NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 G 3.8996 8.3431 109.7451 44.7569 0.0000 172.7251 15 G 3.8899 7.7975 109.6268 44.6066 0.0000 170.4115 16 D 4.5180 8.1556 118.0660 55.9247 42.9333 174.8523 17 T 4.2200 7.6081 108.7446 60.9601 69.8336 174.8044 18 I 3.8125 8.3457 121.3786 64.6586 37.0425 178.3658 19 F 4.4648 8.8129 118.0353 59.4942 38.8460 177.9397 20 G 3.6466 8.0565 106.1284 47.3725 0.0000 176.1489 21 K 4.0230 7.8961 120.3084 59.3079 32.2290 179.3501 22 I 3.5946 7.6999 120.1628 64.1901 36.7782 178.5109 23 I 3.7553 7.4253 119.3271 63.3885 36.8757 177.4402 24 R 4.5305 7.6160 117.3582 55.7628 31.1093 176.0581 25 K 3.8767 7.5307 114.4104 57.1123 30.7171 175.9507 26 E 4.0299 8.4442 120.9686 58.8267 29.6202 177.0860 27 I 4.4419 7.2746 117.5727 58.4982 39.4537 174.0070 28 P 4.4779 0.0000 0.0000 62.7596 32.6725 174.9237 29 A 4.3345 7.6338 117.1508 51.5066 21.1733 177.0909 30 K 4.2177 8.2624 123.2387 55.1350 30.7139 174.4368 31 I 4.1870 7.8427 123.3825 61.2322 37.5134 176.1738 32 I 4.0419 8.6531 127.8189 63.8148 37.8652 176.1604 33 F 4.9936 7.9287 121.3611 57.4524 42.5740 172.6612 34 E 5.0384 7.1528 120.0695 55.7184 32.4583 173.6041 35 D 4.3630 7.9868 118.9680 52.6368 42.2655 174.8622 36 D 4.4645 8.7581 117.8935 56.0101 39.4829 177.3246 37 R 4.4410 8.2593 117.8220 57.0419 31.8576 174.9087 38 C 5.2857 9.2402 111.9621 57.1705 34.1128 172.7990 39 L 5.2303 9.1967 119.9086 53.5772 45.4891 174.2341 40 A 5.6065 9.5445 128.4452 50.1781 21.6274 175.0565 41 F 5.3281 8.6538 116.6711 55.2337 41.8079 174.0262 42 H 4.6252 8.3812 117.5251 56.0082 29.3714 174.6534 43 D 4.5549 8.5382 121.6918 53.2865 41.7500 176.8245 44 I 4.0319 8.3346 118.8828 62.6619 38.5219 176.2222 45 S 4.6614 8.6068 117.1456 55.8265 63.1507 171.7446 46 P 4.3112 0.0000 0.0000 63.4376 31.6739 177.2328 47 Q 4.3983 9.0285 120.2969 55.7984 29.5443 174.5630 48 A 4.6753 7.4525 119.2989 49.9700 22.4595 174.3465 49 P 4.4094 0.0000 0.0000 65.9913 31.7438 177.4523 50 T 4.5079 8.0608 120.4368 62.2710 70.1875 173.3941 51 H 5.4309 8.8237 126.9990 54.4116 32.9943 171.8610 52 F 5.3982 8.9948 120.5996 54.9860 41.7514 173.7841 53 L 5.1018 8.4423 118.9521 52.8745 45.4699 175.9613 54 V 4.8271 8.8763 121.7411 61.2989 34.3898 174.2601 55 I 5.2404 8.8172 121.8522 58.5126 40.5714 173.5857 56 P 5.0851 0.0000 0.0000 61.9956 32.5791 176.4468 57 K 4.2176 8.7753 120.1205 58.7385 32.2994 178.2637 58 K 4.1979 7.8463 117.3885 56.1654 33.4932 176.3143 59 H 4.4213 8.7487 121.7726 55.9277 29.2537 174.0965 60 I 4.5180 8.0035 128.1889 59.3583 39.3998 177.1444 61 S 4.6615 8.9350 119.6669 59.8289 63.8092 174.0266 62 Q 4.5794 7.5817 116.5564 53.9921 31.4563 175.2926 63 I 3.7363 8.4572 119.3830 63.7723 38.2548 177.9772 64 S 4.3762 8.4628 114.2826 60.2966 63.1820 175.3598 65 V 3.9057 7.3705 112.7847 61.6552 31.7901 176.2464 66 A 4.1065 7.3617 122.8531 52.0189 18.9922 177.4369 67 E 4.4724 8.6254 121.8249 55.1377 30.8974 177.5029 68 D 4.5365 8.4280 118.9776 56.9770 41.1149 178.8619 69 D 4.3483 8.0482 118.4159 57.1225 41.1462 177.1516 70 D 4.7773 8.0713 117.6187 54.3010 40.6607 177.8139 71 E 3.9331 7.8482 123.2102 59.7148 29.6081 179.1891 72 S 4.1799 8.0172 114.5043 61.1371 63.0240 176.2318 73 L 4.0358 7.8703 122.9395 57.8863 42.0270 178.8981 74 L 4.1225 8.2995 119.3378 57.8287 41.6444 179.6035 75 G 3.7277 8.3882 105.8824 47.9793 0.0000 175.2330 76 H 4.2313 8.4399 120.5137 59.1866 29.8591 177.2112 77 L 3.9797 8.0139 120.8114 58.2236 41.4189 179.5761 78 M 4.0692 7.9740 117.9673 58.4955 31.9486 178.8539 79 I 3.6906 8.0942 120.4086 64.4267 37.1787 178.7271 80 V 3.4296 8.1351 119.6125 65.4313 31.2474 178.1581 81 G 3.7396 8.2926 106.2958 47.8614 0.0000 175.7126 82 K 3.9072 8.2294 122.1142 59.1919 32.3381 179.2968 83 K 3.8620 7.7945 119.4642 59.5185 32.0372 179.0578 84 C 3.8329 8.2135 117.0059 62.6007 27.8827 175.8815 85 A 4.0900 8.1807 122.1163 55.4230 17.7203 179.6510 86 A 3.6996 7.8624 118.7147 55.2060 18.2090 179.3270 87 D 4.4603 8.0781 116.4638 56.0385 41.0291 177.2666 88 L 4.4205 7.9984 118.5331 53.7792 41.6163 176.4790 89 G 4.0003 7.5531 105.8593 46.7489 0.0000 174.8619 90 L 4.4778 8.5173 118.3891 53.7069 40.9675 178.7826 91 N 4.4657 8.0758 116.3085 55.4418 37.6332 176.3199 92 K 4.0913 8.5158 116.6374 56.8915 32.6750 176.0617 93 G 4.0890 6.6586 104.3915 43.4119 0.0000 171.1993 94 Y 4.8000 6.9251 117.4444 56.7555 40.3531 173.1110 95 R 4.7645 9.0354 119.3604 55.0270 33.8522 173.2715 96 M 5.7318 8.7483 124.6308 53.0619 34.5890 175.4434 97 V 4.5087 8.2354 121.6857 61.1658 35.4076 173.7763 98 V 4.7269 8.5180 126.6916 61.1732 34.0431 174.1214 99 N 4.8261 8.7137 124.6791 51.5471 40.2917 173.8242 100 E 4.5489 8.6265 123.4374 55.3299 32.5043 176.1739 101 G 4.3242 8.8415 114.8785 47.1552 0.0000 172.1144 102 S 4.1165 8.1780 110.9003 61.9866 63.4129 175.9681 103 D 4.3355 8.1957 123.2467 57.6105 40.9717 178.6615 104 G 3.8962 7.4755 105.3655 45.5983 0.0000 173.0570 105 G 3.6106 8.5157 107.7714 46.5217 0.0000 173.4097 106 Q 4.4532 7.8448 119.1810 53.9257 30.9146 174.6102 107 S 4.3062 8.3026 118.2126 59.2239 65.0375 174.2636 108 V 3.6244 7.1790 121.0550 61.5508 30.2040 175.3105 109 Y 4.5219 7.8016 126.8444 55.1347 35.8493 173.6715 110 H 4.6681 7.9214 114.3860 54.8322 33.1212 173.3593 111 V 3.7064 8.6022 127.4468 63.9481 31.8360 175.1307 112 H 5.0606 8.4022 120.9561 54.6841 31.3620 172.5750 113 L 4.3867 9.2452 126.2797 54.5397 43.4190 174.9029 114 H 5.0580 9.2501 124.5225 54.8676 30.6710 174.3851 115 V 4.5962 8.5976 122.8813 60.8827 34.1511 174.1503 116 L 5.1628 9.1999 127.4862 53.3230 45.7480 176.0654 117 G 3.9449 9.6092 108.8854 46.1718 0.0000 172.6781 118 G 4.3420 9.5105 113.8092 45.2613 0.0000 173.9818 119 R 4.5822 7.2065 113.8356 52.9842 32.1136 175.0350 120 Q 4.0908 8.3717 119.3546 56.2013 29.5737 174.8122 121 M 4.4167 8.3894 124.3744 54.2982 33.6478 175.4795 122 H 5.0445 8.3965 119.4361 54.2188 30.9046 174.1030 123 W 4.8194 8.4113 130.4308 54.6521 32.9018 173.6452 124 P 2.9700 0.0000 0.0000 61.4754 31.9652 174.7626 125 P 4.2983 0.0000 0.0000 61.6003 30.2046 176.5670 126 G 3.9041 7.6104 110.7116 46.3704 0.0000 172.0882 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 14 G 8.34 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 0.00 0.00 0.00 15 G 7.80 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.16 4.52 0.00 2.71 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 17 T 7.61 4.22 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 1.32 0.00 0.00 18 I 8.35 3.81 2.38 0.00 0.00 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 1.71 0.66 1.05 0.00 0.00 19 F 8.81 4.46 0.00 2.89 2.96 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 20 G 8.06 3.65 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 0.00 0.00 0.00 21 K 7.90 4.02 0.00 1.92 1.85 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.54 7.81 22 I 7.70 3.59 1.41 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 0.20 0.00 0.00 23 I 7.43 3.76 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 1.51 0.49 0.94 0.00 0.00 24 R 7.62 4.53 0.00 1.87 1.90 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 25 K 7.53 3.88 0.00 1.80 1.77 0.00 1.55 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.32 7.81 26 E 8.44 4.03 0.00 1.87 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 2.31 2.31 0.00 27 I 7.27 4.44 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.72 0.89 0.00 0.00 28 P 0.00 4.48 0.00 2.14 2.05 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 29 A 7.63 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.26 4.22 0.00 1.87 1.88 0.00 1.75 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.56 1.49 7.81 31 I 7.84 4.19 1.84 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 1.49 0.86 0.94 0.00 0.00 32 I 8.65 4.04 1.64 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.35 0.63 0.00 0.00 33 F 7.93 4.99 0.00 2.99 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 34 E 7.15 5.04 0.00 1.82 1.70 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 1.90 2.11 0.00 35 D 7.99 4.36 0.00 2.75 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 0.00 0.00 0.00 0.00 36 D 8.76 4.46 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 37 R 8.26 4.44 0.00 2.12 2.08 0.00 3.09 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 38 C 9.24 5.29 0.00 3.21 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 39 L 9.20 5.23 0.00 1.78 1.59 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 40 A 9.54 5.61 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 41 F 8.65 5.33 0.00 2.99 2.93 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 42 H 8.38 4.63 0.00 3.12 3.29 0.00 5.65 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 43 D 8.54 4.55 0.00 2.36 2.28 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 44 I 8.33 4.03 1.91 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 1.49 0.75 0.97 0.00 0.00 45 S 8.61 4.66 0.00 3.88 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 0.00 46 P 0.00 4.31 0.00 2.20 2.09 0.00 3.76 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 2.01 2.01 0.00 47 Q 9.03 4.40 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.25 0.00 48 A 7.45 4.68 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 49 P 0.00 4.41 0.00 1.97 2.15 0.00 3.93 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 2.05 2.15 0.00 50 T 8.06 4.51 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 1.39 0.00 0.00 51 H 8.82 5.43 0.00 3.14 3.11 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.99 5.40 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.44 5.10 0.00 0.47 1.14 0.54 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.88 4.83 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 1.01 0.00 0.00 1.08 0.00 0.00 55 I 8.82 5.24 2.17 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 1.76 0.89 1.38 0.00 0.00 56 P 0.00 5.09 0.00 2.28 2.17 0.00 4.09 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 2.22 2.05 0.00 57 K 8.78 4.22 0.00 1.79 1.95 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.43 7.81 58 K 7.85 4.20 0.00 1.90 1.84 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.46 7.81 59 H 8.75 4.42 0.00 3.33 3.31 0.00 5.69 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 60 I 8.00 4.52 1.88 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 1.48 0.73 0.94 0.00 0.00 61 S 8.93 4.66 0.00 4.17 4.09 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 62 Q 7.58 4.58 0.00 2.67 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 63 I 8.46 3.74 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.21 0.95 0.00 0.00 64 S 8.46 4.38 0.00 4.01 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 65 V 7.37 3.91 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 0.66 0.00 0.00 0.98 0.00 0.00 66 A 7.36 4.11 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 67 E 8.63 4.47 0.00 2.07 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 2.30 2.28 0.00 68 D 8.43 4.54 0.00 2.71 2.72 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 69 D 8.05 4.35 0.00 2.67 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 70 D 8.07 4.78 0.00 2.74 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 71 E 7.85 3.93 0.00 2.10 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 0.00 2.32 2.37 0.00 72 S 8.02 4.18 0.00 3.92 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 73 L 7.87 4.04 0.00 1.79 1.91 1.04 0.72 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 74 L 8.30 4.12 0.00 1.91 1.72 0.94 0.75 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 75 G 8.39 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 76 H 8.44 4.23 0.00 3.44 3.52 0.00 5.80 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 77 L 8.01 3.98 0.00 1.88 1.75 0.98 0.96 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 78 M 7.97 4.07 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 79 I 8.09 3.69 1.87 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 1.58 1.11 0.89 0.00 0.00 80 V 8.14 3.43 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 0.67 0.00 0.00 0.67 0.00 0.00 81 G 8.29 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 82 K 8.23 3.91 0.00 2.13 2.17 0.00 1.38 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.49 7.81 83 K 7.79 3.86 0.00 1.75 1.69 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.62 1.43 7.81 84 C 8.21 3.83 0.00 2.79 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 0.00 0.00 0.00 85 A 8.18 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.86 3.70 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 87 D 8.08 4.46 0.00 2.59 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 88 L 8.00 4.42 0.00 1.61 1.68 0.56 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.55 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 90 L 8.52 4.48 0.00 1.87 2.00 1.01 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 91 N 8.08 4.47 0.00 2.83 3.00 0.00 0.00 6.33 7.13 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 92 K 8.52 4.09 0.00 1.79 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.38 7.81 93 G 6.66 4.09 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 0.00 94 Y 6.93 4.80 0.00 2.95 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 95 R 9.04 4.76 0.00 1.86 1.77 0.00 3.11 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 96 M 8.75 5.73 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.33 0.00 97 V 8.24 4.51 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 1.07 0.00 0.00 0.90 0.00 0.00 98 V 8.52 4.73 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 0.89 0.00 0.00 0.94 0.00 0.00 99 N 8.71 4.83 0.00 2.72 2.69 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 0.00 100 E 8.63 4.55 0.00 2.01 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 0.00 2.28 2.35 0.00 101 G 8.84 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 0.00 0.00 0.00 0.00 102 S 8.18 4.12 0.00 3.92 3.87 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 0.00 103 D 8.20 4.34 0.00 2.64 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 0.00 104 G 7.48 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 0.00 0.00 0.00 105 G 8.52 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 0.00 106 Q 7.84 4.45 0.00 1.89 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.67 0.00 0.00 0.00 0.00 0.00 1.31 1.92 0.00 107 S 8.30 4.31 0.00 3.92 3.87 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 0.00 108 V 7.18 3.62 1.69 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 -0.65 0.00 0.00 0.70 0.00 0.00 109 Y 7.80 4.52 0.00 3.15 2.93 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 0.00 110 H 7.92 4.67 0.00 3.06 3.09 0.00 5.97 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.60 3.71 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 0.85 0.00 0.00 0.98 0.00 0.00 112 H 8.40 5.06 0.00 3.22 3.47 0.00 5.57 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 0.00 113 L 9.25 4.39 0.00 1.76 1.69 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 114 H 9.25 5.06 0.00 3.26 3.06 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.60 4.60 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 0.51 0.00 0.00 0.42 0.00 0.00 116 L 9.20 5.16 0.00 1.53 1.43 0.81 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 117 G 9.61 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 0.00 118 G 9.51 4.34 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 0.00 119 R 7.21 4.58 0.00 1.90 1.93 0.00 3.02 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 120 Q 8.37 4.09 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 121 M 8.39 4.42 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 122 H 8.40 5.04 0.00 3.16 3.27 0.00 5.66 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 0.00 123 W 8.41 4.82 0.00 3.23 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 0.00 124 P 0.00 2.97 0.00 1.92 1.61 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.78 0.00 125 P 0.00 4.30 0.00 2.07 2.02 0.00 2.90 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 1.63 1.44 0.00 126 G 7.61 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 0.00 0.00 0.00