NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.6648 8.3493 120.3074 53.1620 40.6101 174.7615 4 W 4.5525 6.9944 114.5448 54.9120 29.7620 170.7915 5 V 3.3067 7.2953 121.0696 62.1571 32.2857 174.8900 6 P 4.5027 0.0000 0.0000 61.5073 32.1212 175.6706 7 P 4.4853 0.0000 0.0000 66.1520 30.9650 178.4461 8 E 4.0205 8.3933 118.0350 59.5411 29.2924 179.2422 9 V 3.5435 8.1268 118.1103 65.5296 31.1892 178.2001 10 F 3.9631 8.0707 117.2877 60.3511 38.9060 176.9226 11 D 4.5767 8.2239 118.0995 57.4451 40.4918 178.4545 12 L 4.0104 7.7338 119.2611 58.0613 42.4489 178.7376 13 V 4.2333 7.8269 110.2989 61.9276 31.8398 177.7653 14 A 4.0473 7.6663 121.9248 55.4013 18.1479 179.3336 15 E 3.8610 8.1505 116.7846 59.7146 29.8477 178.5613 16 D 4.3736 8.1300 118.4618 57.0637 40.7906 178.5261 17 K 4.0552 8.7862 120.3711 59.5637 32.2596 178.7623 18 A 4.0298 8.0382 120.9604 55.0321 18.3190 179.4921 19 R 3.8476 8.0371 117.2243 59.9022 30.3228 178.0922 20 C 4.4158 8.5608 116.5235 60.3628 41.3876 176.0712 21 M 4.2394 8.5586 121.9055 58.0478 31.2973 179.0515 22 S 4.1459 8.2735 115.2269 61.6928 62.7989 176.5299 23 E 3.9976 8.6271 120.3978 58.9669 29.6503 178.1892 24 H 4.9174 8.1863 113.0231 54.5396 29.4741 175.2400 25 G 3.9552 7.6209 108.7398 46.7008 0.0000 174.1756 26 T 4.3330 8.0227 116.4463 62.9568 69.2958 174.2903 27 T 4.5530 8.3906 114.8027 59.5539 71.4604 175.2939 28 Q 3.8125 8.5524 123.1351 59.2555 29.0265 178.2289 29 A 3.9325 8.0381 121.3523 55.4974 18.3125 179.4756 30 Q 3.9394 7.8938 116.1300 59.1366 28.7944 179.1411 31 I 3.6319 7.3158 120.8772 64.4991 37.2642 178.2691 32 D 4.3939 8.7634 120.1210 57.4306 40.5732 178.6620 33 D 4.4206 8.1867 119.6191 57.2292 40.8007 178.9062 34 V 4.0118 7.7634 120.1838 65.6946 31.3309 177.8465 35 D 4.4192 8.0408 117.7028 56.9826 40.6572 177.9277 36 K 4.5002 7.6869 116.2433 56.3704 32.1874 177.8518 37 G 3.9542 8.5336 108.1864 45.2103 0.0000 173.5152 38 N 4.7631 8.4025 118.3424 51.7339 38.7085 173.8071 39 L 5.0234 8.3523 123.3699 52.9449 43.9483 176.7369 40 V 4.5855 8.1479 114.7768 59.7308 36.0441 175.4805 41 N 3.7524 8.1267 121.5010 52.4402 37.6931 175.6358 42 E 4.4929 7.4564 119.6542 54.3198 31.9125 174.7008 43 P 4.5552 0.0000 0.0000 65.1488 30.4591 178.6338 44 S 4.7106 8.1173 113.5934 60.4925 62.8021 175.8153 45 I 4.1955 7.6414 121.2401 63.1136 38.4554 177.5145 46 T 4.0786 8.3333 111.1803 65.1372 68.6540 176.0075 47 C 4.4108 8.6826 119.6551 59.4402 41.2811 175.3699 48 Y 4.0143 7.5471 118.3337 60.9791 38.4446 178.0681 49 M 3.9231 8.3171 119.5616 58.4093 31.9954 178.0246 50 Y 3.9387 7.9642 119.5499 60.8262 38.9867 177.1253 51 C 4.0237 8.5920 119.6865 59.7712 41.9086 175.4897 52 L 3.7620 7.5483 121.4934 57.9453 41.6624 178.6191 53 L 4.0218 7.5385 118.9152 57.9519 41.5085 179.1510 54 E 3.6718 7.9380 119.0288 59.1929 29.2626 178.6459 55 A 3.7812 7.5587 119.5399 53.9994 18.2529 177.9997 56 F 4.5557 7.1499 113.5256 57.0138 39.4706 175.4591 57 S 3.7702 7.9864 114.4245 59.6292 60.9134 173.8754 58 L 4.2928 7.9718 121.8082 56.3978 41.9336 177.3873 59 V 5.4841 7.6138 109.0226 58.4246 35.9086 174.5215 60 D 5.1721 8.1722 121.0572 51.9515 41.6640 176.2007 61 D 4.6467 8.7496 116.9091 55.7602 39.7683 176.4507 62 E 4.9853 8.5031 117.8382 54.9627 30.0720 175.2627 63 A 4.0364 8.1734 119.2577 53.2959 16.9099 178.2070 64 N 4.6020 8.6607 117.8876 54.1694 39.2816 175.3592 65 V 4.0702 8.2996 123.5285 62.6994 32.4268 175.7712 66 D 4.6508 9.2571 127.8414 53.0835 40.8876 176.6377 67 E 4.0077 8.5295 126.8758 59.1527 29.8495 178.3922 68 D 4.3530 8.1652 119.3665 57.4547 41.0786 178.7343 69 I 3.7126 8.1402 119.9577 64.5034 37.1482 178.1405 70 M 4.0183 8.1675 118.9603 58.6766 31.8671 178.2753 71 L 4.0418 8.1040 118.1163 57.8964 41.9420 179.5024 72 G 3.7700 7.9785 104.1471 47.5748 0.0000 174.8579 73 L 4.2306 7.6579 121.1440 56.3051 42.4867 177.2273 74 L 4.2689 6.9619 117.6422 53.4133 42.6170 175.0594 75 P 4.4335 0.0000 0.0000 62.6702 31.7960 177.6601 76 D 4.4642 8.4251 119.9251 57.0996 41.2468 178.1829 77 Q 4.0022 8.0330 120.4044 59.0874 29.3953 177.5630 78 L 3.9114 7.2341 115.2223 56.3089 41.5003 179.0643 79 Q 4.1358 7.5219 118.6412 58.8639 28.3504 178.0587 80 E 3.9165 8.1438 119.2397 59.5532 29.4909 179.1801 81 R 3.9204 7.8995 116.7327 59.4396 30.3038 178.4002 82 A 3.9698 8.3031 120.6067 55.8073 18.1109 179.4920 83 Q 3.9214 8.0232 116.2652 59.3389 29.3191 178.3280 84 S 4.2258 7.7726 114.3167 61.0643 62.4176 176.0835 85 V 3.8280 7.9764 120.8948 65.5973 31.3885 177.7538 86 M 4.4660 8.3618 118.3915 57.4638 31.5178 178.8810 87 G 3.5640 7.3644 104.5205 47.4903 0.0000 175.5965 88 K 4.0808 7.8816 120.5776 59.3368 32.5945 178.9508 89 C 4.5252 8.4612 114.4276 56.8207 40.9417 173.8208 90 L 4.7689 6.9085 119.7180 52.0601 43.0659 174.7062 91 P 4.5038 0.0000 0.0000 62.5027 32.0827 176.4264 92 T 4.1923 8.1943 110.2417 61.7727 69.8509 173.9940 93 S 4.6198 8.5098 116.6852 55.9508 66.0763 174.0010 94 G 4.3057 7.9219 109.7366 46.1898 0.0000 171.8087 95 S 4.4252 8.2487 112.5636 59.0783 63.8112 173.4522 96 D 4.4111 7.3724 120.0108 51.6756 42.4366 175.8325 97 N 4.0874 8.2882 116.5823 56.6789 38.2161 178.3349 98 C 4.3436 7.9228 117.1940 60.1320 41.6287 175.5512 99 N 4.2531 9.2843 118.8422 56.3264 38.5119 177.1119 100 K 4.6047 8.3177 121.8827 59.0018 32.0917 179.2243 101 I 3.9715 7.6441 120.1577 63.9872 37.0807 177.7091 102 Y 4.1619 8.3416 120.8132 60.9447 38.7216 178.0260 103 N 4.1345 8.4500 117.3989 55.9562 38.5061 177.1489 104 L 3.8401 7.9242 121.4472 58.1949 42.2059 178.6184 105 A 3.9617 8.4069 121.3118 55.2946 18.2556 179.7301 106 K 3.5312 7.5855 116.8957 59.6097 32.7089 178.6069 107 C 4.0409 7.7883 119.6369 59.6401 44.2051 175.8779 108 V 3.4669 7.8273 120.0511 65.7127 30.8854 177.4551 109 Q 3.2260 7.0089 118.8246 59.1177 28.7348 178.1101 110 E 3.9702 7.5596 118.6800 59.3448 29.7706 178.5533 111 S 4.4209 8.0418 113.8810 60.0177 64.5554 174.8122 112 A 4.7627 8.1268 124.2028 50.1851 19.2622 174.6023 113 P 4.5289 0.0000 0.0000 64.8140 32.4082 178.1393 114 D 4.6329 8.4421 117.4059 57.3025 40.7716 177.8879 115 V 4.3229 7.8065 109.3595 61.9252 32.6841 176.3544 116 W 4.6895 7.7575 128.6627 58.1071 30.8786 174.8088 117 F 4.3041 7.0766 124.0519 57.0641 41.6033 173.0562 118 V 3.8644 7.3251 126.4207 60.8147 34.2112 175.4795 119 I 3.6720 7.8588 125.4952 61.3657 37.1225 175.5788 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 3 D 8.35 4.66 0.00 2.96 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 4 W 6.99 4.55 0.00 3.60 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 5 V 7.30 3.31 1.66 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 0.45 0.00 0.00 -0.57 0.00 0.00 6 P 0.00 4.50 0.00 2.31 1.98 0.00 3.64 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 7 P 0.00 4.49 0.00 2.27 2.29 0.00 3.74 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 2.09 2.06 0.00 8 E 8.39 4.02 0.00 2.09 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 2.42 2.47 0.00 9 V 8.13 3.54 1.87 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 0.64 0.00 0.00 0.82 0.00 0.00 10 F 8.07 3.96 0.00 3.22 3.13 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 11 D 8.22 4.58 0.00 2.91 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 12 L 7.73 4.01 0.00 1.75 1.74 0.97 0.83 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 13 V 7.83 4.23 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 0.28 0.00 0.00 0.93 0.00 0.00 14 A 7.67 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.15 3.86 0.00 2.08 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 2.39 2.41 0.00 16 D 8.13 4.37 0.00 2.94 2.68 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 17 K 8.79 4.06 0.00 1.92 2.10 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.76 7.81 18 A 8.04 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.04 3.85 0.00 1.92 2.10 0.00 3.18 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 20 C 8.56 4.42 0.00 3.30 3.23 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 21 M 8.56 4.24 0.00 2.17 2.17 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 2.91 2.16 0.00 22 S 8.27 4.15 0.00 4.03 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 23 E 8.63 4.00 0.00 1.89 1.73 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 2.31 2.52 0.00 24 H 8.19 4.92 0.00 3.40 3.38 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.62 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 26 T 8.02 4.33 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 0.86 0.00 0.00 27 T 8.39 4.55 4.21 0.00 0.00 0.00 0.00 0.00 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 28 Q 8.55 3.81 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.88 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 29 A 8.04 3.93 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 30 Q 7.89 3.94 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 31 I 7.32 3.63 1.86 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.69 0.78 0.00 0.00 32 D 8.76 4.39 0.00 2.64 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 33 D 8.19 4.42 0.00 2.98 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 34 V 7.76 4.01 2.27 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 1.52 0.00 0.00 1.12 0.00 0.00 35 D 8.04 4.42 0.00 2.91 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 36 K 7.69 4.50 0.00 1.83 1.89 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.69 7.81 37 G 8.53 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 38 N 8.40 4.76 0.00 2.97 2.82 0.00 0.00 6.81 6.36 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 39 L 8.35 5.02 0.00 1.63 1.72 0.81 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.15 4.59 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 0.74 0.00 0.00 0.96 0.00 0.00 41 N 8.13 3.75 0.00 1.63 2.38 0.00 0.00 6.96 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 42 E 7.46 4.49 0.00 2.00 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 2.28 2.30 0.00 43 P 0.00 4.56 0.00 2.16 2.13 0.00 3.85 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 2.11 2.00 0.00 44 S 8.12 4.71 0.00 4.07 4.21 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.64 4.20 1.90 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 1.77 1.39 1.04 0.00 0.00 46 T 8.33 4.08 4.57 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 0.00 0.00 1.40 0.00 0.00 47 C 8.68 4.41 0.00 2.99 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 48 Y 7.55 4.01 0.00 3.23 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.32 3.92 0.00 2.22 2.36 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.04 2.71 0.00 50 Y 7.96 3.94 0.00 3.14 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 51 C 8.59 4.02 0.00 3.14 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 52 L 7.55 3.76 0.00 1.31 1.32 0.98 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.54 4.02 0.00 1.73 1.59 0.95 0.82 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 54 E 7.94 3.67 0.00 1.22 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 2.16 2.38 0.00 55 A 7.56 3.78 1.13 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 0.00 0.00 56 F 7.15 4.56 0.00 3.09 3.03 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 57 S 7.99 3.77 0.00 3.99 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 58 L 7.97 4.29 0.00 1.85 1.71 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.61 5.48 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 0.74 0.00 0.00 0.56 0.00 0.00 60 D 8.17 5.17 0.00 2.91 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 61 D 8.75 4.65 0.00 2.85 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 62 E 8.50 4.99 0.00 1.96 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 2.19 2.21 0.00 63 A 8.17 4.04 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.66 4.60 0.00 3.07 2.78 0.00 0.00 6.71 8.29 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 65 V 8.30 4.07 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 0.98 0.00 0.00 66 D 9.26 4.65 0.00 2.72 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 4.01 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 68 D 8.17 4.35 0.00 2.88 2.77 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 69 I 8.14 3.71 2.01 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 1.42 1.22 0.94 0.00 0.00 70 M 8.17 4.02 0.00 2.21 2.16 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 2.63 2.61 0.00 71 L 8.10 4.04 0.00 1.68 1.70 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.98 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 73 L 7.66 4.23 0.00 1.90 1.83 0.91 0.90 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 74 L 6.96 4.27 0.00 1.82 1.45 0.88 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.43 0.00 1.91 1.92 0.00 3.11 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 2.25 0.00 76 D 8.43 4.46 0.00 2.63 2.70 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 77 Q 8.03 4.00 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.96 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 78 L 7.23 3.91 0.00 1.39 1.41 -0.06 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 7.52 4.14 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 80 E 8.14 3.92 0.00 1.96 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 0.00 2.38 2.38 0.00 81 R 7.90 3.92 0.00 1.93 1.97 0.00 3.13 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 82 A 8.30 3.97 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 83 Q 8.02 3.92 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 84 S 7.77 4.23 0.00 3.90 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 85 V 7.98 3.83 2.21 0.00 0.00 0.00 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 1.01 0.00 0.00 86 M 8.36 4.47 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.58 0.00 87 G 7.36 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.88 4.08 0.00 1.76 1.95 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.51 7.81 89 C 8.46 4.53 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 90 L 6.91 4.77 0.00 1.82 1.59 0.94 1.09 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 91 P 0.00 4.50 0.00 2.19 2.06 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 92 T 8.19 4.19 4.28 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 1.26 0.00 0.00 93 S 8.51 4.62 0.00 3.97 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 94 G 7.92 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 0.00 0.00 0.00 0.00 95 S 8.25 4.43 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 96 D 7.37 4.41 0.00 2.83 2.73 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 97 N 8.29 4.09 0.00 2.23 1.67 0.00 0.00 6.82 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 98 C 7.92 4.34 0.00 3.09 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 99 N 9.28 4.25 0.00 2.79 2.88 0.00 0.00 7.28 7.47 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 0.00 100 K 8.32 4.60 0.00 2.02 1.89 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.48 7.81 101 I 7.64 3.97 2.15 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.12 1.05 0.00 0.00 102 Y 8.34 4.16 0.00 3.08 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 0.00 103 N 8.45 4.13 0.00 3.06 2.83 0.00 0.00 6.72 6.26 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 0.00 104 L 7.92 3.84 0.00 1.95 1.90 0.95 1.26 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 0.00 105 A 8.41 3.96 1.50 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 0.00 106 K 7.59 3.53 0.00 1.71 1.57 0.00 0.91 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.18 7.81 107 C 7.79 4.04 0.00 3.08 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 0.00 108 V 7.83 3.47 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 1.40 0.00 0.00 1.01 0.00 0.00 109 Q 7.01 3.23 0.00 0.93 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.75 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 110 E 7.56 3.97 0.00 1.98 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 0.00 2.26 2.28 0.00 111 S 8.04 4.42 0.00 3.88 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 0.00 112 A 8.13 4.76 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 0.00 113 P 0.00 4.53 0.00 2.12 2.17 0.00 3.74 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 114 D 8.44 4.63 0.00 2.74 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 0.00 115 V 7.81 4.32 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 0.68 0.00 0.00 1.11 0.00 0.00 116 W 7.76 4.69 0.00 3.57 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 0.00 117 F 7.08 4.30 0.00 2.81 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.33 3.86 1.73 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 0.82 0.00 0.00 0.57 0.00 0.00 119 I 7.86 3.67 1.68 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.47 0.59 0.00 0.00