NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7831 8.3027 120.3904 56.1849 31.7552 174.9889 2 K 3.7906 8.3070 118.7877 58.6103 32.0038 176.3265 3 C 4.9813 7.9948 114.5825 56.2975 37.0076 173.1240 4 D 4.5994 7.6730 119.5456 54.0949 41.4693 177.0571 5 I 3.9943 8.2034 116.5161 62.8956 37.6290 177.8369 6 T 3.8647 8.4556 118.8705 66.9828 68.2391 175.7261 7 L 3.9417 7.8176 120.4072 58.1493 41.6778 179.5140 8 Q 4.1108 8.0346 118.6777 59.1546 29.0391 177.7792 9 E 3.9904 8.3020 119.8564 59.3101 29.3586 179.3929 10 I 3.7835 7.9775 120.0617 64.2395 37.2024 178.5124 11 I 3.6581 7.8118 120.9745 64.1794 37.0175 178.6685 12 K 4.0366 8.2592 119.8567 60.1935 32.2950 179.4430 13 T 3.8003 7.7556 116.5910 66.3410 68.3008 176.6358 14 L 3.9022 8.0283 121.1335 57.8070 41.0903 179.1643 15 N 4.1946 8.4486 116.8044 56.5459 38.2354 177.6764 16 S 4.0425 7.4648 115.1123 61.3771 62.8791 176.3435 17 L 3.9610 7.5726 121.2255 57.6899 41.4866 179.0358 18 T 4.2379 7.8558 107.3507 62.5657 69.1455 175.3433 19 E 4.7394 7.3127 119.2486 55.2418 30.2851 175.4787 20 Q 4.2887 7.5345 119.9183 54.6694 30.8511 174.0353 21 K 4.4931 8.5536 125.2437 55.7169 34.2197 176.0009 22 T 4.7890 7.8320 111.5588 60.0383 71.6399 173.4225 23 L 4.2088 8.6179 119.6347 57.4414 42.0953 178.5316 24 C 5.0952 8.4692 114.5265 56.5543 42.2538 175.5686 25 T 3.9235 8.0071 110.8453 63.4659 68.5941 175.4640 26 E 4.3815 7.9986 120.4194 57.1368 30.5398 176.2487 27 L 4.4159 7.7050 119.2773 55.2671 42.9222 176.3486 28 T 5.1865 8.4740 110.5292 60.6405 71.4994 173.7252 29 V 4.6409 8.5407 114.8774 59.3557 36.1649 175.3348 30 T 4.2324 8.3229 119.1600 64.0026 68.9742 175.1938 31 D 4.7769 9.4038 127.7641 52.4927 39.8095 176.4846 32 I 3.7323 7.7952 117.6413 63.0127 37.9209 178.1250 33 F 4.7884 7.6709 118.1642 57.7038 38.5365 175.6741 34 A 4.5045 8.0037 122.3178 51.7561 19.1648 178.0310 35 A 4.3012 7.3774 118.4494 52.4999 19.2677 177.8535 36 S 4.6071 8.2589 113.2075 58.1058 62.9651 174.5291 37 K 3.9114 7.9562 112.9470 58.7011 29.2629 176.5048 38 N 4.8238 8.3102 113.9320 52.8410 37.5002 174.3943 39 T 4.6458 7.3506 107.4741 59.1736 72.0375 173.8556 40 T 4.0365 8.0888 114.2278 61.5990 70.6936 175.0014 41 E 3.5437 8.3980 120.5805 59.1300 29.4772 178.6947 42 K 3.9861 7.7744 118.1689 59.3232 32.1368 178.9855 43 E 3.9568 7.8618 119.0773 59.5813 29.3103 179.6065 44 T 3.7737 7.3873 115.2363 66.6144 68.4702 176.5625 45 F 4.4641 7.4318 119.6227 60.9769 38.9109 176.7993 46 C 3.8400 8.4100 117.9621 59.7921 40.8315 175.9769 47 R 3.8016 8.3087 119.5272 59.1452 29.7027 178.8314 48 A 4.1170 8.4068 120.7729 55.2829 18.4292 179.5697 49 A 4.1425 8.3385 121.2570 54.7058 18.0199 180.1063 50 T 4.0293 7.6548 114.4597 67.1414 68.6556 177.4812 51 V 3.7562 7.7032 114.2293 64.1463 31.4527 178.7710 52 L 3.9784 7.8302 118.9815 57.6233 41.4889 179.3241 53 R 3.0564 8.1007 118.6537 59.2454 30.0879 178.2269 54 Q 3.7650 8.0552 117.8950 59.0476 28.7546 179.1802 55 F 3.9376 8.1104 121.3111 61.4720 39.5177 176.7638 56 Y 4.4072 8.2608 117.5032 60.2307 37.5540 178.1604 57 S 4.1451 7.3043 116.0914 61.9187 63.0715 176.2794 58 H 4.4465 7.6341 116.2142 57.6994 28.5609 176.3858 59 H 4.8567 7.6892 115.8318 55.1177 29.3811 175.4249 60 E 4.1581 8.2844 122.2729 58.6326 29.5668 177.4148 61 K 4.4754 7.6296 114.4854 55.8984 32.7588 175.3353 62 D 4.4371 7.7482 120.6708 54.2733 41.0058 176.9139 63 T 3.7275 8.7508 124.5238 66.9996 68.5438 175.7821 64 R 4.1129 8.4578 119.0067 58.1668 30.2152 176.5709 65 C 4.9025 8.4546 114.2845 57.3961 37.3295 175.2765 66 L 3.7884 7.8389 119.6508 56.4629 41.4593 177.8947 67 G 4.1037 8.2257 104.3909 45.5057 0.0000 173.3195 68 A 4.0595 8.9623 126.6844 54.7253 18.9729 178.8784 69 T 4.4784 7.7636 105.4246 60.0737 72.0583 175.4993 70 A 4.0980 8.4203 122.5784 55.5914 18.2958 179.6530 71 Q 3.9749 8.1036 117.3974 59.5201 29.2202 178.3006 72 Q 4.0561 8.2787 119.1156 58.9344 28.7463 178.5798 73 F 4.9265 8.5453 123.1978 60.9655 39.3592 176.5892 74 H 3.9346 8.9434 118.2582 59.5271 29.6373 177.4621 75 R 3.8751 8.2632 119.8767 59.4038 29.8301 178.5703 76 H 4.2056 8.3838 118.1181 59.2279 29.8299 177.5541 77 K 3.8043 7.9389 120.2782 59.2904 31.7557 179.0353 78 Q 3.7432 8.0752 118.7545 59.0570 28.6408 179.0349 79 L 4.1127 8.0828 120.9350 58.4941 42.1612 179.1759 80 I 3.7333 7.7103 119.6545 64.1546 36.9793 178.2118 81 R 3.6716 7.9666 119.7341 59.6666 29.7399 178.6593 82 F 4.3796 8.2242 117.4230 60.3742 38.8936 177.8197 83 L 4.0936 8.3139 119.0324 57.7101 41.4312 179.7454 84 K 3.7889 7.8860 118.1819 59.1008 31.9599 179.2230 85 A 3.9423 7.8961 121.0564 55.0928 18.3188 179.1533 86 L 3.8944 8.2029 119.0764 58.5134 42.2564 178.7242 87 D 4.2675 8.6082 117.9944 57.3368 41.2358 177.7782 88 R 4.1283 8.6609 119.5968 60.0778 30.0044 178.1680 89 N 4.4351 8.3244 115.8300 56.1052 38.5207 177.5546 90 L 3.7799 8.2864 120.9497 57.5691 41.5856 179.6023 91 W 4.6119 8.5166 119.3742 59.7488 28.7390 178.8471 92 G 3.7431 8.1771 104.9937 47.7370 0.0000 175.5474 93 L 4.1888 7.7788 120.2598 57.5866 41.7645 178.9955 94 A 4.3999 8.7205 120.1070 53.2241 18.5511 177.8476 95 G 4.0767 7.9568 103.9644 45.6418 0.0000 173.2633 96 L 4.4556 8.0329 117.7866 54.1506 45.0390 173.9063 97 N 4.6235 8.9842 122.9625 53.2631 39.8219 174.7871 98 S 4.6517 7.9520 112.6152 56.6081 63.9900 173.0741 99 C 4.5891 8.5179 121.0702 53.4490 42.3304 171.9405 100 P 4.3661 0.0000 0.0000 62.7423 31.3091 176.0307 101 V 4.2775 8.3374 116.3268 59.7624 32.8949 175.6821 102 K 4.4958 8.4645 122.7153 55.9528 32.9425 176.3725 103 E 4.1246 7.9596 118.7749 56.3396 30.2104 176.7040 104 A 4.1798 8.6009 125.6836 54.8396 19.6063 177.6312 105 N 4.2032 7.9976 113.5312 54.6550 39.7336 173.0701 106 Q 5.2424 8.7780 124.3578 54.2123 31.3203 174.8595 107 S 5.0455 8.6209 117.2685 56.0176 66.9510 173.6164 108 T 4.4799 8.4680 110.1484 61.7270 69.1744 174.5995 109 L 3.7913 9.2696 126.1603 58.5455 41.9645 179.1575 110 E 3.9095 8.2292 118.8172 59.6622 29.6192 178.7208 111 N 4.4238 8.3668 116.3242 56.1707 38.5437 177.2966 112 F 4.3043 8.3584 122.3378 61.1845 39.4409 177.3154 113 L 4.0471 8.4705 119.0070 57.8786 41.4577 179.2847 114 E 3.8751 8.0501 118.0609 59.2489 29.3096 179.5081 115 R 3.6313 7.5682 118.3717 59.1196 30.0879 178.2568 116 L 3.6535 7.5372 120.1275 57.6400 41.8841 178.9105 117 K 3.8033 8.0515 119.7749 59.7461 32.2028 178.6799 118 T 3.7713 7.6638 115.9067 66.9806 68.3683 176.6140 119 I 3.6852 7.4739 121.3443 64.5199 37.0586 178.5216 120 M 4.1174 8.1246 119.7984 58.4789 31.7165 179.0694 121 R 3.9395 8.3366 118.6417 58.9380 30.0614 178.7702 122 E 3.9342 8.3319 119.3956 59.0722 29.4270 178.8933 123 K 3.9665 8.0222 117.5318 59.6669 32.4547 178.2989 124 Y 4.1159 8.1146 119.5889 60.8121 38.6199 177.8905 125 S 4.2502 8.5926 114.3788 61.6621 62.2634 176.3971 126 K 4.0634 8.2615 119.7463 59.1742 31.7644 178.0845 127 C 4.4080 8.0662 116.1331 57.5665 40.7552 173.7693 128 S 4.7435 6.8401 114.2050 56.0118 63.6272 173.8778 129 S 4.3034 8.5602 118.9232 58.7918 62.5658 174.0906 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 H 8.30 4.78 0.00 3.19 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 K 8.31 3.79 0.00 1.86 1.86 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.57 7.81 3 C 7.99 4.98 0.00 2.91 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 4 D 7.67 4.60 0.00 2.82 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 5 I 8.20 3.99 1.89 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 1.64 0.52 0.91 0.00 0.00 6 T 8.46 3.86 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 1.20 0.00 0.00 7 L 7.82 3.94 0.00 1.85 1.88 0.92 0.61 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 8 Q 8.03 4.11 0.00 2.39 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 9 E 8.30 3.99 0.00 2.22 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 2.50 2.51 0.00 10 I 7.98 3.78 2.02 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 1.44 0.65 0.83 0.00 0.00 11 I 7.81 3.66 1.82 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 1.49 0.54 0.78 0.00 0.00 12 K 8.26 4.04 0.00 1.95 2.33 0.00 1.32 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.49 7.81 13 T 7.76 3.80 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 1.37 0.00 0.00 14 L 8.03 3.90 0.00 1.75 1.64 0.88 0.93 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 15 N 8.45 4.19 0.00 2.75 2.78 0.00 0.00 7.06 7.34 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 16 S 7.46 4.04 0.00 2.75 3.05 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 17 L 7.57 3.96 0.00 1.67 1.66 1.02 0.91 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 18 T 7.86 4.24 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 1.15 0.00 0.00 19 E 7.31 4.74 0.00 2.13 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 2.34 2.22 0.00 20 Q 7.53 4.29 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 21 K 8.55 4.49 0.00 1.92 1.80 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.43 7.81 22 T 7.83 4.79 4.33 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 1.27 0.00 0.00 23 L 8.62 4.21 0.00 1.71 1.89 0.96 0.81 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 24 C 8.47 5.10 0.00 3.09 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 25 T 8.01 3.92 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 1.26 0.00 0.00 26 E 8.00 4.38 0.00 2.01 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 2.29 2.29 0.00 27 L 7.71 4.42 0.00 1.95 1.62 0.65 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.47 5.19 4.33 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 1.26 0.00 0.00 29 V 8.54 4.64 1.63 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 0.58 0.00 0.00 0.36 0.00 0.00 30 T 8.32 4.23 4.18 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 1.25 0.00 0.00 31 D 9.40 4.78 0.00 2.79 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 32 I 7.80 3.73 1.67 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 -0.36 0.83 0.00 0.00 33 F 7.67 4.79 0.00 3.08 3.01 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 0.00 0.00 0.00 0.00 34 A 8.00 4.50 1.42 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 35 A 7.38 4.30 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 36 S 8.26 4.61 0.00 3.99 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 37 K 7.96 3.91 0.00 1.93 1.98 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.18 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.48 7.81 38 N 8.31 4.82 0.00 2.80 2.90 0.00 0.00 5.99 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 39 T 7.35 4.65 4.38 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 1.20 0.00 0.00 40 T 8.09 4.04 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 1.19 0.00 0.00 41 E 8.40 3.54 0.00 1.90 1.79 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 1.64 1.91 0.00 42 K 7.77 3.99 0.00 1.82 1.97 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.74 1.53 7.81 43 E 7.86 3.96 0.00 2.02 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 2.33 2.36 0.00 44 T 7.39 3.77 4.03 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 1.27 0.00 0.00 45 F 7.43 4.46 0.00 3.03 3.07 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 46 C 8.41 3.84 0.00 3.15 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 47 R 8.31 3.80 0.00 2.02 1.89 0.00 3.16 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 1.63 1.70 0.00 48 A 8.41 4.12 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 0.00 0.00 0.00 0.00 0.00 49 A 8.34 4.14 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 4.03 4.41 0.00 0.00 0.00 0.00 0.00 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 51 V 7.70 3.76 1.85 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 0.80 0.00 0.00 0.63 0.00 0.00 52 L 7.83 3.98 0.00 1.95 1.83 1.06 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.10 3.06 0.00 2.38 2.09 0.00 3.46 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.36 0.00 54 Q 8.06 3.77 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 55 F 8.11 3.94 0.00 3.07 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 56 Y 8.26 4.41 0.00 3.32 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 7.30 4.15 0.00 3.54 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 58 H 7.63 4.45 0.00 2.78 3.00 0.00 5.62 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 7.69 4.86 0.00 2.94 3.13 0.00 5.62 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.28 4.16 0.00 2.33 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 2.43 2.43 0.00 61 K 7.63 4.48 0.00 1.80 1.81 0.00 1.88 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.37 7.81 62 D 7.75 4.44 0.00 2.89 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 63 T 8.75 3.73 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 1.20 0.00 0.00 64 R 8.46 4.11 0.00 1.95 1.99 0.00 3.11 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 65 C 8.45 4.90 0.00 3.00 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 66 L 7.84 3.79 0.00 1.65 1.62 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.23 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 0.00 0.00 0.00 68 A 8.96 4.06 1.33 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 0.00 0.00 69 T 7.76 4.48 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 1.23 0.00 0.00 70 A 8.42 4.10 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 71 Q 8.10 3.97 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.85 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 72 Q 8.28 4.06 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 73 F 8.55 4.93 0.00 3.15 3.25 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 74 H 8.94 3.93 0.00 3.26 3.50 0.00 5.84 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 75 R 8.26 3.88 0.00 1.94 2.01 0.00 3.24 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 76 H 8.38 4.21 0.00 3.47 3.63 0.00 5.78 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 77 K 7.94 3.80 0.00 1.66 1.60 0.00 1.45 0.00 0.00 1.15 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.24 0.92 7.81 78 Q 8.08 3.74 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.21 0.00 79 L 8.08 4.11 0.00 1.95 1.88 0.96 1.13 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 80 I 7.71 3.73 1.76 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.82 0.89 0.00 0.00 81 R 7.97 3.67 0.00 1.83 1.66 0.00 2.89 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.45 0.00 82 F 8.22 4.38 0.00 3.23 2.94 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 83 L 8.31 4.09 0.00 1.91 1.97 1.10 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.89 3.79 0.00 1.75 1.65 0.00 1.38 0.00 0.00 1.38 0.00 0.00 2.46 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.36 0.48 7.81 85 A 7.90 3.94 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 86 L 8.20 3.89 0.00 1.88 2.02 0.91 1.40 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 87 D 8.61 4.27 0.00 3.31 3.04 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 88 R 8.66 4.13 0.00 2.08 2.25 0.00 3.17 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 1.71 1.78 0.00 89 N 8.32 4.44 0.00 2.93 2.81 0.00 0.00 7.10 6.13 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 90 L 8.29 3.78 0.00 1.54 1.45 0.88 0.57 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 91 W 8.52 4.61 0.00 3.56 3.18 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 92 G 8.18 3.74 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 0.00 0.00 0.00 93 L 7.78 4.19 0.00 1.75 1.66 0.14 0.79 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 94 A 8.72 4.40 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.96 4.08 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 0.00 0.00 0.00 96 L 8.03 4.46 0.00 1.74 1.67 0.98 1.08 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 97 N 8.98 4.62 0.00 2.66 2.64 0.00 0.00 6.93 7.57 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 98 S 7.95 4.65 0.00 3.96 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 C 8.52 4.59 0.00 3.09 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 0.00 100 P 0.00 4.37 0.00 2.21 2.13 0.00 3.76 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 2.00 2.00 0.00 101 V 8.34 4.28 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 0.78 0.00 0.00 0.91 0.00 0.00 102 K 8.46 4.50 0.00 1.69 1.80 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.18 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.48 7.81 103 E 7.96 4.12 0.00 1.93 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 2.50 2.37 0.00 104 A 8.60 4.18 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 0.00 105 N 8.00 4.20 0.00 2.89 2.79 0.00 0.00 6.96 7.12 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 0.00 106 Q 8.78 5.24 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.57 0.00 0.00 0.00 0.00 0.00 2.43 2.28 0.00 107 S 8.62 5.05 0.00 3.99 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 0.00 108 T 8.47 4.48 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 1.30 0.00 0.00 109 L 9.27 3.79 0.00 1.23 1.71 0.35 0.45 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 0.00 110 E 8.23 3.91 0.00 2.23 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 2.32 2.36 0.00 111 N 8.37 4.42 0.00 2.86 2.91 0.00 0.00 6.73 7.69 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 0.00 112 F 8.36 4.30 0.00 3.26 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 0.00 113 L 8.47 4.05 0.00 1.74 1.70 0.88 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.05 3.88 0.00 2.11 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 0.00 2.41 2.43 0.00 115 R 7.57 3.63 0.00 1.87 1.66 0.00 2.40 0.00 0.00 2.59 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.64 0.00 116 L 7.54 3.65 0.00 1.64 1.65 1.05 0.61 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 0.00 117 K 8.05 3.80 0.00 1.85 1.84 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.39 7.81 118 T 7.66 3.77 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 1.11 0.00 0.00 119 I 7.47 3.69 1.81 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.35 0.97 0.00 0.00 120 M 8.12 4.12 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.91 0.00 121 R 8.34 3.94 0.00 1.99 1.91 0.00 3.02 0.00 0.00 3.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 122 E 8.33 3.93 0.00 2.14 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 2.29 2.40 0.00 123 K 8.02 3.97 0.00 1.99 1.96 0.00 1.99 0.00 0.00 1.94 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.71 1.58 7.81 124 Y 8.11 4.12 0.00 3.13 3.04 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 0.00 125 S 8.59 4.25 0.00 3.97 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 0.00 126 K 8.26 4.06 0.00 2.03 1.88 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.70 1.64 7.81 127 C 8.07 4.41 0.00 2.99 2.98 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 0.00 128 S 6.84 4.74 0.00 3.74 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 0.00 129 S 8.56 4.30 0.00 4.02 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