91 2.06 0.00 3.03 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 54 N 8.06 4.51 0.00 2.83 2.96 0.00 0.00 6.16 7.00 0.00 0.00 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 G 7.98 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.29 4.76 0.00 2.82 2.73 0.00 0.00 6.83 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 57 L 8.21 5.05 0.00 1.03 1.00 1.01 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.81 4.53 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 59 Y 8.40 5.47 0.00 3.04 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 60 D 9.06 5.10 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 61 L 9.07 5.29 0.00 1.73 1.76 0.98 0.93 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 62 H 9.83 5.53 0.00 3.15 2.90 0.00 5.58 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.84 5.31 0.00 3.19 3.14 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 64 W 9.05 5.10 0.00 3.34 3.30 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 65 L 7.94 4.64 0.00 1.27 1.36 0.90 0.97 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 66 G 7.86 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.61 4.32 0.00 2.57 2.80 0.00 0.00 7.00 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.10 4.46 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 69 C 7.52 4.80 0.00 3.26 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 70 S 8.92 4.48 0.00 4.20 4.07 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 71 Q 8.90 4.14 0.00 2.23 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.93 0.00 0.00 0.00 0.00 0.00 2.57 2.34 0.00 72 D 8.24 4.27 0.00 2.02 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 7.93 3.92 0.00 2.18 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 2.26 2.19 0.00 74 S 8.23 4.26 0.00 4.09 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 0.00 75 G 8.45 3.54 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 0.00 0.00 0.00 76 A 8.02 3.63 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 77 A 8.25 4.11 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.53 2.96 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 79 I 7.58 3.52 1.49 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.61 0.70 0.00 0.00 80 F 8.34 4.47 0.00 3.22 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 81 T 8.15 4.02 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 1.35 0.00 0.00 82 V 7.66 3.66 2.18 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 1.02 0.00 0.00 1.01 0.00 0.00 83 Q 8.35 4.10 0.00 2.56 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.55 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 84 L 8.48 4.05 0.00 1.64 1.62 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.02 4.34 0.00 2.99 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 86 D 7.88 4.42 0.00 2.92 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 87 Y 8.58 4.15 0.00 3.34 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 88 L 8.17 4.46 0.00 1.65 1.48 0.09 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.64 4.24 0.00 2.89 2.90 0.00 0.00 6.86 7.81 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 90 G 8.47 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 0.00 0.00 0.00 91 R 7.88 4.11 0.00 2.07 2.14 0.00 3.24 0.00 0.00 3.38 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.86 0.00 92 A 7.71 4.62 1.38 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 0.00 0.00 93 V 8.21 4.26 2.17 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 0.88 0.00 0.00 1.01 0.00 0.00 94 Q 8.65 4.89 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.45 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 95 H 9.53 4.85 0.00 2.87 3.07 0.00 5.60 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.50 3.34 0.00 1.55 1.65 0.00 3.26 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.15 0.00 97 E 8.27 4.49 0.00 1.66 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 1.86 1.47 0.00 98 V 8.13 4.00 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 0.87 0.00 0.00 0.79 0.00 0.00 99 Q 7.54 4.45 0.00 1.47 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.30 0.00 0.00 0.00 0.00 0.00 2.04 1.65 0.00 100 G 9.51 4.01 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 0.00 0.00 0.00 101 F 7.59 4.89 0.00 2.95 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 0.00 102 E 8.34 4.53 0.00 2.12 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 0.00 2.83 2.85 0.00 103 S 8.93 4.49 0.00 4.10 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 0.00 104 A 8.63 3.95 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 0.00 105 T 7.93 3.59 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 1.09 0.00 0.00 106 F 7.21 3.45 0.00 2.84 3.19 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 0.00 107 L 8.10 4.15 0.00 1.85 1.64 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.20 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 0.00 109 Y 6.98 4.50 0.00 2.12 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 0.00 0.00 0.00 0.00 110 F 7.25 4.46 0.00 2.93 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 0.00 111 K 8.80 4.13 0.00 1.81 1.83 0.00 1.62 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.40 7.81 112 S 8.03 4.40 0.00 3.95 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 0.00 113 G 7.67 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 0.00 114 L 7.99 3.93 0.00 1.07 1.16 0.35 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.84 4.33 0.00 1.61 1.56 0.00 1.56 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.21 1.25 7.81 116 Y 8.07 5.54 0.00 2.94 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 0.00 117 K 9.04 4.72 0.00 1.73 1.77 0.00 0.78 0.00 0.00 1.31 0.00 0.00 2.20 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.13 0.74 7.81 118 K 8.33 4.68 0.00 1.77 1.90 0.00 1.86 0.00 0.00 2.55 0.00 0.00 2.78 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.31 7.81 119 G 9.17 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 0.00 120 G 8.28 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 0.00 121 V 7.88 3.53 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.86 0.00 0.00 122 A 8.13 4.13 1.23 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 0.00 123 S 8.26 4.29 0.00 3.83 3.80 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 0.00 124 G 8.33 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 0.00 0.00 0.00 125 F 7.41 4.68 0.00 3.08 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