NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4794 8.2893 120.3324 55.4241 33.1164 174.8512 2 T 4.1584 7.4242 109.0946 59.0627 71.7696 173.0447 3 H 5.0153 7.4219 125.0309 55.4708 28.1359 178.1825 4 D 4.4604 8.7059 120.6678 52.5693 40.7873 171.3570 5 N 4.0081 9.0517 123.9888 53.7315 38.5650 174.6092 6 K 3.5335 8.5226 127.8418 57.3689 30.7276 174.4987 7 L 4.6777 7.8047 124.5316 54.4247 45.2077 176.4982 8 Q 4.3792 7.9306 118.1940 55.9962 30.2663 173.5261 9 V 4.4112 8.3213 127.5214 63.4099 32.3658 177.1032 10 E 4.2761 7.7210 116.5033 53.6111 27.4066 176.5260 11 A 4.2756 7.1813 117.4715 51.4192 22.1010 175.9780 12 I 4.6001 7.8006 115.7076 58.3669 41.1913 176.5752 13 K 2.4800 7.9346 120.8231 58.1664 32.3315 176.7441 14 R 4.8016 8.0654 115.9259 54.1972 33.8902 175.2701 15 G 4.4570 6.1866 106.0605 44.7572 0.0000 171.9409 16 T 4.9988 8.0034 115.2371 61.6943 72.7978 174.0203 17 V 4.3329 8.3293 123.2970 61.3290 33.9879 174.4943 18 I 4.4474 8.8629 131.3252 60.5821 36.2179 175.4655 19 D 4.2845 9.4698 127.1876 53.5542 42.8624 174.6617 20 H 4.3470 8.1485 116.5936 56.9077 26.2053 175.4975 21 I 4.3648 7.6217 119.6387 59.2437 39.3135 175.6045 22 P 4.5339 0.0000 0.0000 62.9454 32.1890 175.5646 23 A 4.3192 8.6792 125.3383 54.2179 17.9862 176.7203 24 Q 4.2802 10.1905 120.8062 56.8565 28.4065 176.3548 25 I 3.6523 7.6917 118.1202 64.0121 36.7705 178.0814 26 G 3.8756 8.2895 106.4737 48.0183 0.0000 174.7252 27 F 4.5286 7.6788 122.6467 61.6850 39.7206 176.9016 28 K 3.4013 8.5335 115.8382 59.6928 31.7928 178.9204 29 L 3.8665 7.8518 118.0700 58.1469 41.8354 179.7342 30 L 4.0534 7.7661 119.0869 57.8881 41.4388 179.7323 31 S 4.0474 8.4014 114.2413 61.0597 63.1610 175.7423 32 L 3.6248 7.4865 123.4138 57.4032 41.6186 178.1504 33 F 4.5626 7.5381 114.1250 55.8398 40.3544 176.4085 34 K 3.9482 8.5548 118.0583 57.6515 29.7186 175.9289 35 L 4.2926 8.2460 116.1620 56.3174 42.6863 178.4622 36 T 4.3194 7.7144 112.7166 62.5772 67.7866 174.3616 37 E 4.5094 7.7794 119.8596 57.7333 29.6162 175.9301 38 T 4.5770 7.4042 113.8827 60.6833 69.5904 173.1988 39 D 4.8839 8.2757 118.8377 53.6652 42.5521 176.5331 40 Q 4.0749 7.8191 118.1440 55.3000 29.4490 176.1419 41 R 4.0559 8.3098 120.4361 57.0325 30.0771 175.3516 42 I 4.7288 8.1277 126.8147 60.5705 39.0477 175.6548 43 T 4.6505 8.7546 114.5460 60.3130 71.8887 172.6109 44 I 4.7804 8.6312 126.6298 59.1752 40.5014 175.0938 45 G 4.0418 9.2383 114.4205 44.5975 0.0000 171.7697 46 L 5.5058 8.3632 126.4055 52.9177 43.9188 176.8672 47 N 4.6376 8.8508 119.1780 53.8843 36.2865 174.2516 48 L 4.2291 7.3482 119.5219 54.0433 40.2433 174.6378 49 P 5.0967 0.0000 0.0000 62.6663 31.5630 174.9143 50 S 4.4682 9.4964 112.3308 58.1869 63.9857 176.1951 51 G 4.7191 6.8575 117.4952 45.7387 0.0000 173.0305 52 E 3.9622 8.0041 121.6490 58.1224 29.6452 177.4500 53 M 4.5101 7.7158 119.1664 53.2516 33.1706 176.5482 54 G 3.9732 8.7988 114.1571 48.1122 0.0000 172.3968 55 R 4.7844 7.7661 119.2543 54.1281 33.6306 174.6133 56 K 4.7555 8.2500 122.5586 54.7606 35.0105 176.1966 57 D 4.7845 9.2707 125.0521 54.6356 42.5545 174.9844 58 L 4.7546 8.2814 117.8832 54.6683 46.2194 173.2885 59 I 5.1492 8.0993 125.7864 59.5737 41.7638 174.5156 60 K 5.6221 8.5174 122.6282 55.9330 36.2593 174.8162 61 I 4.8085 8.4067 123.6346 59.4536 40.5738 173.8600 62 E 4.6839 8.4834 126.3820 56.2005 30.8527 176.7868 63 N 4.2829 8.6674 122.6355 53.7210 37.3927 174.1103 64 T 4.4750 7.0771 114.3782 61.7005 70.3124 173.7844 65 F 5.4717 8.3190 122.5058 54.3491 41.4712 175.1206 66 L 4.1875 8.7405 126.3531 54.6265 41.8931 177.4941 67 S 4.5969 8.4662 117.1434 57.3619 65.9226 175.0767 68 E 4.1198 8.7865 123.6577 60.0980 29.2901 179.5606 69 D 4.3094 7.9975 118.1436 57.3385 40.9332 178.1930 70 Q 3.9430 8.9833 118.7220 59.4508 29.0184 179.5497 71 V 3.5653 8.9622 119.3041 66.0690 31.4818 177.4065 72 D 4.4527 7.9292 117.8150 57.9912 40.4312 179.2426 73 Q 3.6844 7.9365 117.6014 59.1804 28.6672 178.9441 74 L 4.3371 8.1741 118.7646 56.2735 41.4438 178.2659 75 A 4.2013 8.6265 121.2127 53.3826 18.3877 178.1559 76 L 4.1314 7.5666 117.7958 55.8759 42.5352 176.3657 77 Y 4.6614 7.7497 112.7259 57.9320 40.7565 175.8221 78 A 4.7408 8.2485 120.5331 51.1915 20.9932 175.1781 79 P 4.4920 0.0000 0.0000 64.0588 32.3268 178.1352 80 Q 4.3477 8.0514 115.7550 55.9266 29.0549 174.8549 81 A 4.8958 7.6439 121.7440 51.2846 22.0474 176.5213 82 T 4.6994 8.3534 108.3561 60.0635 71.4993 173.6144 83 V 4.5094 8.5979 126.4779 62.0520 33.7088 174.3117 84 N 5.2461 8.5701 123.5752 51.5659 41.8700 174.0902 85 R 4.2151 9.0870 126.3654 55.8227 29.2013 173.3012 86 I 4.4270 8.5618 123.9692 60.1802 38.5331 173.9893 87 D 4.8182 8.4747 127.4286 52.6842 44.3419 175.2700 88 N 3.9249 9.5756 123.3546 55.0094 37.3792 174.9176 89 Y 3.8915 7.6028 111.8965 57.9765 37.8956 169.7528 90 E 4.6635 7.8121 121.0960 53.4081 31.6893 175.0507 91 V 3.7700 8.4671 124.9517 62.7523 31.3088 176.0243 92 V 4.0546 8.5270 119.1032 62.9007 32.7041 177.0755 93 G 4.0549 7.7120 104.5170 45.0154 0.0000 172.3767 94 K 5.1132 8.8564 126.0113 54.7608 33.7464 175.0938 95 S 4.9013 8.9608 122.6186 56.5775 66.5521 172.7022 96 R 5.1491 8.4021 118.7326 52.8490 33.1388 172.5383 97 P 4.4512 0.0000 0.0000 63.2403 31.5592 175.5219 98 S 4.6965 8.3946 119.6435 55.8017 64.8754 173.9488 99 L 3.9381 8.4172 125.4757 54.8385 42.2360 174.9141 100 P 4.7512 0.0000 0.0000 61.2548 33.3381 175.8308 101 E 4.1134 8.6232 117.8057 58.8254 29.5241 177.1190 102 R 4.9051 7.4679 111.8071 55.4900 32.5899 174.1753 103 I 4.4354 8.7436 121.7318 59.0400 38.7225 174.7631 104 D 4.9208 9.2705 128.2462 53.8331 42.2249 176.9646 105 N 3.9418 7.4131 115.2996 56.1828 35.2930 173.3606 106 V 3.7548 6.6870 126.7597 60.3431 34.1774 172.1675 107 L 4.3180 7.0941 114.8862 54.2950 45.6786 175.6575 108 V 4.3054 9.0306 126.1611 61.1222 32.1960 175.1202 109 C 4.4909 9.2523 128.5811 59.6993 31.7376 172.6966 110 P 4.1526 0.0000 0.0000 64.4877 31.6780 175.8938 111 N 4.5321 7.5579 120.1989 53.4293 39.0319 175.6703 112 S 4.2057 8.7749 122.8114 61.7220 63.1688 174.5835 113 N 4.7045 8.1442 116.2948 53.7560 38.8373 173.8631 114 C 4.3237 7.6765 117.1328 58.3287 32.2542 174.4489 115 I 3.8550 8.1825 125.7193 63.3030 37.4650 177.7238 116 S 3.8724 7.6617 113.4803 60.5189 62.7387 175.2679 117 H 4.5551 7.3790 118.2591 58.4148 29.0824 176.6995 118 A 4.0714 7.8557 120.7485 54.6411 18.6586 177.6522 119 E 4.1076 7.1531 116.2873 55.4718 30.2095 176.2414 120 P 4.5855 0.0000 0.0000 61.7057 30.2072 175.5108 121 V 4.5434 7.4326 117.8180 60.0484 35.9184 175.0782 122 S 4.6203 8.6129 118.3929 57.8578 62.9993 174.4966 123 S 4.3348 8.7230 119.7437 58.9957 64.2224 173.3257 124 S 5.0948 7.5716 109.4474 57.9174 65.5074 175.0333 125 F 5.7975 8.6564 124.9095 54.6430 42.6707 174.3015 126 A 4.7336 8.6585 123.9299 51.5585 20.1197 176.4187 127 V 4.7039 8.3830 121.3450 61.8614 33.4384 175.2397 128 R 4.5426 8.3841 124.8226 54.8932 33.9365 174.3779 129 K 4.0811 8.5573 127.3721 56.4226 29.9420 176.5394 130 R 3.7775 9.0703 124.0730 57.1260 29.3851 176.4331 131 A 4.5127 5.8000 115.9915 51.4830 22.3631 176.4883 132 N 4.8072 7.8459 111.6684 51.1746 38.4663 174.2145 133 D 4.3757 7.2126 117.5532 53.1854 41.8204 174.1250 134 I 4.7208 7.6015 119.5620 60.8236 38.8551 175.0565 135 A 5.2454 9.3384 128.3839 50.1488 21.8925 175.3767 136 L 5.2198 9.5437 122.0004 52.8887 45.0672 175.5185 137 K 4.9772 8.8908 126.2877 54.3773 34.0817 174.8094 138 C 3.7342 9.0357 129.1704 59.6184 31.9016 174.1987 139 K 3.2630 9.1465 129.0738 59.9726 31.6690 176.8972 140 Y 4.2711 7.9558 116.7690 59.8597 38.5194 176.2537 141 C 4.1705 7.9868 115.9588 59.7542 30.2904 175.3366 142 E 3.9009 7.8694 117.9411 56.6036 27.2920 173.7477 143 K 4.3287 7.4398 120.1580 55.4118 33.4352 175.6438 144 E 4.7855 8.1736 122.3066 54.6479 32.1144 175.2495 145 F 5.1444 9.7356 120.5773 55.4492 43.9120 174.1732 146 S 4.6262 9.0714 116.5531 59.3967 63.5976 174.2994 147 H 4.6926 8.9488 116.3741 56.4591 28.2744 175.5097 148 N 4.6064 8.1889 116.5732 53.8575 39.6965 175.9855 149 V 4.0882 7.0535 116.1864 62.4867 32.9063 176.8991 150 V 3.5173 7.2652 120.1731 62.8035 31.9241 175.2625 151 L 4.8435 8.3500 127.6331 53.2750 45.4387 174.3461 152 A 5.1033 8.1076 122.2747 49.5517 22.6341 176.0000 153 N 4.3851 8.6649 115.3122 53.7154 38.6042 175.4129 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 4.48 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 2 T 7.42 4.16 4.17 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 1.16 0.00 0.00 3 H 7.42 5.02 0.00 3.30 2.75 0.00 5.52 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.71 4.46 0.00 2.81 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 5 N 9.05 4.01 0.00 2.88 2.89 0.00 0.00 6.95 6.68 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 6 K 8.52 3.53 0.00 1.90 1.68 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.46 7.81 7 L 7.80 4.68 0.00 1.53 1.49 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 7.93 4.38 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.25 0.00 9 V 8.32 4.41 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 0.89 0.00 0.00 0.94 0.00 0.00 10 E 7.72 4.28 0.00 2.01 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 2.34 2.29 0.00 11 A 7.18 4.28 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 12 I 7.80 4.60 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.77 0.86 0.00 0.00 13 K 7.93 2.48 0.00 0.83 1.42 0.00 1.53 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.16 1.10 7.81 14 R 8.07 4.80 0.00 1.75 1.45 0.00 3.04 0.00 0.00 3.08 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 15 G 6.19 4.46 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 0.00 16 T 8.00 5.00 4.29 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 1.28 0.00 0.00 17 V 8.33 4.33 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 0.98 0.00 0.00 0.93 0.00 0.00 18 I 8.86 4.45 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 1.22 0.90 0.92 0.00 0.00 19 D 9.47 4.28 0.00 2.71 2.55 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 0.00 0.00 0.00 0.00 20 H 8.15 4.35 0.00 3.34 3.30 0.00 5.74 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 21 I 7.62 4.36 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.68 0.99 0.00 0.00 22 P 0.00 4.53 0.00 2.12 2.05 0.00 3.69 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 23 A 8.68 4.32 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 24 Q 10.19 4.28 0.00 2.28 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 25 I 7.69 3.65 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.30 1.07 0.00 0.00 26 G 8.29 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 27 F 7.68 4.53 0.00 2.72 3.08 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 0.00 0.00 0.00 28 K 8.53 3.40 0.00 1.78 1.58 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.69 7.81 29 L 7.85 3.87 0.00 1.92 1.82 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.77 4.05 0.00 1.99 1.78 1.06 1.09 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 31 S 8.40 4.05 0.00 3.79 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 32 L 7.49 3.62 0.00 1.30 0.63 0.42 -0.03 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 33 F 7.54 4.56 0.00 3.05 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 34 K 8.55 3.95 0.00 1.87 1.79 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.66 7.81 35 L 8.25 4.29 0.00 1.66 1.75 1.05 0.87 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 36 T 7.71 4.32 4.27 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 0.00 0.00 0.00 1.26 0.00 0.00 37 E 7.78 4.51 0.00 1.96 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 2.24 0.00 38 T 7.40 4.58 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 1.23 0.00 0.00 39 D 8.28 4.88 0.00 2.64 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 40 Q 7.82 4.07 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.21 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 41 R 8.31 4.06 0.00 1.87 1.83 0.00 3.14 0.00 0.00 3.33 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 42 I 8.13 4.73 1.88 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 1.40 0.90 0.95 0.00 0.00 43 T 8.75 4.65 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 44 I 8.63 4.78 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.70 0.94 0.00 0.00 45 G 9.24 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 0.00 0.00 0.00 46 L 8.36 5.51 0.00 1.57 1.55 0.82 0.98 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 47 N 8.85 4.64 0.00 2.84 2.88 0.00 0.00 7.08 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 48 L 7.35 4.23 0.00 1.69 1.84 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 5.10 0.00 2.21 2.22 0.00 3.27 0.00 0.00 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 50 S 9.50 4.47 0.00 3.99 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 51 G 6.86 4.72 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 52 E 8.00 3.96 0.00 1.93 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 2.35 2.45 0.00 53 M 7.72 4.51 0.00 2.13 2.03 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 2.50 2.46 0.00 54 G 8.80 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 0.00 0.00 0.00 55 R 7.77 4.78 0.00 1.66 1.83 0.00 3.26 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 56 K 8.25 4.76 0.00 1.81 1.81 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.72 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.36 1.40 7.81 57 D 9.27 4.78 0.00 2.79 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 58 L 8.28 4.75 0.00 1.68 1.44 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.10 5.15 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.62 0.93 0.00 0.00 60 K 8.52 5.62 0.00 1.73 1.92 0.00 1.53 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.45 7.81 61 I 8.41 4.81 1.85 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 1.23 0.78 0.89 0.00 0.00 62 E 8.48 4.68 0.00 2.18 1.74 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 2.36 2.36 0.00 63 N 8.67 4.28 0.00 2.83 2.87 0.00 0.00 6.94 6.92 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 64 T 7.08 4.48 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 1.23 0.00 0.00 65 F 8.32 5.47 0.00 2.93 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 66 L 8.74 4.19 0.00 1.67 1.59 0.86 0.95 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 67 S 8.47 4.60 0.00 4.03 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 68 E 8.79 4.12 0.00 2.00 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 0.00 2.38 2.38 0.00 69 D 8.00 4.31 0.00 2.77 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 70 Q 8.98 3.94 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 71 V 8.96 3.57 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 1.08 0.00 0.00 0.89 0.00 0.00 72 D 7.93 4.45 0.00 3.08 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 73 Q 7.94 3.68 0.00 1.82 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 74 L 8.17 4.34 0.00 1.67 1.72 0.81 0.15 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 75 A 8.63 4.20 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 76 L 7.57 4.13 0.00 1.74 0.70 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.75 4.66 0.00 3.05 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 78 A 8.25 4.74 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 79 P 0.00 4.49 0.00 2.19 2.41 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 80 Q 8.05 4.35 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 81 A 7.64 4.90 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 82 T 8.35 4.70 4.27 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 0.00 0.00 0.00 1.31 0.00 0.00 83 V 8.60 4.51 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 1.03 0.00 0.00 0.92 0.00 0.00 84 N 8.57 5.25 0.00 2.63 2.69 0.00 0.00 6.57 9.01 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 85 R 9.09 4.22 0.00 1.85 1.84 0.00 2.85 0.00 0.00 2.53 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.00 86 I 8.56 4.43 2.01 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 1.13 0.98 0.87 0.00 0.00 87 D 8.47 4.82 0.00 2.88 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.58 3.92 0.00 2.89 2.90 0.00 0.00 7.18 7.54 0.00 0.00 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 Y 7.60 3.89 0.00 3.20 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 E 7.81 4.66 0.00 2.06 1.82 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 2.24 2.24 0.00 91 V 8.47 3.77 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 0.81 0.00 0.00 0.95 0.00 0.00 92 V 8.53 4.05 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 0.88 0.00 0.00 0.95 0.00 0.00 93 G 7.71 4.05 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 0.00 0.00 0.00 94 K 8.86 5.11 0.00 1.76 1.72 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.33 1.41 7.81 95 S 8.96 4.90 0.00 3.87 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 96 R 8.40 5.15 0.00 1.76 1.77 0.00 3.11 0.00 0.00 4.01 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 97 P 0.00 4.45 0.00 2.19 2.08 0.00 3.96 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 98 S 8.39 4.70 0.00 3.98 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 99 L 8.42 3.94 0.00 1.59 1.61 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.75 0.00 2.25 2.06 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 1.98 2.01 0.00 101 E 8.62 4.11 0.00 2.04 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 0.00 2.41 2.25 0.00 102 R 7.47 4.91 0.00 2.07 1.88 0.00 3.15 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 103 I 8.74 4.44 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.90 1.12 0.00 0.00 104 D 9.27 4.92 0.00 2.67 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 0.00 105 N 7.41 3.94 0.00 2.92 3.01 0.00 0.00 5.98 7.68 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 0.00 106 V 6.69 3.75 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 0.63 0.00 0.00 0.93 0.00 0.00 107 L 7.09 4.32 0.00 1.58 1.50 0.71 0.77 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 0.00 108 V 9.03 4.31 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 0.69 0.00 0.00 0.94 0.00 0.00 109 C 9.25 4.49 0.00 3.14 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 0.00 110 P 0.00 4.15 0.00 1.97 1.88 0.00 3.03 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.85 0.00 111 N 7.56 4.53 0.00 3.25 2.88 0.00 0.00 7.04 7.03 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 0.00 112 S 8.77 4.21 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 0.00 113 N 8.14 4.70 0.00 2.67 2.80 0.00 0.00 6.92 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 0.00 114 C 7.68 4.32 0.00 3.07 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.18 3.85 1.80 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 1.58 0.92 0.68 0.00 0.00 116 S 7.66 3.87 0.00 3.94 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 0.00 117 H 7.38 4.56 0.00 3.14 3.33 0.00 5.69 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 0.00 118 A 7.86 4.07 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 119 E 7.15 4.11 0.00 1.79 1.82 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 2.28 2.31 0.00 120 P 0.00 4.59 0.00 2.16 2.07 0.00 3.67 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 1.94 1.96 0.00 121 V 7.43 4.54 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 0.76 0.00 0.00 0.65 0.00 0.00 122 S 8.61 4.62 0.00 3.82 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 0.00 123 S 8.72 4.33 0.00 4.14 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 0.00 124 S 7.57 5.09 0.00 3.87 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 0.00 125 F 8.66 5.80 0.00 3.21 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 0.00 126 A 8.66 4.73 1.26 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 0.00 0.00 127 V 8.38 4.70 2.29 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 0.74 0.00 0.00 0.99 0.00 0.00 128 R 8.38 4.54 0.00 1.93 1.68 0.00 3.13 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 129 K 8.56 4.08 0.00 1.77 1.71 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.47 7.81 130 R 9.07 3.78 0.00 1.95 1.80 0.00 3.41 0.00 0.00 3.22 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 131 A 5.80 4.51 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 0.00 132 N 7.85 4.81 0.00 2.83 2.90 0.00 0.00 5.84 8.06 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 0.00 133 D 7.21 4.38 0.00 2.83 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 0.00 134 I 7.60 4.72 1.38 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.67 0.84 0.00 0.00 135 A 9.34 5.25 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 0.00 136 L 9.54 5.22 0.00 1.87 1.67 0.63 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.89 4.98 0.00 1.83 1.71 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.30 7.81 138 C 9.04 3.73 0.00 3.19 2.91 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 0.00 139 K 9.15 3.26 0.00 1.52 1.00 0.00 0.80 0.00 0.00 1.08 0.00 0.00 2.73 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.11 1.18 7.81 140 Y 7.96 4.27 0.00 3.02 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 0.00 141 C 7.99 4.17 0.00 3.17 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 0.00 142 E 7.87 3.90 0.00 2.11 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 0.00 2.18 2.22 0.00 143 K 7.44 4.33 0.00 1.81 1.36 0.00 1.58 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.56 7.81 144 E 8.17 4.79 0.00 1.86 1.75 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 2.02 2.19 0.00 145 F 9.74 5.14 0.00 2.74 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 0.00 146 S 9.07 4.63 0.00 3.93 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 0.00 147 H 8.95 4.69 0.00 3.08 3.45 0.00 5.56 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 8.19 4.61 0.00 2.68 2.86 0.00 0.00 6.93 7.68 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 0.00 149 V 7.05 4.09 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 0.94 0.00 0.00 150 V 7.27 3.52 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 0.20 0.00 0.00 0.83 0.00 0.00 151 L 8.35 4.84 0.00 1.66 1.40 0.87 0.96 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 0.00 152 A 8.11 5.10 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 0.00 153 N 8.66 4.39 0.00 2.69 2.71 0.00 0.00 6.80 7.56 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