NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.5309 8.1727 120.1051 56.2655 34.5944 173.6423 3 K 4.9128 9.5772 124.3086 54.3585 34.7236 173.1586 4 I 4.8378 8.6155 128.3685 59.4347 40.4246 173.7878 5 L 4.8383 8.6851 129.4858 53.9126 43.6541 174.9949 6 I 4.5833 8.5800 128.4622 59.7759 39.3245 175.0324 7 V 4.9263 8.7921 128.0248 60.3521 32.9966 173.5328 8 D 5.4837 8.1375 127.0312 52.6884 44.1575 175.5391 9 D 4.7243 9.0552 125.0066 55.1122 40.3358 176.4995 10 E 4.3891 8.4306 121.3776 55.0903 30.2095 176.7672 11 K 4.1717 8.6763 126.1274 59.1392 32.4829 176.7325 12 P 4.3174 0.0000 0.0000 65.5991 31.2590 178.7085 13 I 3.8250 7.7438 118.1751 64.3905 37.1894 177.9016 14 S 4.1498 8.2885 114.0586 61.8971 62.0480 176.1781 15 D 4.4703 8.3509 121.2850 57.2282 40.5543 178.8044 16 I 3.8343 7.7486 119.9379 64.6389 37.0859 178.6201 17 I 3.8994 8.0903 120.6551 64.0416 36.8194 178.4562 18 K 3.9547 8.3837 120.6985 59.4121 32.0910 178.4485 19 F 4.2289 8.5257 121.0618 61.7479 39.2150 176.9407 20 N 4.1292 8.3642 115.9132 56.4150 38.3651 177.4798 21 M 4.2741 8.4909 120.5144 58.5805 31.9014 179.0232 22 T 4.0656 8.1520 116.2486 66.6086 68.4456 176.8851 23 K 3.7450 7.5384 119.1268 59.2285 32.0659 178.3900 24 E 4.0738 7.5080 116.8088 56.7626 29.6617 177.5226 25 G 3.8270 7.9544 107.9871 44.8681 0.0000 173.3848 26 Y 4.6423 6.8536 116.5968 57.5369 39.0919 174.9702 27 E 4.2755 9.0575 124.1145 55.9542 31.0692 175.3053 28 V 4.9474 8.4628 126.5100 61.2076 33.7470 174.8340 29 V 4.6925 8.5918 120.9414 59.6749 34.7852 174.7342 30 T 5.0426 8.5369 113.4819 59.9224 71.7681 173.1285 31 A 4.7265 8.2681 123.7748 50.4483 22.7633 176.6163 32 F 4.7686 9.6850 118.3755 56.2292 40.0198 175.1566 33 N 5.0321 7.6699 118.5729 50.7221 41.1994 175.2375 34 G 3.8154 8.4155 108.2305 47.1716 0.0000 176.0957 35 R 3.8657 8.0091 120.3954 59.4750 30.2992 178.0840 36 E 4.1265 9.0124 118.6073 59.3946 29.3639 179.0732 37 A 3.9734 8.3315 120.9948 55.5415 18.5459 179.8314 38 L 4.0915 7.9347 117.0321 57.8430 41.6256 179.8004 39 E 4.0157 8.1148 118.5675 59.5639 29.3931 179.3467 40 Q 4.0484 8.6039 118.5561 58.5411 28.8123 178.4552 41 F 4.2743 8.5236 122.1171 61.4535 39.2726 177.0988 42 E 3.4195 7.8072 116.2472 59.1711 29.3664 178.8284 43 A 4.1753 7.9151 118.9773 53.8028 18.8848 178.4413 44 E 4.2784 8.3880 115.7597 55.2563 31.9007 175.9962 45 Q 3.3518 7.7140 116.6196 55.5748 26.5711 172.0312 46 P 4.3825 0.0000 0.0000 63.4609 32.1566 176.9262 47 D 4.5878 8.4811 120.1174 57.1097 41.4721 176.4762 48 I 4.7065 7.4793 116.6539 59.6667 41.8546 173.3026 49 I 4.8891 8.3755 127.9361 59.5544 40.4918 174.4205 50 I 4.6295 8.4098 127.8018 59.6155 39.1919 174.5193 51 L 4.9365 8.6710 129.4434 53.2509 44.8319 175.1401 52 D 5.5202 8.5619 126.0627 51.3337 41.7285 177.3976 53 L 3.9230 8.4295 121.8208 57.7696 43.4948 176.2879 54 M 4.6163 7.4333 118.9590 53.6622 32.4925 175.3587 55 L 4.8409 8.0528 122.7365 51.9372 45.9703 174.7682 56 P 4.3358 0.0000 0.0000 63.5714 31.3269 174.0312 57 E 4.0130 8.2025 119.0762 56.0650 28.1503 174.1505 58 I 4.5912 7.0788 116.3956 58.5089 41.6299 175.1775 59 D 4.7539 8.5536 126.8832 52.8464 41.5014 177.3705 60 G 3.8297 8.4728 108.3560 48.3782 0.0000 176.0714 61 L 3.9474 7.8709 120.4870 57.6004 41.7084 179.1176 62 E 3.9559 9.2119 119.6117 58.9755 29.4446 178.7417 63 V 3.5337 8.0333 118.4556 66.1292 31.5599 177.9161 64 A 3.8301 8.0815 120.3995 54.8893 17.9684 179.5168 65 K 3.8148 8.1830 117.5770 59.8841 32.7240 178.6551 66 T 3.9596 8.5972 113.9052 65.1181 67.3516 175.9416 67 I 3.4608 7.8258 122.0344 64.6386 36.9047 178.6377 68 R 4.4341 7.6018 118.1712 58.1849 29.8458 178.6998 69 K 4.0891 7.7886 118.1203 58.7639 32.1335 177.5035 70 T 4.6112 7.8443 105.4029 61.0808 70.3875 173.8525 71 S 4.6891 7.7735 116.6663 57.0232 65.4892 173.5724 72 S 4.8629 8.6070 120.6332 57.8027 63.1880 174.1400 73 V 3.7401 7.6386 120.6119 62.2956 31.3917 174.2395 74 P 4.6015 0.0000 0.0000 63.3163 32.4965 175.0000 75 I 4.8789 8.9475 123.0226 59.3378 40.9961 174.0214 76 L 4.9710 8.6039 128.9964 53.4045 44.0403 175.4109 77 M 5.1539 8.7174 127.0244 54.5138 33.7525 175.5217 78 L 5.2848 7.6210 122.5359 52.5675 45.7705 174.8375 79 S 4.7964 8.1876 117.4832 57.4065 65.1275 175.7775 80 A 4.3224 8.8043 127.8609 54.1638 18.5279 178.2266 81 K 4.2476 8.0460 116.6035 56.8276 32.0366 176.6221 82 D 4.9783 8.6284 124.9157 52.5702 40.2020 176.4933 83 S 4.6212 7.7974 113.9404 57.9391 65.8631 173.6636 84 E 3.8116 8.5943 122.8325 59.5852 29.3366 178.7116 85 F 4.0565 8.2450 119.9569 61.3913 39.4090 176.6153 86 D 4.2509 8.2154 118.3803 57.3505 40.6893 179.0084 87 K 2.8126 7.5338 118.8313 58.9532 31.8616 179.5893 88 V 3.4437 7.6821 118.7364 66.0060 31.4255 177.9773 89 I 3.5545 7.4804 118.4563 63.6026 37.7103 177.6777 90 G 3.8805 7.8889 106.7623 48.2392 0.0000 175.5370 91 L 4.2788 7.9187 123.2416 56.7289 41.4084 179.5319 92 E 3.9757 8.1573 117.8295 59.3161 29.5455 178.7845 93 L 4.2794 8.1516 116.0676 54.8508 41.8469 177.0185 94 G 3.7491 7.7314 106.0097 44.8030 0.0000 174.5733 95 A 4.0289 8.0521 124.2379 52.9914 18.8229 178.1583 96 D 4.6913 8.8250 121.1375 56.3172 41.8437 176.1380 97 D 4.7373 7.7207 115.9447 53.5041 44.9036 173.3570 98 Y 5.0629 8.3617 122.8695 56.1061 42.0644 174.2417 99 V 4.7221 8.7007 125.9989 61.4136 35.2233 174.1192 100 T 5.1920 8.7223 117.1492 60.5011 70.7850 173.8496 101 K 4.8582 8.6857 123.4583 54.6046 33.9218 174.6922 102 P 4.5477 0.0000 0.0000 62.0725 32.4147 175.0341 103 F 5.0031 7.6107 114.0869 54.7782 40.9837 174.6622 104 S 4.6261 8.4651 114.7563 57.1973 64.0719 174.2655 105 N 4.6424 8.8365 126.4864 56.6533 38.4390 177.7841 106 R 3.9510 7.9928 118.9402 59.1602 30.2166 178.4300 107 E 3.9142 8.2906 119.1314 59.1390 29.5521 178.2389 108 L 3.8451 8.0962 120.4003 58.6635 42.0779 179.0193 109 Q 4.0142 8.1607 117.3237 59.0934 28.5596 178.9425 110 A 4.1008 8.0059 121.6892 54.9980 18.3420 179.9706 111 R 3.8619 8.3225 117.1150 59.1339 30.0859 179.2402 112 V 3.4654 7.9778 118.3606 65.8180 31.4710 177.7574 113 K 3.8902 8.0994 118.9772 59.6878 31.8068 178.3579 114 A 3.9916 8.0400 119.6260 55.2446 18.4822 179.2579 115 L 4.0684 8.1610 117.6011 58.0158 41.5597 179.8421 116 L 4.0130 8.1083 118.9924 57.6843 41.3200 179.5131 117 R 3.9609 8.1289 117.9379 58.4215 30.0630 177.4521 118 R 4.4832 7.4177 115.9421 55.9132 30.4599 175.8893 119 S 4.2550 7.7643 117.6661 59.1744 63.1936 173.6568 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 2 K 8.17 4.53 0.00 1.96 1.85 0.00 1.64 0.00 0.00 2.00 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.52 7.81 3 K 9.58 4.91 0.00 1.82 1.63 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.60 7.81 4 I 8.62 4.84 1.76 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.57 0.78 0.00 0.00 5 L 8.69 4.84 0.00 1.76 1.51 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 6 I 8.58 4.58 1.77 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.70 0.82 0.00 0.00 7 V 8.79 4.93 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 1.22 0.00 0.00 0.83 0.00 0.00 8 D 8.14 5.48 0.00 2.68 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 9 D 9.06 4.72 0.00 2.91 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 10 E 8.43 4.39 0.00 2.23 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 0.00 2.33 2.35 0.00 11 K 8.68 4.17 0.00 1.84 1.81 0.00 1.80 0.00 0.00 1.55 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.62 7.81 12 P 0.00 4.32 0.00 2.22 2.10 0.00 3.63 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 2.13 2.19 0.00 13 I 7.74 3.83 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.43 1.14 0.00 0.00 14 S 8.29 4.15 0.00 4.14 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 0.00 15 D 8.35 4.47 0.00 2.97 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 16 I 7.75 3.83 2.12 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 1.55 0.57 1.05 0.00 0.00 17 I 8.09 3.90 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.09 0.88 0.00 0.00 18 K 8.38 3.95 0.00 2.01 2.13 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.51 7.81 19 F 8.53 4.23 0.00 3.22 3.37 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 20 N 8.36 4.13 0.00 2.97 2.88 0.00 0.00 7.12 7.82 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 21 M 8.49 4.27 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.92 0.00 22 T 8.15 4.07 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 1.20 0.00 0.00 23 K 7.54 3.74 0.00 1.55 1.66 0.00 1.15 0.00 0.00 1.16 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.17 0.84 7.81 24 E 7.51 4.07 0.00 1.82 1.52 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 0.00 2.50 2.49 0.00 25 G 7.95 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 26 Y 6.85 4.64 0.00 3.00 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 27 E 9.06 4.28 0.00 2.11 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 2.32 2.28 0.00 28 V 8.46 4.95 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 0.89 0.00 0.00 0.98 0.00 0.00 29 V 8.59 4.69 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 0.75 0.00 0.00 0.92 0.00 0.00 30 T 8.54 5.04 3.78 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 1.20 0.00 0.00 31 A 8.27 4.73 1.11 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 32 F 9.69 4.77 0.00 3.01 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 33 N 7.67 5.03 0.00 3.17 2.95 0.00 0.00 6.07 6.93 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 34 G 8.42 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 0.00 0.00 0.00 35 R 8.01 3.87 0.00 1.91 2.10 0.00 3.22 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 36 E 9.01 4.13 0.00 2.04 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 2.39 2.57 0.00 37 A 8.33 3.97 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 38 L 7.93 4.09 0.00 1.78 1.83 0.93 0.96 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 39 E 8.11 4.02 0.00 2.23 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 2.35 2.51 0.00 40 Q 8.60 4.05 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 41 F 8.52 4.27 0.00 3.09 3.25 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 0.00 42 E 7.81 3.42 0.00 1.94 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 2.09 2.53 0.00 43 A 7.92 4.18 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 44 E 8.39 4.28 0.00 2.07 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 0.00 2.25 2.47 0.00 45 Q 7.71 3.35 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 46 P 0.00 4.38 0.00 2.30 2.08 0.00 4.00 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.08 0.00 47 D 8.48 4.59 0.00 2.69 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 48 I 7.48 4.71 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.50 0.69 0.00 0.00 49 I 8.38 4.89 1.76 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.52 0.85 0.00 0.00 50 I 8.41 4.63 1.74 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.46 0.73 0.00 0.00 51 L 8.67 4.94 0.00 1.59 1.34 0.83 0.80 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 52 D 8.56 5.52 0.00 2.95 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 53 L 8.43 3.92 0.00 1.72 1.68 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 54 M 7.43 4.62 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.66 0.00 55 L 8.05 4.84 0.00 1.75 1.51 0.88 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.34 0.00 2.20 2.00 0.00 3.73 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 2.16 2.14 0.00 57 E 8.20 4.01 0.00 2.15 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 0.00 2.22 2.25 0.00 58 I 7.08 4.59 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 1.46 1.48 0.91 0.00 0.00 59 D 8.55 4.75 0.00 3.00 2.79 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 60 G 8.47 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 61 L 7.87 3.95 0.00 1.88 1.72 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 62 E 9.21 3.96 0.00 2.13 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 2.30 2.35 0.00 63 V 8.03 3.53 2.16 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 0.93 0.00 0.00 0.97 0.00 0.00 64 A 8.08 3.83 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 65 K 8.18 3.81 0.00 1.75 1.95 0.00 1.95 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.43 7.81 66 T 8.60 3.96 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 1.34 0.00 0.00 67 I 7.83 3.46 1.76 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.62 0.38 0.00 0.00 68 R 7.60 4.43 0.00 1.90 1.97 0.00 3.27 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 69 K 7.79 4.09 0.00 1.98 1.90 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.62 7.81 70 T 7.84 4.61 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 1.26 0.00 0.00 71 S 7.77 4.69 0.00 4.14 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 72 S 8.61 4.86 0.00 4.00 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 V 7.64 3.74 2.19 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 0.63 0.00 0.00 1.07 0.00 0.00 74 P 0.00 4.60 0.00 2.08 2.19 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.98 0.00 75 I 8.95 4.88 1.79 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.60 0.80 0.00 0.00 76 L 8.60 4.97 0.00 1.59 1.39 0.82 0.55 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 77 M 8.72 5.15 0.00 1.35 1.85 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.32 0.00 78 L 7.62 5.28 0.00 1.46 1.29 0.67 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.19 4.80 0.00 3.77 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 80 A 8.80 4.32 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 81 K 8.05 4.25 0.00 1.93 2.17 0.00 1.72 0.00 0.00 1.85 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.45 7.81 82 D 8.63 4.98 0.00 2.77 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 83 S 7.80 4.62 0.00 4.15 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 84 E 8.59 3.81 0.00 2.04 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 2.38 2.35 0.00 85 F 8.25 4.06 0.00 3.17 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 86 D 8.22 4.25 0.00 2.86 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 K 7.53 2.81 0.00 1.49 1.37 0.00 1.49 0.00 0.00 1.35 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 1.19 7.81 88 V 7.68 3.44 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 1.00 0.00 0.00 0.91 0.00 0.00 89 I 7.48 3.55 0.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.91 0.55 0.00 0.00 90 G 7.89 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 91 L 7.92 4.28 0.00 1.67 1.71 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.16 3.98 0.00 1.99 1.97 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 2.30 2.45 0.00 93 L 8.15 4.28 0.00 1.63 1.67 0.95 0.93 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 94 G 7.73 3.75 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 0.00 0.00 0.00 95 A 8.05 4.03 1.36 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 0.00 0.00 96 D 8.82 4.69 0.00 2.62 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 97 D 7.72 4.74 0.00 2.66 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 98 Y 8.36 5.06 0.00 2.97 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 99 V 8.70 4.72 1.95 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 0.91 0.00 0.00 0.90 0.00 0.00 100 T 8.72 5.19 4.35 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 1.40 0.00 0.00 101 K 8.69 4.86 0.00 1.83 1.87 0.00 1.78 0.00 0.00 1.90 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.71 1.47 7.81 102 P 0.00 4.55 0.00 2.06 1.96 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 103 F 7.61 5.00 0.00 3.09 3.20 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 0.00 104 S 8.47 4.63 0.00 3.96 3.85 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 0.00 0.00 0.00 105 N 8.84 4.64 0.00 2.90 2.99 0.00 0.00 7.16 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 0.00 106 R 7.99 3.95 0.00 1.89 2.01 0.00 3.16 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 107 E 8.29 3.91 0.00 2.10 2.14 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 2.34 2.35 0.00 108 L 8.10 3.85 0.00 1.97 1.74 0.43 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.16 4.01 0.00 2.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.45 2.57 0.00 110 A 8.01 4.10 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 0.00 111 R 8.32 3.86 0.00 1.95 1.95 0.00 3.13 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 112 V 7.98 3.47 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 0.72 0.00 0.00 0.84 0.00 0.00 113 K 8.10 3.89 0.00 2.14 1.92 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.55 7.81 114 A 8.04 3.99 1.36 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 0.00 0.00 115 L 8.16 4.07 0.00 1.82 1.68 0.86 0.89 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 0.00 116 L 8.11 4.01 0.00 1.85 1.73 0.83 0.61 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 0.00 117 R 8.13 3.96 0.00 2.05 2.16 0.00 3.24 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 118 R 7.42 4.48 0.00 1.85 2.12 0.00 3.30 0.00 0.00 3.27 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 119 S 7.76 4.26 0.00 3.90 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