NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4513 8.3044 118.1943 54.8717 32.6776 175.0937 2 S 3.8788 8.8192 116.6966 60.5199 62.6049 172.9373 3 A 4.2384 8.1128 120.1448 51.9564 21.5975 174.8420 4 T 4.6163 8.6093 119.0856 62.1151 71.6041 173.7436 5 A 4.6917 8.3017 127.2776 50.0744 22.4091 175.7967 6 A 3.9893 8.8267 124.3574 53.9050 19.1816 178.1021 7 T 3.4287 7.9058 103.4805 62.3680 67.0184 172.2837 8 V 3.7333 7.4212 115.2038 61.2904 32.7234 174.9007 9 P 4.4893 0.0000 0.0000 61.5709 31.9201 174.2445 10 P 4.2219 0.0000 0.0000 62.9416 31.6817 176.7968 11 A 3.9378 8.7773 124.7268 53.7844 18.7947 177.3411 12 A 3.7549 7.9797 115.8263 52.0632 15.4617 174.2612 13 P 4.1205 0.0000 0.0000 63.0802 32.0726 174.0942 14 A 3.7097 8.0293 126.6390 52.0280 19.7873 174.7160 15 G 3.8503 9.1661 117.6169 45.8441 0.0000 173.7821 16 E 3.7828 9.8744 117.5962 56.8611 27.4482 175.0348 17 G 3.7243 8.2668 105.8910 45.7042 0.0000 174.1376 18 G 4.4031 7.9103 108.8916 44.5600 0.0000 171.0961 19 P 4.4759 0.0000 0.0000 61.5512 32.4820 174.7378 20 P 4.1306 0.0000 0.0000 64.3321 31.6155 176.4666 21 A 3.6836 7.8538 118.7120 52.4369 15.1900 174.4460 22 P 4.5466 0.0000 0.0000 60.4086 33.0377 175.2057 23 P 4.2723 0.0000 0.0000 61.4403 32.1132 174.5700 24 P 4.4476 0.0000 0.0000 62.6930 31.9686 176.4291 25 N 4.4593 8.8774 118.5244 55.6363 38.7705 175.4333 26 L 4.7902 7.4259 115.8186 52.7224 44.3679 176.3719 27 T 4.0174 8.6048 117.0207 64.8373 67.5603 174.5737 28 S 4.7526 7.5387 113.9716 57.1731 67.1903 171.1162 29 N 4.8117 8.0923 122.7777 53.1866 45.7800 173.8398 30 R 4.3998 6.2029 121.6760 56.1399 37.7400 176.4621 31 R 3.8954 8.3216 117.9229 59.4702 30.5326 178.3311 32 L 4.3237 7.7701 119.5616 57.3748 41.4491 179.2732 33 Q 4.1888 7.9016 117.7755 58.6431 28.7978 178.6436 34 Q 4.1522 7.8716 117.6602 58.2388 28.9797 176.9115 35 T 4.2091 7.5148 116.7874 63.3925 69.4647 174.6759 36 Q 4.3100 8.4070 119.2285 57.1176 28.5808 177.9509 37 A 4.2716 7.8337 123.3857 54.1903 18.3836 179.3232 38 Q 3.8927 7.9377 118.0066 59.6807 29.1989 178.6676 39 V 3.8010 7.7227 112.6448 64.0617 31.3056 178.1883 40 D 4.3633 8.1968 119.2226 57.3982 40.2187 178.3731 41 E 4.0407 7.9524 119.1743 59.0904 29.5341 178.9648 42 V 3.6411 7.5096 118.2883 65.4685 31.4384 178.2037 43 V 3.5753 7.4858 118.1329 66.0572 31.4546 177.6791 44 D 4.3517 8.0302 118.0890 57.4450 40.7441 178.7120 45 I 3.7055 7.4602 119.7031 64.5611 37.2268 178.1534 46 M 4.0259 8.3893 119.4570 58.5737 31.9416 178.1702 47 R 3.8776 8.1658 118.9456 59.4177 30.2066 178.6760 48 V 4.2108 7.6688 119.1521 65.6123 31.5940 177.3762 49 N 4.3005 8.2158 116.8094 56.7090 38.4633 176.9470 50 V 3.6964 7.5286 118.7410 65.7565 32.0907 177.1031 51 D 4.6012 7.8924 116.7982 54.1893 39.4868 178.3327 52 K 3.9344 8.0985 122.2879 59.6385 32.3478 178.5891 53 V 3.7559 7.1613 116.8125 64.7322 31.3651 177.7251 54 L 4.0276 7.7845 119.6197 56.8114 42.4796 177.0282 55 E 4.1722 7.7765 118.6929 55.9908 30.2400 175.8684 56 R 4.5874 8.1101 122.8882 54.2431 33.8238 175.1798 57 D 4.5474 8.4829 120.5496 53.1978 40.7119 175.7547 58 Q 4.2138 8.3682 126.6051 55.3166 29.5492 177.8429 59 K 4.0899 8.7689 122.7317 59.5756 32.7058 178.4444 60 L 3.9642 8.0949 118.4322 56.6106 41.9173 178.0528 61 S 3.6417 7.9650 108.3112 58.8370 61.8147 173.3358 62 E 3.9229 8.0551 118.6710 57.8513 29.2418 178.0223 63 L 3.6954 7.4103 117.4479 55.3245 41.5460 173.5540 64 D 4.5879 7.6922 117.7035 54.3497 41.2032 176.1250 65 D 4.5641 8.8895 124.8031 56.9227 41.1515 177.0389 66 R 4.7182 7.6299 114.4719 54.5736 33.9830 174.6086 67 A 4.7028 7.9561 120.8795 51.4508 20.7535 177.3086 68 D 4.2595 8.3674 114.7899 54.4688 40.1043 176.3903 69 A 3.7046 7.8871 119.8460 52.0269 16.6719 176.7551 70 L 3.7117 8.1055 117.5221 57.2243 40.6216 177.4798 71 Q 4.2839 8.2808 130.1208 56.0404 36.1405 171.9272 72 A 4.5929 7.0661 121.2693 50.5328 22.6564 177.2078 73 G 3.8472 8.1792 105.5669 45.7180 0.0000 171.7767 74 A 3.9693 8.4121 121.8261 53.5216 18.3739 176.7657 75 S 3.6971 8.0222 113.8363 57.7530 62.9889 172.7057 76 Q 4.2568 8.3291 123.2290 57.2356 28.4438 178.4227 77 F 4.0986 8.2224 122.2514 61.2826 39.2844 176.4214 78 E 3.8644 7.6874 117.6167 59.4553 29.8241 178.5681 79 T 3.9791 7.8356 109.4456 64.6614 68.9948 176.3029 80 S 3.9899 8.2340 116.1615 61.2046 62.4436 176.0582 81 A 3.8953 7.5438 122.8337 54.8502 17.9385 179.4072 82 A 3.9780 7.6832 119.1550 55.2301 18.1684 179.9843 83 K 3.9365 7.6973 115.7480 59.5946 32.3071 179.2468 84 L 4.1802 7.8491 118.7318 57.8489 41.7056 179.6062 85 K 4.2106 8.2663 118.4610 59.4535 31.7421 179.3074 86 R 4.0940 8.0449 118.3951 59.3549 29.9738 178.3773 87 K 4.0386 7.6552 117.7738 59.6831 32.1021 178.5584 88 Y 3.7105 7.8272 115.2359 59.9442 38.0761 176.4826 89 W 4.2189 7.6470 118.5771 55.6176 30.5505 177.3081 90 W 5.3690 8.3999 114.2034 55.2070 28.1241 175.0706 91 K 4.0917 8.4629 125.2523 58.6268 32.1237 177.8527 92 N 4.4159 8.2427 118.0910 55.9825 37.1734 176.9986 93 L 3.9732 7.5994 120.9910 57.4716 41.6061 179.5995 94 K 3.9525 8.0555 117.9263 59.7802 32.0203 179.1197 95 M 4.0493 7.9495 118.5521 58.4794 31.7903 178.5228 96 M 4.0541 7.8436 118.0679 58.4560 32.1220 178.3802 97 I 3.6679 8.0079 120.3348 64.4550 37.3554 178.3261 98 I 3.7111 8.0084 119.6983 63.8067 37.8165 177.6145 99 L 4.0579 8.0644 121.5480 58.1266 41.8466 179.2168 100 G 3.6304 8.2890 105.7535 47.6299 0.0000 175.8197 101 V 3.5911 7.4163 120.1718 65.8713 31.3474 178.2067 102 I 3.6835 7.5505 118.9373 64.7540 37.0183 178.2725 103 C 4.1262 8.1930 117.2406 62.7086 27.8920 175.9958 104 A 4.0307 8.3157 122.8286 55.1963 17.9295 179.7714 105 I 3.6754 7.6115 118.0061 64.5776 37.1213 178.7094 106 I 3.7312 7.4920 120.5090 64.3563 36.8458 178.4741 107 L 3.9906 8.0001 119.7914 57.8556 41.3526 179.6753 108 I 3.7262 7.8292 119.7186 64.4233 37.0628 178.5668 109 I 3.7618 7.8755 120.6070 64.4522 36.8559 178.5932 110 I 3.8514 8.0261 120.7457 64.4629 36.9289 178.5976 111 I 3.7960 8.0769 120.8627 64.3984 36.9618 178.7493 112 V 3.7088 8.1814 120.7838 65.5636 31.1694 177.4045 113 Y 4.0586 8.4695 118.5340 60.6679 38.7377 177.4790 114 F 4.1669 8.5609 120.9669 61.1999 40.0251 176.7138 115 S 4.1079 8.4150 112.4345 58.8683 63.0420 174.3518 116 T 3.7841 7.8950 124.4330 64.0981 68.9846 171.7890 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 8.30 4.45 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 2 S 8.82 3.88 0.00 3.93 3.93 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 3 A 8.11 4.24 1.21 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 0.00 0.00 4 T 8.61 4.62 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 1.21 0.00 0.00 5 A 8.30 4.69 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 0.00 0.00 6 A 8.83 3.99 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 T 7.91 3.43 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 1.24 0.00 0.00 8 V 7.42 3.73 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 0.70 0.00 0.00 0.93 0.00 0.00 9 P 0.00 4.49 0.00 2.17 2.07 0.00 3.79 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 1.98 1.99 0.00 10 P 0.00 4.22 0.00 2.06 2.05 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 11 A 8.78 3.94 1.28 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 0.00 0.00 12 A 7.98 3.75 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 13 P 0.00 4.12 0.00 2.05 2.14 0.00 3.84 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 14 A 8.03 3.71 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 15 G 9.17 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 0.00 0.00 0.00 16 E 9.87 3.78 0.00 2.10 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 2.22 2.23 0.00 17 G 8.27 3.72 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 0.00 0.00 0.00 18 G 7.91 4.40 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 0.00 19 P 0.00 4.48 0.00 2.19 2.08 0.00 3.80 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 1.99 1.99 0.00 20 P 0.00 4.13 0.00 2.06 2.18 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 21 A 7.85 3.68 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 22 P 0.00 4.55 0.00 2.19 2.06 0.00 3.81 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 1.98 1.98 0.00 23 P 0.00 4.27 0.00 2.05 2.07 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 24 P 0.00 4.45 0.00 2.38 2.05 0.00 3.77 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 1.98 1.98 0.00 25 N 8.88 4.46 0.00 2.73 2.92 0.00 0.00 6.83 7.85 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 26 L 7.43 4.79 0.00 1.60 1.55 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 27 T 8.60 4.02 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 1.21 0.00 0.00 28 S 7.54 4.75 0.00 3.83 3.68 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 29 N 8.09 4.81 0.00 2.63 2.53 0.00 0.00 6.81 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 30 R 6.20 4.40 0.00 1.78 1.75 0.00 3.15 0.00 0.00 3.09 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 31 R 8.32 3.90 0.00 1.84 1.94 0.00 3.30 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 32 L 7.77 4.32 0.00 1.73 1.70 0.92 1.04 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 33 Q 7.90 4.19 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 34 Q 7.87 4.15 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.60 2.54 0.00 35 T 7.51 4.21 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 1.21 0.00 0.00 36 Q 8.41 4.31 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 37 A 7.83 4.27 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 38 Q 7.94 3.89 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 39 V 7.72 3.80 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 0.94 0.00 0.00 40 D 8.20 4.36 0.00 2.79 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 41 E 7.95 4.04 0.00 2.09 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 2.30 2.35 0.00 42 V 7.51 3.64 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 1.11 0.00 0.00 1.01 0.00 0.00 43 V 7.49 3.58 2.25 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 0.93 0.00 0.00 1.03 0.00 0.00 44 D 8.03 4.35 0.00 2.88 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 45 I 7.46 3.71 2.01 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 1.41 0.93 0.91 0.00 0.00 46 M 8.39 4.03 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.69 0.00 47 R 8.17 3.88 0.00 1.99 2.06 0.00 3.15 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 48 V 7.67 4.21 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 1.47 0.00 0.00 0.99 0.00 0.00 49 N 8.22 4.30 0.00 2.89 2.97 0.00 0.00 6.88 7.28 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 50 V 7.53 3.70 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 0.86 0.00 0.00 0.99 0.00 0.00 51 D 7.89 4.60 0.00 2.95 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 52 K 8.10 3.93 0.00 1.89 2.04 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.45 7.81 53 V 7.16 3.76 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 0.84 0.00 0.00 0.93 0.00 0.00 54 L 7.78 4.03 0.00 1.64 1.88 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 55 E 7.78 4.17 0.00 2.03 1.83 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 2.32 2.33 0.00 56 R 8.11 4.59 0.00 1.78 1.76 0.00 3.42 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.52 0.00 57 D 8.48 4.55 0.00 2.63 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.37 4.21 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.42 6.69 0.00 0.00 0.00 0.00 0.00 2.60 2.33 0.00 59 K 8.77 4.09 0.00 1.72 1.87 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.53 7.81 60 L 8.09 3.96 0.00 1.71 1.72 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 61 S 7.96 3.64 0.00 4.09 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 62 E 8.06 3.92 0.00 2.09 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 2.33 2.36 0.00 63 L 7.41 3.70 0.00 1.88 1.74 0.93 1.23 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 64 D 7.69 4.59 0.00 2.66 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 65 D 8.89 4.56 0.00 2.68 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 66 R 7.63 4.72 0.00 1.73 1.95 0.00 3.17 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 1.54 1.63 0.00 67 A 7.96 4.70 1.24 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 0.00 0.00 0.00 68 D 8.37 4.26 0.00 2.80 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 69 A 7.89 3.70 1.35 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 0.00 0.00 0.00 70 L 8.11 3.71 0.00 1.65 1.51 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.28 4.28 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.70 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 72 A 7.07 4.59 1.20 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 0.00 0.00 73 G 8.18 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 0.00 0.00 0.00 74 A 8.41 3.97 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 75 S 8.02 3.70 0.00 4.06 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 76 Q 8.33 4.26 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.69 0.00 0.00 0.00 0.00 0.00 2.48 2.24 0.00 77 F 8.22 4.10 0.00 3.15 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 78 E 7.69 3.86 0.00 1.92 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 2.32 2.33 0.00 79 T 7.84 3.98 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 1.27 0.00 0.00 80 S 8.23 3.99 0.00 3.86 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 81 A 7.54 3.90 1.10 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 0.00 0.00 82 A 7.68 3.98 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 83 K 7.70 3.94 0.00 1.94 1.88 0.00 1.58 0.00 0.00 1.80 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.53 7.81 84 L 7.85 4.18 0.00 1.90 1.81 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.27 4.21 0.00 2.05 2.06 0.00 1.74 0.00 0.00 1.59 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.67 7.81 86 R 8.04 4.09 0.00 1.97 2.19 0.00 3.31 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 87 K 7.66 4.04 0.00 1.70 1.58 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.67 7.81 88 Y 7.83 3.71 0.00 2.82 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.65 4.22 0.00 3.32 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 90 W 8.40 5.37 0.00 3.62 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 91 K 8.46 4.09 0.00 1.90 1.94 0.00 1.61 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.60 7.81 92 N 8.24 4.42 0.00 2.96 3.15 0.00 0.00 6.33 6.77 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 93 L 7.60 3.97 0.00 1.42 1.62 0.47 1.05 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 94 K 8.06 3.95 0.00 2.00 1.87 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.58 7.81 95 M 7.95 4.05 0.00 2.03 2.31 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 2.64 2.92 0.00 96 M 7.84 4.05 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 97 I 8.01 3.67 1.98 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.77 0.89 0.00 0.00 98 I 8.01 3.71 1.87 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 1.40 1.34 0.98 0.00 0.00 99 L 8.06 4.06 0.00 1.91 1.80 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.29 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 0.00 0.00 0.00 101 V 7.42 3.59 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 1.02 0.00 0.00 0.99 0.00 0.00 102 I 7.55 3.68 2.00 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 1.52 0.73 0.91 0.00 0.00 103 C 8.19 4.13 0.00 3.10 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 0.00 104 A 8.32 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 0.00 105 I 7.61 3.68 2.06 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 1.52 1.11 0.91 0.00 0.00 106 I 7.49 3.73 2.03 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 1.51 0.71 0.90 0.00 0.00 107 L 8.00 3.99 0.00 1.86 1.72 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.83 3.73 2.05 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 1.53 0.90 0.93 0.00 0.00 109 I 7.88 3.76 2.04 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 1.54 0.75 0.92 0.00 0.00 110 I 8.03 3.85 2.05 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 1.53 0.89 0.96 0.00 0.00 111 I 8.08 3.80 2.06 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 1.52 0.82 0.96 0.00 0.00 112 V 8.18 3.71 2.32 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 1.06 0.00 0.00 1.01 0.00 0.00 113 Y 8.47 4.06 0.00 3.02 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 0.00 114 F 8.56 4.17 0.00 3.17 3.30 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 0.00 115 S 8.42 4.11 0.00 4.11 4.19 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 0.00 116 T 7.89 3.78 4.06 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 0.00 0.00 1.09 0.00 0.00