NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 G 4.3544 8.2085 109.7334 44.1906 0.0000 172.9494 7 A 4.4166 7.5043 121.5423 48.6963 22.0244 170.7535 8 V 3.9392 8.9964 122.1903 63.0150 33.5331 173.7915 9 I 4.3798 8.9745 129.0763 59.5015 38.7857 174.7725 10 A 4.4601 8.6060 130.1883 51.9071 19.0213 176.3363 11 C 4.6561 8.8023 122.1748 59.0197 28.4393 173.8170 12 H 4.9063 9.7735 121.5046 55.6839 29.3614 176.3233 13 T 4.7882 7.4543 109.4977 58.8649 73.0390 174.4530 14 K 4.0383 8.6242 122.4790 59.8394 32.1235 179.1892 15 Q 4.0399 8.0782 118.0386 58.7458 28.7236 177.9925 16 E 3.9031 8.3875 120.3621 59.2124 29.6530 178.3260 17 F 4.1228 8.3835 120.6521 61.7769 39.3569 176.8061 18 D 4.2603 8.6927 118.5899 57.5576 40.5370 179.0421 19 T 3.7886 8.1238 116.3487 67.1069 68.5329 176.4983 20 H 4.1599 7.9909 117.9983 58.8573 28.6467 177.8372 21 M 3.8156 7.9667 120.5391 58.2784 31.7087 178.4747 22 A 3.9550 8.1310 121.1745 55.3005 18.6279 179.1564 23 N 4.3178 8.3932 115.6589 56.6338 38.9146 177.3257 24 G 3.5413 8.0984 107.0871 47.6739 0.0000 175.5083 25 K 3.9159 8.0674 122.6395 59.3658 32.0079 178.6165 26 D 4.4058 8.3674 118.4438 56.6037 40.7653 177.8120 27 T 4.4960 7.5976 107.2342 60.4361 69.2724 174.6108 28 G 3.8897 7.5240 109.1210 46.8725 0.0000 173.9830 29 K 4.5024 8.0273 118.3918 54.4096 33.8841 176.7771 30 L 4.2342 8.3995 125.2922 55.2640 43.5508 175.4956 31 V 4.6235 8.7681 126.2864 61.1099 34.1297 174.0453 32 I 4.5771 8.3922 128.7872 59.4720 39.7619 174.3749 33 I 4.6380 8.5128 128.5661 59.4792 39.6068 174.2742 34 D 3.9899 8.6982 128.1648 52.7342 42.2368 175.2480 35 F 4.8219 8.6859 127.1072 56.8508 40.3904 175.1908 36 T 4.8088 8.7248 118.4076 60.8412 71.6157 171.7689 37 A 5.0880 8.2328 121.5852 50.2378 22.1387 177.7894 38 S 3.8320 8.4270 115.8497 61.0687 62.9399 175.9401 39 W 4.4157 7.3823 118.2310 57.9384 29.4726 176.2227 40 C 4.4266 7.9438 120.4063 57.6883 29.8467 173.7639 41 G 3.8457 8.7280 112.6746 47.5351 0.0000 170.5642 42 P 4.3155 0.0000 0.0000 65.5448 31.7245 178.1604 43 C 4.3401 7.9867 114.4229 62.3832 27.5425 176.1990 44 R 4.0464 8.1067 120.1991 58.8210 29.3368 178.8482 45 V 3.6012 7.7920 117.2198 66.1120 31.7728 177.3367 46 I 3.9718 7.5712 116.3317 62.7146 37.8797 177.1829 47 A 4.0935 7.6322 121.8140 55.3487 18.1262 177.9434 48 P 4.2369 0.0000 0.0000 65.3611 31.3203 179.1469 49 V 3.2600 7.6401 116.8526 65.8106 31.4525 177.5775 50 F 4.2094 8.3622 120.2273 61.3577 39.2066 176.9082 51 A 3.8005 8.1159 120.3454 55.0339 18.1581 179.1723 52 E 3.7869 8.3902 118.2275 59.6891 29.7093 178.7422 53 Y 4.4771 7.9666 116.7325 60.9674 37.9417 178.0182 54 A 2.0000 7.2175 121.7687 54.6348 18.0563 179.9286 55 K 4.0346 7.2673 116.6419 58.8039 32.1908 179.3106 56 K 3.9111 7.6882 118.9886 57.6289 33.6317 176.9427 57 F 5.0139 7.8122 117.5165 54.9303 38.9100 173.9748 58 P 4.3727 0.0000 0.0000 65.2815 31.7278 178.6029 59 G 3.7977 8.2548 105.6954 46.4007 0.0000 172.6567 60 A 4.9532 8.0179 121.0318 50.0588 22.4496 175.6193 61 I 4.4021 8.3824 120.4636 59.9049 39.4458 174.9360 62 F 5.0783 8.9820 125.6918 55.8055 41.2298 174.3793 63 L 5.2784 9.1905 124.4653 52.7009 44.8965 175.4459 64 K 4.8397 9.0491 123.9427 54.5387 35.0717 174.7773 65 V 4.4249 8.3750 127.1993 60.8824 34.5692 173.6438 66 D 4.9163 8.5665 128.0059 53.7888 41.7989 177.2453 67 V 3.7557 9.1491 120.7019 64.3948 32.0630 178.3875 68 D 4.5740 8.5208 119.8525 56.4403 40.5098 178.1319 69 E 4.1698 8.2022 119.6274 58.1239 31.2236 176.3389 70 L 4.9169 7.6697 120.4787 53.0846 39.0100 177.1477 71 K 4.1813 8.1474 123.2956 58.5975 32.4979 178.5167 72 D 4.3283 7.9996 119.1019 56.5105 39.4217 178.7822 73 V 3.5576 7.6995 119.3741 65.3129 31.6317 177.3227 74 A 3.6496 8.0999 120.6968 55.3658 18.1141 179.2946 75 E 3.7916 8.2717 117.2664 59.3276 29.4892 178.7282 76 A 3.8853 7.9933 119.9426 54.8934 18.4389 178.2029 77 Y 4.1666 7.7422 112.2705 56.6765 38.7807 175.2368 78 N 4.0573 8.0834 116.6300 54.0250 36.8179 175.2207 79 V 3.5700 7.4419 116.9541 63.2254 32.1284 175.1179 80 E 4.6472 8.3213 124.7948 55.3781 31.0656 174.8107 81 A 4.4688 7.3578 118.5714 51.9615 21.6733 176.4393 82 M 4.8481 8.3607 118.9266 52.7327 35.7857 173.7912 83 P 4.6466 0.0000 0.0000 62.8253 33.5087 174.8961 84 T 4.9766 8.3880 118.9738 61.9063 71.3030 173.0749 85 F 4.9806 9.4254 125.8607 56.0073 40.8871 174.7754 86 L 5.2555 8.8474 124.3783 53.0530 44.6523 175.4759 87 F 5.1158 9.3245 121.6212 55.8438 41.5537 174.4877 88 I 5.0699 9.0731 125.2592 59.3478 39.9972 174.6235 89 K 4.6348 8.9223 128.3734 55.0400 35.4963 175.5787 90 D 4.3420 9.9160 125.8676 55.3541 39.5963 174.4286 91 G 4.0139 8.5422 103.9850 45.1051 0.0000 173.8503 92 E 4.7800 7.7505 119.3493 53.7540 32.0496 175.3810 93 K 4.6234 8.7647 123.5468 57.0006 32.6188 176.7758 94 V 4.4917 8.6590 118.3894 61.3138 33.9942 174.4076 95 D 4.6856 8.0493 118.8319 54.1702 44.5694 173.7111 96 S 5.5406 8.4001 113.6380 57.5096 65.8627 174.0671 97 V 4.6100 9.3154 121.0024 61.3198 34.8354 174.0628 98 V 4.6690 8.8907 127.4463 62.5246 33.0426 176.1185 99 G 3.9806 9.5483 114.9941 45.0885 0.0000 173.8344 100 G 3.9820 8.1940 107.6186 44.5730 0.0000 176.8991 101 R 4.3979 7.3513 119.3009 54.3017 29.4952 176.8889 102 K 3.9984 8.2621 122.7622 59.6713 32.4131 177.9986 103 D 4.4088 8.1183 117.4955 57.2450 41.2067 177.6346 104 D 4.3628 8.1439 119.0517 57.5020 40.9031 178.7660 105 I 3.8763 7.9767 120.1283 64.6374 37.1719 177.9356 106 H 3.6391 8.4142 119.0220 59.4453 29.5849 177.3228 107 T 3.8348 8.1537 117.6863 66.6802 68.2236 176.7042 108 K 3.6833 8.0108 120.2778 59.2964 31.9219 179.3881 109 I 3.5547 7.6593 119.9869 64.4028 36.7641 178.6730 110 V 3.4207 7.2431 117.2478 65.7242 31.5445 177.5864 111 A 4.0682 8.0996 120.7482 55.1774 18.0912 179.3707 112 L 4.1987 7.8164 115.3812 56.9854 41.9782 178.8522 113 M 4.1841 7.9796 117.9584 57.2359 32.4642 178.5937 114 G 3.7965 8.2361 106.3248 45.8394 0.0000 172.8859 115 S 4.5883 8.2580 115.2381 56.4439 65.8541 174.1093 116 A 4.0985 8.4063 124.6558 52.1028 18.7199 177.9135 117 S 4.2487 8.6147 117.6534 59.3735 63.5496 174.9327 118 T 4.2084 8.2069 112.6992 61.9309 68.7018 173.6243 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 6 G 8.21 4.35 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 0.00 7 A 7.50 4.42 1.19 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 0.00 0.00 8 V 9.00 3.94 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 1.04 0.00 0.00 0.82 0.00 0.00 9 I 8.97 4.38 1.77 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.77 0.75 0.00 0.00 10 A 8.61 4.46 1.14 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 0.00 0.00 11 C 8.80 4.66 0.00 2.90 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 12 H 9.77 4.91 0.00 3.15 3.48 0.00 5.56 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.45 4.79 4.44 0.00 0.00 0.00 0.00 0.00 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 14 K 8.62 4.04 0.00 1.89 1.91 0.00 1.95 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.75 1.68 7.81 15 Q 8.08 4.04 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.68 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 16 E 8.39 3.90 0.00 2.10 2.18 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 2.43 2.39 0.00 17 F 8.38 4.12 0.00 3.16 3.29 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 18 D 8.69 4.26 0.00 2.93 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 19 T 8.12 3.79 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 1.10 0.00 0.00 20 H 7.99 4.16 0.00 3.09 3.26 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 21 M 7.97 3.82 0.00 1.80 1.94 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.76 0.00 22 A 8.13 3.96 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 23 N 8.39 4.32 0.00 2.81 2.97 0.00 0.00 7.13 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 24 G 8.10 3.54 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 0.00 0.00 0.00 25 K 8.07 3.92 0.00 1.83 1.93 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.40 7.81 26 D 8.37 4.41 0.00 2.82 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 27 T 7.60 4.50 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 1.27 0.00 0.00 28 G 7.52 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 0.00 0.00 0.00 29 K 8.03 4.50 0.00 1.61 1.72 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.60 1.38 7.81 30 L 8.40 4.23 0.00 1.74 1.46 1.07 0.74 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 31 V 8.77 4.62 1.99 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 0.65 0.00 0.00 0.85 0.00 0.00 32 I 8.39 4.58 1.42 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.18 0.60 0.00 0.00 33 I 8.51 4.64 1.56 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 1.07 0.68 -0.04 0.00 0.00 34 D 8.70 3.99 0.00 1.58 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 0.00 0.00 0.00 0.00 35 F 8.69 4.82 0.00 2.99 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 36 T 8.72 4.81 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 1.14 0.00 0.00 37 A 8.23 5.09 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 38 S 8.43 3.83 0.00 3.42 3.61 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 39 W 7.38 4.42 0.00 3.33 3.29 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 40 C 7.94 4.43 0.00 3.04 2.99 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 41 G 8.73 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 42 P 0.00 4.32 0.00 2.06 2.19 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.23 0.00 43 C 7.99 4.34 0.00 3.29 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 44 R 8.11 4.05 0.00 1.94 1.98 0.00 3.29 0.00 0.00 3.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.78 0.00 45 V 7.79 3.60 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 0.85 0.00 0.00 0.95 0.00 0.00 46 I 7.57 3.97 1.99 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.15 1.20 0.00 0.00 47 A 7.63 4.09 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 48 P 0.00 4.24 0.00 2.14 2.09 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 49 V 7.64 3.26 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 0.50 0.00 0.00 0.85 0.00 0.00 50 F 8.36 4.21 0.00 3.22 3.31 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 51 A 8.12 3.80 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 52 E 8.39 3.79 0.00 2.00 1.92 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 2.33 2.32 0.00 53 Y 7.97 4.48 0.00 3.10 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 54 A 7.22 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.27 4.03 0.00 1.78 1.78 0.00 1.58 0.00 0.00 1.41 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.32 7.81 56 K 7.69 3.91 0.00 1.70 1.50 0.00 1.65 0.00 0.00 1.44 0.00 0.00 2.64 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.41 1.11 7.81 57 F 7.81 5.01 0.00 3.54 3.06 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 0.00 58 P 0.00 4.37 0.00 2.19 2.18 0.00 3.85 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 59 G 8.25 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 0.00 0.00 0.00 60 A 8.02 4.95 1.22 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 0.00 0.00 61 I 8.38 4.40 1.81 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 1.24 0.70 0.88 0.00 0.00 62 F 8.98 5.08 0.00 2.75 2.46 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 63 L 9.19 5.28 0.00 1.53 1.55 0.77 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 64 K 9.05 4.84 0.00 1.87 1.62 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.22 1.21 7.81 65 V 8.37 4.42 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 0.86 0.00 0.00 0.59 0.00 0.00 66 D 8.57 4.92 0.00 2.71 2.50 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 67 V 9.15 3.76 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 0.90 0.00 0.00 0.97 0.00 0.00 68 D 8.52 4.57 0.00 2.95 2.87 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 69 E 8.20 4.17 0.00 2.05 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 2.40 2.42 0.00 70 L 7.67 4.92 0.00 1.67 1.66 0.86 0.85 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 71 K 8.15 4.18 0.00 1.80 1.87 0.00 1.96 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.56 7.81 72 D 8.00 4.33 0.00 2.95 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 73 V 7.70 3.56 1.92 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 0.44 0.00 0.00 0.73 0.00 0.00 74 A 8.10 3.65 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 75 E 8.27 3.79 0.00 2.08 1.92 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 2.26 2.29 0.00 76 A 7.99 3.89 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 77 Y 7.74 4.17 0.00 2.65 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 78 N 8.08 4.06 0.00 2.79 2.81 0.00 0.00 6.85 7.94 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 79 V 7.44 3.57 1.78 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 0.60 0.00 0.00 -0.07 0.00 0.00 80 E 8.32 4.65 0.00 1.91 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 2.16 2.39 0.00 81 A 7.36 4.47 1.19 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 0.00 0.00 82 M 8.36 4.85 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 83 P 0.00 4.65 0.00 1.69 2.02 0.00 3.70 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.10 0.00 84 T 8.39 4.98 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 1.24 0.00 0.00 85 F 9.43 4.98 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 86 L 8.85 5.26 0.00 1.67 1.67 1.02 1.28 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 87 F 9.32 5.12 0.00 3.01 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 88 I 9.07 5.07 1.86 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.10 1.00 0.00 0.00 89 K 8.92 4.63 0.00 1.84 1.62 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.40 7.81 90 D 9.92 4.34 0.00 2.82 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 91 G 8.54 4.01 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 0.00 0.00 0.00 92 E 7.75 4.78 0.00 2.15 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 2.42 2.37 0.00 93 K 8.76 4.62 0.00 1.99 1.87 0.00 1.87 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.66 7.81 94 V 8.66 4.49 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 1.06 0.00 0.00 95 D 8.05 4.69 0.00 2.59 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 0.00 0.00 0.00 96 S 8.40 5.54 0.00 4.03 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 97 V 9.32 4.61 2.46 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 1.05 0.00 0.00 1.10 0.00 0.00 98 V 8.89 4.67 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 0.89 0.00 0.00 0.99 0.00 0.00 99 G 9.55 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 0.00 0.00 0.00 100 G 8.19 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 0.00 0.00 0.00 101 R 7.35 4.40 0.00 1.92 1.94 0.00 3.20 0.00 0.00 3.41 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 102 K 8.26 4.00 0.00 1.87 2.00 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.54 7.81 103 D 8.12 4.41 0.00 2.75 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 0.00 104 D 8.14 4.36 0.00 2.98 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 0.00 105 I 7.98 3.88 2.20 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 1.30 0.90 1.15 0.00 0.00 106 H 8.41 3.64 0.00 3.09 3.38 0.00 5.59 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 0.00 107 T 8.15 3.83 4.32 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 1.17 0.00 0.00 108 K 8.01 3.68 0.00 1.40 0.89 0.00 1.12 0.00 0.00 0.96 0.00 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.13 1.40 7.81 109 I 7.66 3.55 1.40 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 1.36 0.92 -0.11 0.00 0.00 110 V 7.24 3.42 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 0.81 0.00 0.00 0.91 0.00 0.00 111 A 8.10 4.07 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 0.00 112 L 7.82 4.20 0.00 1.66 1.72 0.75 1.21 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 0.00 113 M 7.98 4.18 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 114 G 8.24 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 0.00 0.00 0.00 115 S 8.26 4.59 0.00 3.94 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 0.00 116 A 8.41 4.10 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 0.00 117 S 8.61 4.25 0.00 3.87 3.83 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 0.00 0.00 0.00 118 T 8.21 4.21 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 1.25 0.00 0.00