NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4264 8.2893 120.3177 53.8828 34.0852 174.9295 2 E 4.4811 7.0088 111.6453 55.1173 32.2468 172.1580 3 S 5.3341 8.1470 119.2749 58.5561 64.4088 175.8761 4 H 4.9013 8.0888 120.6140 55.0808 33.0971 171.6739 5 T 4.5623 8.2179 114.5656 62.3525 71.2048 174.3734 6 A 4.5397 8.7451 129.4203 51.2264 17.1579 175.9639 7 V 3.8848 8.6763 121.1022 62.5491 33.3221 174.3768 8 Q 5.0761 8.6968 125.8940 54.2018 30.8180 174.9769 9 G 4.2496 9.4518 110.1869 44.2040 0.0000 170.8877 10 L 5.2165 8.1400 120.9146 52.4571 44.8263 175.5849 11 A 4.3572 8.3353 129.2794 53.4786 18.6484 177.7225 12 G 3.9779 9.7233 111.6094 43.1235 0.0000 172.6392 13 H 5.0820 8.0341 116.1470 52.9051 33.0964 171.3570 14 P 5.0662 0.0000 0.0000 62.7929 32.5907 175.8282 15 V 4.5018 8.4075 119.4008 60.3663 35.0749 174.0884 16 T 4.8626 8.3759 118.7893 61.7381 71.4699 173.4123 17 L 4.1574 8.5475 126.7784 51.8236 43.3997 174.1543 18 P 4.7588 0.0000 0.0000 63.0971 32.3011 176.7417 19 C 4.9984 9.4087 124.1708 55.6793 46.6692 172.5505 20 I 6.0954 8.7649 126.0668 59.1932 41.0280 174.1180 21 Y 4.8497 8.0607 121.1857 55.5511 42.0027 173.9142 22 S 4.2926 8.6504 115.8850 57.9871 62.9143 175.0332 23 T 4.3901 7.9248 120.3829 63.9748 68.5679 176.4118 24 H 4.3426 7.9626 118.4049 58.3838 28.8584 176.6765 25 L 4.4946 7.7423 119.8161 55.6204 42.0963 177.6619 26 G 3.9010 8.1280 104.8093 44.3901 0.0000 174.1376 27 G 3.8107 8.2040 109.7386 44.8575 0.0000 172.5289 28 I 4.4326 8.0686 119.3716 59.9236 37.4751 175.6296 29 V 4.6111 8.2679 118.2316 58.3532 36.0250 173.8608 30 P 4.9565 0.0000 0.0000 63.2634 32.7061 175.3667 31 M 5.1301 8.4322 118.1150 54.2546 35.1039 172.2946 32 C 4.8615 8.5424 113.0503 53.5717 41.3184 172.6244 33 W 4.9878 8.6172 120.1372 54.9782 31.6909 175.1895 34 G 4.4791 9.2638 110.3762 44.2714 0.0000 171.3884 35 L 4.2368 8.2743 121.5153 55.0951 42.4871 177.3350 36 G 3.8138 8.4586 109.5276 44.3393 0.0000 172.8659 37 E 4.4053 8.4292 117.2470 55.7950 30.1245 177.6852 38 C 4.5486 9.2166 119.6729 58.6530 40.8957 174.4380 39 R 3.6809 8.4474 118.9343 55.5378 26.6559 174.9161 40 H 5.1158 7.4015 125.6692 56.5108 31.1671 175.4885 41 S 4.7514 7.8038 110.8402 57.2105 62.1628 173.2991 42 Y 4.6141 7.7481 119.7901 58.1497 38.8549 174.9696 43 C 3.7744 8.0861 109.5472 58.0916 37.2004 175.3239 44 I 3.7318 8.0526 121.1938 63.4221 38.3845 175.7382 45 R 4.6715 7.4776 119.1001 53.8990 29.6926 174.8342 46 S 4.5202 8.2264 115.4719 58.5615 63.2025 173.4088 47 L 4.4288 9.2544 125.5431 55.6607 44.3995 176.5475 48 I 5.2281 7.3993 117.2336 59.6833 42.1322 174.3535 49 W 5.6564 9.3314 124.5147 55.3365 33.4211 174.3402 50 T 5.2786 9.1051 113.5607 59.7833 71.6435 173.2709 51 N 4.9235 8.8475 116.6247 52.7418 37.4613 175.0892 52 G 4.4449 8.4531 108.9368 45.6397 0.0000 174.6546 53 Y 4.6664 8.6166 115.4257 58.5181 40.7412 175.7267 54 T 4.7632 7.8721 107.3984 59.5465 71.9480 172.9180 55 V 4.2539 8.4466 123.0603 63.4302 31.7892 175.7351 56 T 4.6058 8.8708 117.3654 62.3070 70.2267 174.1301 57 H 5.0404 8.0054 121.2974 55.2901 33.4215 172.0450 58 Q 4.9594 8.2477 122.3185 54.5312 30.9565 174.5540 59 R 4.2128 8.8922 124.5746 59.3063 30.9116 175.7256 60 N 4.8183 8.0716 113.6708 51.7850 39.6532 174.9634 61 S 4.3159 8.5922 112.7464 60.5962 63.2095 175.5185 62 R 3.8857 8.6555 121.0115 58.2019 30.9369 175.5475 63 Y 4.9794 7.5128 116.7367 56.4439 39.1832 175.4302 64 Q 4.6180 9.1064 123.1301 54.0293 33.5780 174.7718 65 L 5.0759 8.5793 122.0925 53.4205 42.4316 176.4994 66 K 4.1783 8.7586 123.0267 56.7324 32.7934 177.5889 67 G 3.9569 7.5685 107.2859 43.3453 0.0000 173.4151 68 N 4.5968 8.3264 117.4637 52.2525 37.7692 175.4352 69 I 3.8470 8.4532 126.2309 64.2743 37.3960 178.9817 70 S 4.0792 8.0807 112.1334 60.5055 62.8691 174.4364 71 E 4.1917 8.0399 119.0198 56.1113 29.6702 176.6380 72 G 3.4223 8.2231 108.3795 45.6874 0.0000 172.9081 73 N 4.9423 8.0364 119.5464 52.0841 39.0583 175.2958 74 V 4.5466 8.2684 122.5062 60.7924 32.4192 176.5472 75 S 4.7826 8.4341 116.2973 58.8846 63.7563 173.7313 76 L 4.2604 8.3112 126.1866 54.0473 43.4814 175.1128 77 T 4.7942 8.8325 122.9713 61.7940 71.4032 173.0640 78 I 4.4848 8.4519 128.1014 59.6320 38.8624 175.2812 79 E 4.2428 8.9387 127.6595 55.4924 30.1662 176.3959 80 N 3.9460 8.3247 118.3517 54.7971 37.3223 173.7783 81 T 4.1917 7.6294 110.5426 61.8734 70.2213 174.5066 82 V 4.5917 8.6129 115.2362 59.1324 35.6393 177.1056 83 V 3.5554 8.5241 121.2600 66.2178 31.3205 178.1479 84 G 3.8396 8.0138 106.1984 47.3109 0.0000 173.5203 85 D 4.6638 8.2471 119.4771 55.1083 41.3001 177.1517 86 G 3.7737 7.8172 108.7081 46.0971 0.0000 171.9228 87 G 3.7729 8.6538 105.9527 42.7454 0.0000 171.2994 88 P 5.2412 0.0000 0.0000 63.1673 32.6719 175.1534 89 Y 5.3001 9.4337 118.9663 56.6786 42.9384 173.3260 90 C 5.5477 9.5542 120.7748 55.1797 45.8771 171.6343 91 C 4.1929 8.7921 125.7763 54.3526 46.3742 172.4206 92 V 4.2594 8.0372 125.6037 60.9796 34.3307 174.0579 93 V 3.8768 8.0026 129.0545 60.3412 32.8795 176.0810 94 E 2.5400 7.6407 131.9958 54.8526 27.0248 178.0434 95 I 3.7714 6.5031 121.3361 59.5693 37.6489 174.4857 96 P 4.4878 0.0000 0.0000 64.4507 31.3470 177.2307 97 G 3.9518 10.5520 110.7881 45.8115 0.0000 173.5807 98 A 4.6940 8.2192 121.6377 50.3773 20.0090 176.8540 99 F 4.1982 8.3157 120.3770 58.3195 40.4069 176.1610 100 H 4.9178 8.4293 122.3766 54.4981 31.6323 173.2173 101 F 5.2733 8.7568 123.5962 55.6348 42.4297 174.7764 102 V 4.2830 8.4215 121.4241 61.2988 34.6958 173.5827 103 D 5.3480 8.5637 127.4574 53.1733 42.6900 174.9389 104 Y 5.0146 9.2949 121.5022 56.3516 41.8301 174.7079 105 M 5.0246 9.4540 122.6098 53.8832 34.9023 173.9061 106 L 4.8252 9.3259 130.1496 53.9855 44.1107 174.6608 107 E 4.8279 9.2471 128.1500 54.5872 31.6423 174.4890 108 V 4.6849 8.3911 127.6140 61.2718 33.0878 175.0440 109 K 4.5914 8.9325 128.6856 54.6029 33.6494 175.2778 110 P 4.6735 0.0000 0.0000 62.3380 32.1483 177.3356 111 E 4.0402 8.6484 119.0296 58.7177 29.6541 177.3883 112 L 4.5078 7.2645 119.9954 53.1365 44.9608 175.5483 113 V 3.9836 8.3436 126.0850 60.8187 31.1770 173.4669 114 P 4.1600 0.0000 0.0000 64.2918 31.8882 176.8246 115 R 4.2417 8.5851 118.6700 56.6358 29.4054 176.1897 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 4.43 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 2 E 7.01 4.48 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.56 0.00 3 S 8.15 5.33 0.00 4.07 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 4 H 8.09 4.90 0.00 3.00 3.44 0.00 5.83 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 5 T 8.22 4.56 4.11 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 1.31 0.00 0.00 6 A 8.75 4.54 1.29 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 0.00 0.00 0.00 7 V 8.68 3.88 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 0.89 0.00 0.00 0.82 0.00 0.00 8 Q 8.70 5.08 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.28 0.00 9 G 9.45 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 0.00 0.00 0.00 10 L 8.14 5.22 0.00 1.67 1.40 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.34 4.36 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 12 G 9.72 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 0.00 0.00 0.00 13 H 8.03 5.08 0.00 3.23 3.14 0.00 5.81 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 14 P 0.00 5.07 0.00 1.99 2.20 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 15 V 8.41 4.50 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 0.70 0.00 0.00 0.79 0.00 0.00 16 T 8.38 4.86 4.15 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 0.00 0.00 1.17 0.00 0.00 17 L 8.55 4.16 0.00 0.90 0.64 0.36 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.76 0.00 2.23 2.15 0.00 3.54 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 2.32 2.08 0.00 19 C 9.41 5.00 0.00 3.34 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 20 I 8.76 6.10 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.67 0.94 0.00 0.00 21 Y 8.06 4.85 0.00 2.97 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 22 S 8.65 4.29 0.00 3.84 3.79 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 23 T 7.92 4.39 4.11 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 0.70 0.00 0.00 24 H 7.96 4.34 0.00 3.13 3.36 0.00 5.69 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.74 4.49 0.00 1.59 1.74 0.94 1.01 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 26 G 8.13 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 27 G 8.20 3.81 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 0.00 0.00 0.00 28 I 8.07 4.43 1.68 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 1.26 0.61 0.05 0.00 0.00 29 V 8.27 4.61 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 0.81 0.00 0.00 0.60 0.00 0.00 30 P 0.00 4.96 0.00 2.41 2.30 0.00 3.54 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 2.16 2.15 0.00 31 M 8.43 5.13 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 32 C 8.54 4.86 0.00 1.48 1.18 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 33 W 8.62 4.99 0.00 3.23 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 34 G 9.26 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.27 4.24 0.00 1.47 1.42 0.87 0.82 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 36 G 8.46 3.81 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 0.00 0.00 0.00 37 E 8.43 4.41 0.00 2.08 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 2.56 2.41 0.00 38 C 9.22 4.55 0.00 2.93 2.78 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 0.00 39 R 8.45 3.68 0.00 1.54 1.74 0.00 3.31 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.25 0.00 40 H 7.40 5.12 0.00 3.25 3.32 0.00 5.66 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 41 S 7.80 4.75 0.00 3.84 4.02 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 0.00 0.00 0.00 42 Y 7.75 4.61 0.00 3.00 3.02 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 0.00 0.00 0.00 43 C 8.09 3.77 0.00 2.81 2.92 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 44 I 8.05 3.73 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.64 1.00 0.00 0.00 45 R 7.48 4.67 0.00 1.71 1.78 0.00 3.35 0.00 0.00 3.27 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 46 S 8.23 4.52 0.00 4.15 3.96 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 47 L 9.25 4.43 0.00 1.43 0.98 0.90 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.40 5.23 2.09 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.13 1.06 0.00 0.00 49 W 9.33 5.66 0.00 3.35 3.02 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 0.00 0.00 0.00 50 T 9.11 5.28 4.45 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 1.32 0.00 0.00 51 N 8.85 4.92 0.00 2.98 3.01 0.00 0.00 7.25 6.37 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 52 G 8.45 4.44 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 0.00 53 Y 8.62 4.67 0.00 2.90 3.02 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 0.00 0.00 0.00 54 T 7.87 4.76 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 1.30 0.00 0.00 55 V 8.45 4.25 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 0.97 0.00 0.00 1.01 0.00 0.00 56 T 8.87 4.61 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 1.29 0.00 0.00 57 H 8.01 5.04 0.00 3.34 3.39 0.00 5.82 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.25 4.96 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 59 R 8.89 4.21 0.00 1.93 1.95 0.00 3.26 0.00 0.00 3.33 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.65 0.00 60 N 8.07 4.82 0.00 2.99 2.96 0.00 0.00 5.96 7.14 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 61 S 8.59 4.32 0.00 3.98 4.04 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 62 R 8.66 3.89 0.00 1.32 1.43 0.00 3.15 0.00 0.00 3.05 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 63 Y 7.51 4.98 0.00 2.87 2.82 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 64 Q 9.11 4.62 0.00 1.84 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.75 0.00 0.00 0.00 0.00 0.00 2.21 2.40 0.00 65 L 8.58 5.08 0.00 1.55 1.69 1.08 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.76 4.18 0.00 1.72 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.39 7.81 67 G 7.57 3.96 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 0.00 0.00 0.00 68 N 8.33 4.60 0.00 2.77 2.73 0.00 0.00 6.90 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 69 I 8.45 3.85 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.76 1.03 0.00 0.00 70 S 8.08 4.08 0.00 4.05 4.16 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 71 E 8.04 4.19 0.00 2.04 1.92 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 2.21 2.33 0.00 72 G 8.22 3.42 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 0.00 73 N 8.04 4.94 0.00 2.84 2.95 0.00 0.00 6.96 7.71 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 74 V 8.27 4.55 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 0.88 0.00 0.00 1.09 0.00 0.00 75 S 8.43 4.78 0.00 3.80 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 76 L 8.31 4.26 0.00 0.27 0.13 0.68 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.83 4.79 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 1.18 0.00 0.00 78 I 8.45 4.48 1.65 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.51 0.67 0.00 0.00 79 E 8.94 4.24 0.00 1.65 1.76 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 2.33 2.29 0.00 80 N 8.32 3.95 0.00 2.78 2.66 0.00 0.00 6.73 7.22 0.00 0.00 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 7.63 4.19 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 1.19 0.00 0.00 82 V 8.61 4.59 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 0.73 0.00 0.00 1.04 0.00 0.00 83 V 8.52 3.56 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 0.99 0.00 0.00 0.94 0.00 0.00 84 G 8.01 3.84 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 0.00 0.00 0.00 85 D 8.25 4.66 0.00 2.86 2.85 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 86 G 7.82 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.65 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 5.24 0.00 2.19 2.24 0.00 3.63 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 89 Y 9.43 5.30 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.55 5.55 0.00 3.22 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 91 C 8.79 4.19 0.00 1.23 2.36 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 92 V 8.04 4.26 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 0.81 0.00 0.00 1.17 0.00 0.00 93 V 8.00 3.88 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.59 0.00 0.00 94 E 7.64 2.54 0.00 1.72 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.14 0.00 95 I 6.50 3.77 1.87 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 1.17 0.24 0.90 0.00 0.00 96 P 0.00 4.49 0.00 2.08 2.11 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 2.07 2.18 0.00 97 G 10.55 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 98 A 8.22 4.69 1.25 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 0.00 0.00 99 F 8.32 4.20 0.00 2.68 2.42 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 0.00 100 H 8.43 4.92 0.00 3.11 2.89 0.00 5.72 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 0.00 101 F 8.76 5.27 0.00 2.88 2.78 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 0.00 102 V 8.42 4.28 1.94 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 0.41 0.00 0.00 0.78 0.00 0.00 103 D 8.56 5.35 0.00 2.55 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 0.00 104 Y 9.29 5.01 0.00 3.24 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 0.00 105 M 9.45 5.02 0.00 2.13 1.89 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 106 L 9.33 4.83 0.00 1.68 1.81 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 107 E 9.25 4.83 0.00 2.07 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 2.21 2.23 0.00 108 V 8.39 4.68 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 0.90 0.00 0.00 0.96 0.00 0.00 109 K 8.93 4.59 0.00 1.72 1.69 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.37 7.81 110 P 0.00 4.67 0.00 2.38 2.17 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 111 E 8.65 4.04 0.00 1.98 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 2.34 2.41 0.00 112 L 7.26 4.51 0.00 1.54 1.48 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.34 3.98 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 0.87 0.00 0.00 0.93 0.00 0.00 114 P 0.00 4.16 0.00 2.07 2.01 0.00 3.75 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 2.04 2.14 0.00 115 R 8.59 4.24 0.00 1.95 2.10 0.00 3.24 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00