NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1611 8.0249 120.7887 60.3739 39.9501 175.5804 2 Q 4.7126 7.8505 116.4567 53.6395 32.8867 173.3657 3 R 4.7656 9.2708 121.8898 54.6090 33.7652 174.7539 4 T 4.9127 8.8307 118.3283 60.1116 68.3838 172.3815 5 P 4.8400 0.0000 0.0000 62.8494 32.3161 176.1046 6 K 4.3648 9.4604 122.9748 56.4388 33.5284 176.0197 7 I 5.0687 8.3226 123.6858 59.7034 40.4390 174.7119 8 Q 4.8437 9.2523 125.6537 54.0415 32.2062 174.5193 9 V 5.0337 8.4360 123.5035 61.5100 34.0022 173.8840 10 Y 5.2157 8.2163 124.6690 56.9180 41.7296 172.6987 11 S 5.0619 8.9318 113.8607 56.5280 65.0665 174.3152 12 R 4.1125 8.9240 123.1273 59.5477 30.0260 176.4170 13 H 5.0799 8.2466 113.4440 52.7081 31.4624 172.4099 14 P 4.2525 0.0000 0.0000 62.9847 31.4720 176.3730 15 A 4.2582 8.8625 126.6261 52.2291 19.0898 176.3343 16 E 4.6518 8.5946 122.0042 54.0834 32.6867 175.1132 17 N 4.6765 8.8776 121.7658 55.1798 38.8735 175.3470 18 G 3.9099 9.4871 111.7495 45.1476 0.0000 172.7820 19 K 4.4603 7.4513 118.8698 53.7753 34.1421 176.0752 20 S 4.1036 8.4188 118.7626 58.5346 63.2085 172.6949 21 N 5.0110 8.7463 123.7638 52.8208 42.8449 171.8954 22 F 5.2987 8.9403 116.0703 55.7255 42.8242 174.0043 23 L 3.9015 8.8323 126.5449 53.6624 43.2825 174.7774 24 N 5.3695 8.7178 123.9976 51.4566 41.6978 173.0571 25 C 5.1502 9.4989 122.8484 55.1510 46.6810 172.0159 26 Y 5.4419 9.3060 129.4835 56.6232 39.9040 174.4467 27 V 5.1218 8.6791 121.0570 59.8957 34.4426 175.3535 28 S 5.1189 8.4989 118.1001 58.5124 66.8014 174.9991 29 G 4.2719 8.8442 106.4554 46.8137 0.0000 173.2221 30 F 5.2882 7.3281 114.3891 55.8227 40.9955 174.1866 31 H 5.2998 9.0125 118.1622 54.8594 33.7824 172.1066 32 P 4.7944 0.0000 0.0000 62.4337 32.3469 175.9214 33 S 3.9779 8.4141 112.9627 60.5044 63.2914 174.4436 34 D 4.4050 7.9074 121.4064 54.5200 40.8619 175.1888 35 I 4.6649 7.9947 122.9086 59.6906 41.4094 173.2655 36 E 4.6210 8.9387 127.3184 54.4845 32.1606 175.2123 37 V 4.4505 7.9798 123.6136 61.1614 34.1634 173.9923 38 D 5.0137 9.0002 128.0037 52.4451 44.2626 175.0680 39 L 4.9779 8.3422 121.5757 53.3574 44.0753 175.2431 40 L 5.1555 9.1973 123.6976 52.7764 44.9132 175.2790 41 K 4.3796 9.1123 124.7910 54.6863 34.4489 175.8593 42 N 4.1880 10.1667 128.4011 54.3288 36.6634 175.6646 43 G 3.9685 8.3867 105.0188 45.2234 0.0000 173.4185 44 E 4.6275 7.7070 119.8963 54.0709 31.3597 175.5508 45 R 4.4510 8.4753 122.4797 56.7283 30.7308 176.2844 46 I 4.1534 8.9123 125.5744 60.8012 36.8023 175.6188 47 E 4.1185 8.7825 127.2010 56.2371 31.2544 176.4862 48 K 4.0298 8.6960 121.5383 57.1244 29.5179 176.0890 49 V 3.6869 7.1535 119.4657 63.2407 31.8706 175.5118 50 E 4.6068 8.5504 127.2444 55.0950 32.2335 174.3236 51 H 5.2747 7.7563 115.2715 53.7332 31.6948 173.2018 52 S 4.5532 8.7913 114.9808 58.0350 64.0149 173.6864 53 D 4.4993 8.5041 120.5517 53.6186 41.2869 176.2798 54 L 4.0436 8.4584 125.1293 55.9961 42.6492 175.8549 55 S 4.7576 8.2147 120.2623 56.8437 66.7306 171.8211 56 F 5.2036 7.5525 115.4812 55.4962 41.2392 174.3136 57 S 4.7353 8.9634 116.6132 57.0219 64.4855 175.5986 58 K 3.6499 8.3883 119.9093 59.3599 31.6993 177.8574 59 D 4.4658 7.8173 116.0005 52.7401 39.4966 177.2823 60 W 3.6930 7.6658 119.5260 56.7997 28.3730 174.7762 61 S 4.3204 8.0761 113.8866 58.1905 63.7862 173.9809 62 F 4.9706 8.6401 121.2642 57.1635 40.3905 174.2250 63 Y 5.3824 8.2452 117.8685 55.8884 41.7759 173.9970 64 L 5.1402 9.5597 120.2554 53.5388 47.1362 174.3616 65 L 5.4742 9.2283 124.7938 53.9057 44.3452 174.5495 66 Y 5.1483 9.3480 124.8846 56.9188 40.2233 174.3758 67 Y 5.8268 8.5516 120.2577 56.8995 41.9535 173.4526 68 T 5.0136 8.3461 114.0544 60.5877 71.2428 172.5286 69 E 4.0879 8.6631 125.6053 56.8141 30.2116 176.2438 70 F 4.7501 8.6807 116.1269 56.3176 42.0705 173.3565 71 T 4.3073 8.1371 116.9238 60.8322 70.6731 171.5935 72 P 4.7150 0.0000 0.0000 62.8257 32.6724 176.0315 73 T 4.9983 8.5568 112.7021 59.2877 72.0248 173.6283 74 E 4.1479 8.8470 118.7361 58.7071 29.7290 177.9358 75 K 4.3516 7.8568 116.6420 56.8397 33.3530 176.3948 76 D 4.5540 7.9858 119.6892 54.0055 41.3011 174.9565 77 E 4.6915 9.7808 126.0737 54.9171 31.5432 174.1235 78 Y 5.3880 8.8828 123.4775 56.5326 41.6774 174.3734 79 A 5.1410 8.9713 122.9893 51.1316 23.7893 173.8675 80 C 5.2310 9.5249 119.5455 54.7908 45.5007 172.4983 81 R 5.0728 9.1851 126.5376 54.5526 32.2132 174.4239 82 V 4.7724 8.8724 126.7379 61.0030 34.4691 173.6079 83 N 5.3001 8.9473 126.2411 52.3332 42.1854 172.3966 84 H 5.0623 8.4347 122.6821 54.7517 33.0497 174.4713 85 V 3.6223 8.2047 122.7092 64.8331 31.2877 177.7424 86 T 4.0545 8.0277 110.1701 63.3624 69.1401 173.7938 87 L 4.7208 7.6426 122.9068 53.0309 42.8282 176.9353 88 S 4.3429 8.6590 118.2803 60.3438 63.6401 174.3729 89 Q 4.5949 7.5837 117.7658 52.8403 32.3674 172.8498 90 P 4.4550 0.0000 0.0000 63.0639 32.2594 175.4737 91 K 4.4338 9.2951 125.8747 55.0667 33.8465 174.8755 92 I 4.8359 8.3415 128.5584 59.9526 38.8361 175.1338 93 V 4.4212 8.8518 127.5653 60.9074 33.7507 174.9073 94 K 4.6183 8.7395 127.4403 55.7325 33.2066 176.4801 95 W 4.5945 9.3045 135.0000 57.2914 31.5264 174.8979 96 D 4.5234 8.6050 126.8375 51.9307 42.3201 176.5731 97 R 3.9143 7.7346 123.2584 58.3110 29.6267 176.7039 98 D 4.8456 7.9961 118.2328 54.2977 40.9346 176.3567 99 M 4.3995 8.0706 125.3714 55.6500 32.9219 175.1881 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 I 8.02 4.16 1.88 0.00 0.00 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 1.43 1.34 0.93 0.00 0.00 2 Q 7.85 4.71 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 3 R 9.27 4.77 0.00 1.93 1.99 0.00 3.17 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 4 T 8.83 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 5 P 0.00 4.84 0.00 2.00 1.74 0.00 3.76 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.68 0.00 6 K 9.46 4.36 0.00 1.81 1.81 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.47 7.81 7 I 8.32 5.07 1.90 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 1.31 0.60 0.95 0.00 0.00 8 Q 9.25 4.84 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 9 V 8.44 5.03 2.31 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 0.96 0.00 0.00 1.10 0.00 0.00 10 Y 8.22 5.22 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 11 S 8.93 5.06 0.00 4.22 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 12 R 8.92 4.11 0.00 1.80 2.05 0.00 3.05 0.00 0.00 2.97 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.44 0.00 13 H 8.25 5.08 0.00 3.26 3.21 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.25 0.00 2.10 2.10 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 15 A 8.86 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.59 4.65 0.00 1.99 1.82 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 2.31 2.47 0.00 17 N 8.88 4.68 0.00 2.73 2.81 0.00 0.00 7.28 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 18 G 9.49 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 19 K 7.45 4.46 0.00 1.82 1.67 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.46 7.81 20 S 8.42 4.10 0.00 3.78 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 21 N 8.75 5.01 0.00 2.61 2.20 0.00 0.00 6.78 7.37 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 22 F 8.94 5.30 0.00 3.01 2.89 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 23 L 8.83 3.90 0.00 0.27 0.74 -0.29 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.72 5.37 0.00 1.44 1.97 0.00 0.00 5.96 7.52 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 25 C 9.50 5.15 0.00 2.89 2.97 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 26 Y 9.31 5.44 0.00 3.40 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 27 V 8.68 5.12 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 0.63 0.00 0.00 1.08 0.00 0.00 28 S 8.50 5.12 0.00 3.81 3.26 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 29 G 8.84 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 0.00 0.00 0.00 0.00 30 F 7.33 5.29 0.00 3.12 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 31 H 9.01 5.30 0.00 3.30 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.79 0.00 2.14 2.18 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 33 S 8.41 3.98 0.00 3.22 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 34 D 7.91 4.41 0.00 2.65 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 35 I 7.99 4.66 1.49 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.55 0.82 0.00 0.00 36 E 8.94 4.62 0.00 1.83 1.72 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 2.16 2.15 0.00 37 V 7.98 4.45 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 0.25 0.00 0.00 0.41 0.00 0.00 38 D 9.00 5.01 0.00 2.52 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 39 L 8.34 4.98 0.00 1.57 1.53 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.20 5.16 0.00 1.55 1.54 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.11 4.38 0.00 1.87 1.65 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.15 0.87 7.81 42 N 10.17 4.19 0.00 2.70 2.78 0.00 0.00 7.20 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 43 G 8.39 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 44 E 7.71 4.63 0.00 2.17 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 2.23 2.23 0.00 45 R 8.48 4.45 0.00 1.69 1.87 0.00 3.35 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 46 I 8.91 4.15 1.96 0.00 0.00 1.00 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 0.53 0.93 0.00 0.00 47 E 8.78 4.12 0.00 2.06 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 2.36 2.34 0.00 48 K 8.70 4.03 0.00 1.95 1.91 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.41 7.81 49 V 7.15 3.69 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 0.79 0.00 0.00 0.96 0.00 0.00 50 E 8.55 4.61 0.00 1.16 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 2.10 2.05 0.00 51 H 7.76 5.27 0.00 2.27 1.88 0.00 5.53 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.79 4.55 0.00 3.99 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 0.00 53 D 8.50 4.50 0.00 2.70 2.64 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 54 L 8.46 4.04 0.00 1.64 1.62 0.83 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.21 4.76 0.00 3.76 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 56 F 7.55 5.20 0.00 2.90 2.53 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 57 S 8.96 4.74 0.00 4.10 3.86 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 58 K 8.39 3.65 0.00 1.62 1.69 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.32 7.81 59 D 7.82 4.47 0.00 2.76 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 60 W 7.67 3.69 0.00 3.33 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 61 S 8.08 4.32 0.00 4.05 3.98 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 62 F 8.64 4.97 0.00 1.66 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 63 Y 8.25 5.38 0.00 3.06 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 64 L 9.56 5.14 0.00 1.97 1.74 1.22 0.59 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 65 L 9.23 5.47 0.00 2.06 1.73 1.07 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.35 5.15 0.00 3.00 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 67 Y 8.55 5.83 0.00 3.04 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 68 T 8.35 5.01 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 1.13 0.00 0.00 69 E 8.66 4.09 0.00 1.73 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.15 0.00 70 F 8.68 4.75 0.00 2.77 2.66 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 71 T 8.14 4.31 4.17 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 1.13 0.00 0.00 72 P 0.00 4.71 0.00 2.12 2.28 0.00 3.29 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.86 0.00 73 T 8.56 5.00 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 1.31 0.00 0.00 74 E 8.85 4.15 0.00 2.12 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 0.00 2.30 2.36 0.00 75 K 7.86 4.35 0.00 1.78 1.91 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.45 7.81 76 D 7.99 4.55 0.00 2.88 2.41 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 77 E 9.78 4.69 0.00 2.05 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 2.23 2.33 0.00 78 Y 8.88 5.39 0.00 3.25 2.75 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 79 A 8.97 5.14 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 80 C 9.52 5.23 0.00 2.95 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 81 R 9.19 5.07 0.00 1.82 1.69 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 8.87 4.77 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 0.71 0.00 0.00 0.81 0.00 0.00 83 N 8.95 5.30 0.00 2.69 2.53 0.00 0.00 6.23 8.24 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 84 H 8.43 5.06 0.00 3.06 3.02 0.00 5.74 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.20 3.62 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 0.77 0.00 0.00 0.91 0.00 0.00 86 T 8.03 4.05 4.31 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 1.37 0.00 0.00 87 L 7.64 4.72 0.00 1.79 1.82 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.66 4.34 0.00 3.98 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 89 Q 7.58 4.59 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 90 P 0.00 4.46 0.00 1.91 1.96 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 91 K 9.30 4.43 0.00 1.76 1.65 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 I 8.34 4.84 1.88 0.00 0.00 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 1.22 0.70 0.96 0.00 0.00 93 V 8.85 4.42 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 1.06 0.00 0.00 0.96 0.00 0.00 94 K 8.74 4.62 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.57 1.47 7.81 95 W 9.30 4.59 0.00 3.25 3.45 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 96 D 8.60 4.52 0.00 2.62 2.44 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 97 R 7.73 3.91 0.00 1.92 1.28 0.00 2.99 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.49 0.00 98 D 8.00 4.85 0.00 2.77 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 99 M 8.07 4.40 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.69 0.00