NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2937 8.2393 120.8628 55.4958 31.2779 174.9068 2 V 3.5800 8.1678 121.4647 62.1587 31.5350 174.1221 3 S 4.6740 8.0338 117.4340 57.0637 67.7710 175.0048 4 H 4.6068 8.5119 117.6856 55.3944 28.8873 175.4877 5 Q 3.9096 8.7383 123.6613 59.4687 29.7693 175.8271 6 G 3.6019 8.5600 102.4372 46.0508 0.0000 171.2893 7 Y 4.6139 7.6185 120.7659 57.4481 40.5975 178.0472 8 S 4.7572 8.5091 113.5098 57.5593 63.7589 172.8800 9 T 4.4236 8.2920 113.0874 62.6870 73.9838 173.3624 10 E 4.3641 8.1243 118.2041 55.5137 31.5082 174.6821 11 A 4.6551 8.2684 120.9977 50.7321 21.1303 177.1943 12 E 4.1618 8.8185 120.5629 57.0731 29.6579 177.4951 13 F 5.0566 7.9829 115.0877 56.2847 37.6642 173.9755 14 E 4.4357 7.2650 121.6810 56.9568 32.2006 176.7010 15 E 4.8933 7.3830 120.1174 54.9577 29.9793 172.7039 16 P 4.4595 0.0000 0.0000 64.1275 33.0132 177.6545 17 R 4.6399 7.3528 112.5555 52.9502 32.7402 177.1011 18 V 3.4274 7.0042 118.5011 65.0157 31.2692 177.5634 19 I 3.5453 7.1227 121.9048 64.2181 37.0790 178.0872 20 D 4.4986 7.8393 119.6951 57.2382 40.8645 178.2501 21 L 4.0194 7.7137 120.3314 58.9568 40.0333 179.2478 22 W 4.6877 7.9620 118.0383 58.6347 29.3536 177.9063 23 D 4.6259 8.3018 118.9273 57.5233 40.7336 178.1982 24 L 4.1221 8.0097 118.5435 57.2643 41.5231 178.7300 25 A 3.9088 7.9131 119.7488 54.0835 18.3073 178.6795 26 Q 4.0418 7.6829 116.7847 58.1489 29.2511 176.5960 27 S 4.4095 8.1318 109.2603 58.6317 66.0841 174.4136 28 A 3.8137 7.2781 120.9050 55.3909 18.5586 177.5651 29 N 4.8708 7.5366 115.0201 51.1875 40.8144 175.0732 30 L 4.7005 7.3785 126.8132 54.4605 40.8719 178.0932 31 T 4.7039 7.9817 117.0813 60.0359 71.8796 174.3528 32 D 4.4049 8.7365 121.6745 57.3421 40.6987 179.1624 33 K 3.8549 7.8741 119.4989 59.4110 32.4683 177.9864 34 E 3.8775 8.1841 119.1239 59.6202 29.3366 177.9958 35 L 3.8065 8.3286 120.1945 58.6148 42.1031 178.5916 36 E 3.9701 8.4493 118.6531 59.0217 29.5769 178.8875 37 A 3.9213 8.1267 120.9344 55.2260 18.5115 179.1094 38 F 4.2228 8.7093 120.7525 60.7149 39.2800 177.3784 39 R 3.4965 8.4056 118.6322 59.3250 30.0224 178.3810 40 E 3.9661 8.1469 117.7444 59.2355 29.1985 178.8370 41 E 3.8247 8.0315 118.6476 59.2681 29.6112 179.2675 42 L 3.9111 7.8897 120.5624 56.8266 41.5139 179.3412 43 K 3.8747 7.8600 119.9102 59.8274 32.1339 178.5860 44 H 4.1140 8.3794 116.5184 58.6735 28.5125 177.4977 45 F 3.9460 8.2520 122.7066 61.1310 39.2381 176.6620 46 E 3.9555 9.0488 117.4221 59.6584 29.1342 178.9426 47 A 3.9160 7.9012 121.6823 54.7134 18.3740 179.8064 48 K 3.7644 7.8764 116.8790 59.6122 32.0383 179.5672 49 I 3.5238 7.6311 118.9709 63.7299 37.8110 177.4909 50 E 3.9151 8.4235 120.8340 59.1822 29.4484 179.0558 51 K 3.8695 7.9949 118.5583 59.3786 32.1105 178.4311 52 H 3.9749 8.2479 118.9085 59.5326 29.6369 176.1638 53 N 4.1693 8.4197 118.7666 57.3536 38.7321 175.9887 54 H 4.1302 8.2782 119.1130 59.7336 29.8162 176.7216 55 Y 4.2606 8.4257 118.3625 60.9063 37.8094 177.8771 56 Q 3.9887 8.6753 119.5259 58.8070 28.7783 179.2005 57 K 3.9835 8.2894 119.4760 59.7349 32.1289 179.5547 58 Q 4.0537 8.1725 117.9879 58.5489 28.4666 179.1485 59 L 3.8608 8.0778 120.7105 57.8112 41.6869 178.9647 60 E 3.9552 8.1889 119.1782 59.4163 29.5511 178.9562 61 I 3.7168 7.9482 119.6845 64.0346 37.0606 178.2603 62 A 3.9649 8.1987 122.0209 55.3764 18.2109 179.1146 63 H 4.1189 8.7926 117.0377 59.3623 29.9600 176.8273 64 E 3.8082 8.2738 121.0654 59.5282 29.5486 179.1358 65 K 4.0758 8.1320 118.0354 58.9053 31.9965 179.1520 66 L 3.9432 8.2180 121.9063 58.0955 42.1573 178.9908 67 R 4.0291 8.1739 116.1738 59.7128 28.9715 178.1310 68 H 4.1513 8.1925 117.6401 58.3980 30.1108 176.6540 69 A 4.2549 8.0549 122.8111 54.7824 18.5804 179.3427 70 E 3.9827 8.6386 117.5684 59.4085 29.2637 178.9483 71 S 4.3601 7.8925 109.3311 58.8991 62.1558 174.4699 72 V 4.1447 7.9997 120.4140 61.4077 33.1922 176.8451 73 G 3.9870 7.9138 107.0914 44.8075 0.0000 174.4017 74 D 4.1338 7.9155 119.1441 55.2878 40.9652 175.5441 75 G 3.9866 7.3841 110.6134 46.4006 0.0000 175.0445 76 E 3.8899 8.0694 118.9699 58.8510 29.8064 179.8320 77 R 3.9902 8.7675 115.8755 58.6810 29.6111 178.8222 78 V 3.5435 7.6639 119.0027 66.0948 31.5141 177.9741 79 S 4.1017 8.2401 114.9718 61.6814 62.7332 176.7307 80 R 3.8584 8.1510 121.4039 59.3515 29.6765 178.2379 81 S 4.1040 8.4799 115.4554 62.1300 62.8686 176.9032 82 R 3.8775 8.1055 120.1044 59.2876 29.8411 178.8803 83 E 3.8686 8.3965 119.0813 59.3685 29.7160 178.9325 84 K 3.9891 8.1445 119.5173 59.2317 32.1821 178.3652 85 H 3.9993 8.5084 118.9016 59.1786 29.7979 176.9315 86 A 4.0372 8.3920 122.9877 55.0773 18.1976 179.1012 87 L 3.8952 7.9221 118.6376 58.4915 42.1090 179.2322 88 L 4.0421 8.1546 118.9694 57.9974 41.5200 179.4690 89 E 4.3607 8.1934 120.3039 58.6510 29.3439 179.6594 90 G 3.6388 8.3991 106.2413 47.9922 0.0000 175.8200 91 R 4.0576 8.2703 121.8403 58.8995 30.0501 178.7767 92 T 4.0656 8.1981 110.0593 64.6899 68.8935 176.4753 93 K 3.9460 8.2631 123.2301 58.9832 32.2472 178.3625 94 E 4.0242 8.3134 119.3980 59.2257 29.6139 178.4396 95 L 4.0169 8.4076 120.9352 58.0941 42.1743 178.9229 96 G 3.7293 8.4963 106.1172 48.1046 0.0000 174.8336 97 Y 4.1586 8.2744 122.0101 60.7766 38.7725 178.4202 98 T 3.3989 7.9699 116.5820 66.3852 68.4743 176.5822 99 V 3.8616 8.3482 120.4959 66.1968 31.5722 177.7091 100 K 3.2080 8.3414 119.4112 59.6409 31.9159 178.4202 101 K 3.7702 7.9879 118.7054 59.9715 31.9743 178.9859 102 H 4.2145 8.6272 116.3531 58.9796 28.6148 177.3501 103 L 4.2363 8.7191 121.2171 58.6695 41.4743 179.6305 104 Q 4.1655 8.3586 117.5319 59.0211 28.6758 178.3552 105 D 4.2903 8.1390 119.4962 57.2644 41.3328 178.1869 106 L 3.7219 8.4181 119.6377 57.5352 41.5650 179.3731 107 S 4.4447 8.8988 113.7678 61.7142 61.8722 176.0521 108 G 3.8165 8.1735 107.9700 48.4917 0.0000 175.6250 109 R 3.8279 8.1881 120.6149 58.7727 30.0855 179.4277 110 I 3.6811 7.9764 118.8413 64.4661 37.1464 178.5022 111 S 4.3283 7.9532 115.3956 60.7691 62.6315 176.6612 112 R 4.0978 7.4944 118.1498 58.3365 30.5053 176.8491 113 A 3.5315 7.9609 122.7137 51.6709 15.0816 176.3329 114 R 3.8626 7.6799 118.7830 56.5399 31.0633 177.7769 115 H 5.4995 6.9429 127.0160 56.7965 29.2110 175.8791 116 N 4.7030 7.4595 117.1413 52.2119 37.7548 173.6784 117 E 3.6463 7.7866 121.7326 55.8742 30.5654 173.9596 118 L 4.2987 8.1511 117.8549 54.8084 42.2703 176.7207 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 R 8.24 4.29 0.00 1.80 1.91 0.00 3.40 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 2 V 8.17 3.58 2.10 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 0.76 0.00 0.00 0.96 0.00 0.00 3 S 8.03 4.67 0.00 3.86 3.80 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 4 H 8.51 4.61 0.00 3.23 3.28 0.00 5.15 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 5 Q 8.74 3.91 0.00 2.09 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.45 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 6 G 8.56 3.60 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 0.00 0.00 0.00 7 Y 7.62 4.61 0.00 2.94 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 8 S 8.51 4.76 0.00 3.86 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 0.00 9 T 8.29 4.42 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 10 E 8.12 4.36 0.00 2.27 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 2.28 0.00 11 A 8.27 4.66 1.37 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 0.00 0.00 12 E 8.82 4.16 0.00 1.75 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 13 F 7.98 5.06 0.00 3.08 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 14 E 7.27 4.44 0.00 2.05 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 0.00 2.41 2.41 0.00 15 E 7.38 4.89 0.00 1.88 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 2.18 2.29 0.00 16 P 0.00 4.46 0.00 2.20 2.02 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 17 R 7.35 4.64 0.00 1.83 1.84 0.00 3.42 0.00 0.00 3.21 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 18 V 7.00 3.43 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 0.17 0.00 0.00 0.83 0.00 0.00 19 I 7.12 3.55 1.85 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 1.58 1.06 1.04 0.00 0.00 20 D 7.84 4.50 0.00 2.79 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 21 L 7.71 4.02 0.00 1.93 2.06 1.15 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 22 W 7.96 4.69 0.00 3.63 3.35 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 23 D 8.30 4.63 0.00 3.02 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 24 L 8.01 4.12 0.00 1.79 1.71 1.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.91 3.91 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 26 Q 7.68 4.04 0.00 2.42 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.67 0.00 0.00 0.00 0.00 0.00 2.54 2.72 0.00 27 S 8.13 4.41 0.00 3.81 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 28 A 7.28 3.81 1.23 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 0.00 0.00 29 N 7.54 4.87 0.00 2.63 2.69 0.00 0.00 6.89 7.77 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 30 L 7.38 4.70 0.00 1.49 1.09 0.77 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 31 T 7.98 4.70 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 1.23 0.00 0.00 32 D 8.74 4.40 0.00 2.70 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 33 K 7.87 3.85 0.00 1.78 1.78 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.43 7.81 34 E 8.18 3.88 0.00 2.00 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 2.34 2.27 0.00 35 L 8.33 3.81 0.00 1.71 1.83 1.01 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.45 3.97 0.00 2.17 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 0.00 2.32 2.39 0.00 37 A 8.13 3.92 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 38 F 8.71 4.22 0.00 3.00 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 39 R 8.41 3.50 0.00 2.28 2.01 0.00 3.32 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 40 E 8.15 3.97 0.00 2.23 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 0.00 2.25 2.31 0.00 41 E 8.03 3.82 0.00 2.07 2.26 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 2.17 1.97 0.00 42 L 7.89 3.91 0.00 1.12 1.43 0.09 0.78 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 43 K 7.86 3.87 0.00 2.06 1.85 0.00 1.49 0.00 0.00 1.62 0.00 0.00 3.25 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.50 7.81 44 H 8.38 4.11 0.00 3.38 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.25 3.95 0.00 3.21 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 46 E 9.05 3.96 0.00 2.27 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 0.00 2.31 2.73 0.00 47 A 7.90 3.92 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 48 K 7.88 3.76 0.00 1.82 1.64 0.00 1.58 0.00 0.00 1.43 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.50 7.81 49 I 7.63 3.52 1.53 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.50 0.92 0.00 0.00 50 E 8.42 3.92 0.00 2.23 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 2.32 2.36 0.00 51 K 7.99 3.87 0.00 1.79 1.44 0.00 1.71 0.00 0.00 1.42 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.40 7.81 52 H 8.25 3.97 0.00 3.04 3.48 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.42 4.17 0.00 2.88 3.15 0.00 0.00 6.97 8.08 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 54 H 8.28 4.13 0.00 3.52 3.55 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 8.43 4.26 0.00 3.23 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 56 Q 8.68 3.99 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.14 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 57 K 8.29 3.98 0.00 1.93 1.84 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.63 7.81 58 Q 8.17 4.05 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 59 L 8.08 3.86 0.00 1.79 1.63 0.89 0.50 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 60 E 8.19 3.96 0.00 2.24 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 2.36 2.35 0.00 61 I 7.95 3.72 1.86 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 1.45 0.72 0.90 0.00 0.00 62 A 8.20 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.79 4.12 0.00 3.20 3.52 0.00 5.80 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.27 3.81 0.00 2.12 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 2.31 2.36 0.00 65 K 8.13 4.08 0.00 2.00 1.83 0.00 1.70 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.57 7.81 66 L 8.22 3.94 0.00 1.77 1.79 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.17 4.03 0.00 2.02 2.11 0.00 2.76 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 68 H 8.19 4.15 0.00 3.35 3.46 0.00 5.74 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.05 4.25 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 70 E 8.64 3.98 0.00 1.96 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 2.32 2.30 0.00 71 S 7.89 4.36 0.00 3.94 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 72 V 8.00 4.14 2.10 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 0.85 0.00 0.00 0.94 0.00 0.00 73 G 7.91 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 0.00 0.00 0.00 74 D 7.92 4.13 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 75 G 7.38 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 0.00 0.00 0.00 76 E 8.07 3.89 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 2.38 2.45 0.00 77 R 8.77 3.99 0.00 2.04 2.22 0.00 2.83 0.00 0.00 3.08 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 78 V 7.66 3.54 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 1.00 0.00 0.00 0.94 0.00 0.00 79 S 8.24 4.10 0.00 4.04 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 80 R 8.15 3.86 0.00 2.02 1.91 0.00 3.11 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 81 S 8.48 4.10 0.00 4.13 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 82 R 8.11 3.88 0.00 2.08 1.98 0.00 3.11 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 83 E 8.40 3.87 0.00 1.98 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 0.00 2.30 2.45 0.00 84 K 8.14 3.99 0.00 1.95 1.73 0.00 1.54 0.00 0.00 1.44 0.00 0.00 2.67 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.37 1.51 7.81 85 H 8.51 4.00 0.00 3.36 3.43 0.00 5.65 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 86 A 8.39 4.04 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 87 L 7.92 3.90 0.00 1.79 1.92 1.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.15 4.04 0.00 1.89 1.64 0.36 0.76 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 89 E 8.19 4.36 0.00 2.17 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 2.26 2.29 0.00 90 G 8.40 3.64 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 0.00 0.00 0.00 91 R 8.27 4.06 0.00 2.10 2.32 0.00 3.06 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 92 T 8.20 4.07 4.37 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 1.25 0.00 0.00 93 K 8.26 3.95 0.00 1.97 1.89 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.49 1.63 7.81 94 E 8.31 4.02 0.00 2.18 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 2.42 0.00 95 L 8.41 4.02 0.00 1.75 1.57 0.63 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.50 3.73 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 0.00 0.00 0.00 97 Y 8.27 4.16 0.00 3.16 3.32 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 98 T 7.97 3.40 4.34 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 1.20 0.00 0.00 99 V 8.35 3.86 2.22 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 1.19 0.00 0.00 0.59 0.00 0.00 100 K 8.34 3.21 0.00 1.67 1.83 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.98 1.66 7.81 101 K 7.99 3.77 0.00 1.63 1.57 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.91 1.05 7.81 102 H 8.63 4.21 0.00 3.54 3.08 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 0.00 103 L 8.72 4.24 0.00 1.69 1.51 1.02 0.55 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 0.00 104 Q 8.36 4.17 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 105 D 8.14 4.29 0.00 2.81 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 0.00 106 L 8.42 3.72 0.00 1.08 0.50 0.57 -0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.90 4.44 0.00 4.05 4.10 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 0.00 108 G 8.17 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 0.00 109 R 8.19 3.83 0.00 1.79 1.92 0.00 3.02 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.82 0.00 110 I 7.98 3.68 2.07 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 1.43 0.43 0.98 0.00 0.00 111 S 7.95 4.33 0.00 3.94 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 0.00 112 R 7.49 4.10 0.00 1.90 2.04 0.00 3.19 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.67 0.00 113 A 7.96 3.53 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 0.00 114 R 7.68 3.86 0.00 1.71 1.90 0.00 3.43 0.00 0.00 2.92 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.48 0.00 115 H 6.94 5.50 0.00 3.37 3.44 0.00 5.77 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 N 7.46 4.70 0.00 2.67 2.81 0.00 0.00 6.90 7.70 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 0.00 117 E 7.79 3.65 0.00 2.08 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 0.00 2.25 2.23 0.00 118 L 8.15 4.30 0.00 1.57 1.45 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00