NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2584 8.3144 120.1355 55.9211 33.5128 174.8031 2 E 3.9779 8.5135 122.5528 54.0744 30.2755 175.9095 3 T 4.1533 8.7459 118.5835 61.3015 72.0138 174.7767 4 A 3.9988 8.5670 123.9004 55.4333 18.4580 179.9661 5 A 4.2299 8.2817 119.8120 54.7866 18.4395 179.5927 6 A 3.9948 8.1995 119.2834 55.1148 18.3700 179.6717 7 K 3.9759 8.4838 118.6134 59.6780 32.2107 178.7193 8 F 4.0887 8.4833 120.8733 61.3583 39.3308 176.9874 9 E 4.0543 8.4650 118.2738 59.4110 29.0615 179.3040 10 R 3.8829 8.0135 117.7875 59.5644 30.2658 178.1994 11 Q 4.0136 8.0624 116.5230 57.7981 29.1780 176.1686 12 H 4.8625 7.9824 113.7261 53.7209 31.5784 172.9260 13 M 4.7718 7.9487 118.8343 53.8276 33.3633 176.3051 14 D 4.7405 8.9837 123.3584 52.7452 41.6258 175.7354 15 S 4.2714 8.6637 118.9886 60.2747 63.7368 175.8941 16 S 4.2429 8.2873 114.8179 61.2401 62.3383 174.6156 17 T 4.6606 7.4388 115.4195 60.5020 71.2019 174.5326 18 S 4.2177 8.4744 116.7855 60.8157 63.5078 173.7802 19 A 4.2550 7.1826 120.8597 50.4823 21.6305 175.3755 20 A 3.2713 7.9347 122.6049 52.1661 18.5713 178.1604 21 S 4.2235 8.3463 118.9570 60.5973 63.3296 175.3581 22 S 4.8980 7.5079 114.1230 56.7118 65.6018 174.0372 23 S 4.3416 8.6629 113.0663 60.3202 63.2853 173.9716 24 N 4.6394 7.9654 119.6170 54.1268 39.2794 175.5822 25 Y 4.0404 7.8410 118.4691 62.0380 38.7332 177.4529 26 C 4.2809 8.3852 116.9344 60.1025 38.6226 175.7241 27 N 4.3961 8.2924 117.5141 56.5316 38.1273 177.0940 28 Q 3.9173 8.1782 120.7080 59.4983 29.3442 178.0978 29 M 3.7107 8.2507 122.1774 57.9704 31.7362 178.6893 30 M 4.0394 8.2113 119.2570 58.0111 31.9672 178.7845 31 K 4.0195 7.8789 120.0224 59.0809 32.6674 179.1351 32 S 4.2215 8.0811 113.9429 60.3720 62.6597 175.3120 33 R 4.4674 7.4436 119.6628 55.0609 30.3073 175.4903 34 N 4.2560 8.0523 114.9383 54.8638 36.4378 174.7947 35 L 4.6456 8.2627 116.0435 54.8583 41.9218 177.6473 36 T 4.8797 7.4842 107.6960 60.2280 69.3650 176.0617 37 K 4.1021 8.3049 123.1877 59.8342 32.6143 177.3817 38 D 4.6239 7.8838 117.3443 55.4932 41.9499 176.4738 39 R 3.7256 7.0922 113.1325 54.6987 32.1164 174.4055 40 C 4.7019 8.4734 116.4012 55.6549 40.2380 173.9012 41 K 4.1474 8.5513 127.5707 55.9895 32.2331 174.8927 42 P 4.6855 0.0000 0.0000 65.0171 32.5948 176.6913 43 V 4.9385 7.5979 117.8698 61.1126 34.4253 174.5140 44 N 4.7030 9.2850 125.6586 52.7397 42.8696 172.8224 45 T 4.7635 7.9455 122.1712 61.7633 71.2969 173.1308 46 F 5.0373 8.8967 124.7163 55.6859 42.0433 174.6031 47 V 4.4128 8.9776 123.4373 61.0581 33.2778 175.6483 48 H 5.6827 8.7044 127.5868 54.0191 26.5126 173.0252 49 E 4.8222 7.7155 117.7267 53.2589 34.4330 176.7332 50 S 4.3559 8.3487 114.8714 58.2739 65.0009 174.9188 51 L 3.9759 8.5590 124.3907 58.4325 41.8370 179.1595 52 A 4.0243 8.0078 120.1085 55.4094 18.1339 179.2011 53 D 4.3114 7.9362 116.2809 57.3996 41.1702 178.9670 54 V 3.7684 7.8620 118.7982 66.1417 31.6144 178.0567 55 Q 3.8914 8.6250 117.9777 58.9228 28.5027 178.6958 56 A 4.0618 8.1933 121.2487 54.4364 18.2829 179.6268 57 V 3.4154 7.6353 117.0654 65.8580 31.3165 176.9204 58 C 3.6875 7.7805 115.0115 57.9764 39.8636 174.1682 59 S 4.6877 7.5053 114.4082 57.9746 63.8352 174.3758 60 Q 4.1028 7.2485 120.1344 56.2286 30.5974 178.4184 61 K 4.3376 8.5742 134.6167 56.4790 32.7594 174.7726 62 N 4.3344 8.7892 127.6214 53.7315 39.3532 174.3364 63 V 4.5944 8.3751 118.4763 59.1199 36.6663 175.0004 64 A 4.2526 8.4065 124.9455 52.3521 19.0251 178.5265 65 C 4.7305 8.9658 119.2229 55.8977 41.3279 175.1392 66 K 3.7087 8.6963 121.5212 59.8921 31.6228 178.1329 67 N 4.5119 8.0447 112.6130 53.0914 37.4427 175.8468 68 G 3.9475 8.2487 108.5594 45.6837 0.0000 174.2617 69 Q 4.2809 8.5642 119.4934 56.1758 29.2510 176.1223 70 T 4.7229 8.2038 108.2141 61.6698 69.2529 173.7090 71 N 5.0134 8.0857 117.1614 54.3227 38.7131 174.7176 72 C 5.3414 7.5349 114.9437 56.8070 44.3662 172.5906 73 Y 5.0627 8.7923 118.3066 56.4882 42.2904 173.9351 74 Q 4.9724 9.1635 126.1088 54.3087 30.9900 174.9351 75 S 4.5090 8.8329 122.2834 58.8195 63.0618 174.2939 76 Y 4.5263 9.1305 122.0295 60.8704 37.9265 176.8907 77 S 4.7943 7.8549 113.9550 56.9919 64.6604 173.9147 78 T 4.1173 8.0469 112.7171 62.2028 69.6493 173.3718 79 M 5.0337 9.1052 121.6818 53.3531 36.8976 174.7121 80 S 4.9039 9.4059 117.6426 58.4127 63.5902 173.1268 81 I 5.0918 9.0831 120.0816 59.5559 41.8195 174.0328 82 T 4.9612 8.9148 119.3728 61.9563 71.6378 172.9129 83 D 4.9110 9.2282 127.5153 53.5191 42.7309 174.7856 84 C 5.4597 9.1709 121.8324 55.2981 41.6210 172.8986 85 R 5.2797 8.7495 123.8512 54.0839 32.9959 174.1709 86 E 4.1249 9.2750 128.2616 56.2835 30.3159 176.8035 87 T 4.1897 8.6414 116.4570 61.0213 69.7188 175.9832 88 G 3.6057 8.5592 111.5446 48.0506 0.0000 174.6147 89 S 4.4895 7.2582 112.3849 58.0693 63.7292 174.5056 90 S 4.1421 7.3565 117.0582 58.2993 62.8191 173.3497 91 K 4.4687 8.2777 127.3874 54.7257 34.7511 174.5524 92 Y 4.3885 8.7732 127.7303 57.6693 39.0516 174.0589 93 P 3.2585 0.0000 0.0000 63.0587 32.3393 176.5924 94 N 4.6703 7.4462 119.2075 52.0377 36.9897 174.0933 95 C 4.3507 7.8947 116.2403 56.9043 41.4613 173.5201 96 A 5.0664 8.7658 125.4373 50.4050 21.8253 174.5205 97 Y 5.1196 9.4232 119.4551 56.0848 42.2328 175.1711 98 K 4.5702 9.1310 122.1235 55.6591 34.2008 175.6941 99 T 4.9913 8.5605 121.5182 62.6723 70.0582 174.3072 100 T 4.6084 8.7851 122.7603 61.7785 71.9822 173.4055 101 Q 4.7630 8.8307 125.6641 55.8149 29.8854 175.1718 102 A 4.6163 8.9493 123.3685 50.9958 23.6284 174.8322 103 N 5.2886 8.7200 117.3227 51.9460 40.6840 173.3586 104 K 4.8174 8.9115 124.5326 54.5775 37.5962 175.5675 105 H 4.7763 9.0007 119.5365 55.9129 29.8860 174.8504 106 I 4.7618 8.6168 116.0350 59.4178 40.5234 174.4168 107 I 4.9132 8.3110 124.7424 59.7159 39.8154 175.0919 108 V 4.8203 8.6125 119.5405 59.2688 35.9667 174.6150 109 A 4.8930 8.7657 125.3017 51.5150 20.1696 175.8107 110 C 5.1152 8.7033 119.3227 55.2468 39.9474 173.1903 111 E 4.7168 8.7386 121.0636 56.5978 33.5744 175.3776 112 G 3.8392 9.5089 110.8021 44.6600 0.0000 171.4422 113 N 4.8595 8.1593 116.1747 50.6411 40.4508 172.2977 114 P 4.3555 0.0000 0.0000 62.8613 32.0154 175.9510 115 Y 5.1736 8.2055 121.3590 56.4073 38.4567 174.4715 116 V 4.4293 7.8896 119.0381 58.1839 36.9379 173.3726 117 P 4.5011 0.0000 0.0000 62.9173 31.7352 177.4117 118 V 4.5933 8.6312 115.1153 61.1086 33.8081 175.1561 119 H 4.9800 7.8523 119.4184 55.0358 33.3939 171.8037 120 F 4.6238 8.7713 128.0647 57.4550 39.3767 174.4878 121 D 4.6037 8.5709 127.1739 56.1913 41.9396 175.8815 122 A 4.5862 6.5290 117.3755 51.5768 22.2834 174.8625 123 S 5.1874 8.9424 113.4282 56.6699 66.0818 174.7020 124 V 4.1451 8.8403 114.5642 61.6845 32.3585 175.4933 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 K 8.31 4.26 0.00 1.77 1.82 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 2 E 8.51 3.98 0.00 2.02 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 2.31 2.38 0.00 3 T 8.75 4.15 4.26 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 1.23 0.00 0.00 4 A 8.57 4.00 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 5 A 8.28 4.23 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 6 A 8.20 3.99 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 7 K 8.48 3.98 0.00 1.94 2.04 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.46 7.81 8 F 8.48 4.09 0.00 3.27 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 9 E 8.47 4.05 0.00 2.30 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 2.53 2.71 0.00 10 R 8.01 3.88 0.00 1.80 2.09 0.00 3.36 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 1.63 1.67 0.00 11 Q 8.06 4.01 0.00 1.52 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.48 0.00 0.00 0.00 0.00 0.00 2.23 2.47 0.00 12 H 7.98 4.86 0.00 1.86 2.59 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.95 4.77 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.75 0.00 14 D 8.98 4.74 0.00 2.70 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 15 S 8.66 4.27 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 16 S 8.29 4.24 0.00 3.97 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 17 T 7.44 4.66 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 1.18 0.00 0.00 18 S 8.47 4.22 0.00 3.96 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 19 A 7.18 4.26 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 20 A 7.93 3.27 0.69 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 0.00 0.00 21 S 8.35 4.22 0.00 3.96 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 22 S 7.51 4.90 0.00 3.97 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 23 S 8.66 4.34 0.00 4.04 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 24 N 7.97 4.64 0.00 2.79 2.85 0.00 0.00 6.67 8.03 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 25 Y 7.84 4.04 0.00 3.16 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 26 C 8.39 4.28 0.00 3.16 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 27 N 8.29 4.40 0.00 3.07 2.94 0.00 0.00 6.73 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 28 Q 8.18 3.92 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 29 M 8.25 3.71 0.00 0.85 1.34 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.20 0.00 30 M 8.21 4.04 0.00 1.70 1.83 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.33 0.00 31 K 7.88 4.02 0.00 1.86 1.93 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.31 7.81 32 S 8.08 4.22 0.00 4.03 4.02 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 0.00 0.00 0.00 33 R 7.44 4.47 0.00 1.89 2.13 0.00 3.61 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.01 0.00 34 N 8.05 4.26 0.00 2.89 2.94 0.00 0.00 6.80 7.47 0.00 0.00 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 L 8.26 4.65 0.00 1.75 1.62 0.77 0.72 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 36 T 7.48 4.88 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 1.44 0.00 0.00 37 K 8.30 4.10 0.00 1.77 1.88 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.43 7.81 38 D 7.88 4.62 0.00 2.61 2.57 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 0.00 0.00 0.00 0.00 39 R 7.09 3.73 0.00 1.81 1.64 0.00 2.95 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 0.00 40 C 8.47 4.70 0.00 3.08 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 41 K 8.55 4.15 0.00 1.80 1.77 0.00 1.75 0.00 0.00 1.60 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.42 7.81 42 P 0.00 4.69 0.00 2.14 2.09 0.00 3.62 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 43 V 7.60 4.94 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 9.29 4.70 0.00 2.61 2.25 0.00 0.00 6.68 7.32 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 45 T 7.95 4.76 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 0.96 0.00 0.00 46 F 8.90 5.04 0.00 2.98 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 47 V 8.98 4.41 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 1.06 0.00 0.00 1.06 0.00 0.00 48 H 8.70 5.68 0.00 3.02 3.49 0.00 5.61 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 49 E 7.72 4.82 0.00 1.95 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 0.00 2.25 2.25 0.00 50 S 8.35 4.36 0.00 4.07 4.02 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 0.00 0.00 0.00 51 L 8.56 3.98 0.00 1.83 1.75 1.02 1.08 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 52 A 8.01 4.02 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 53 D 7.94 4.31 0.00 2.84 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 54 V 7.86 3.77 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 1.21 0.00 0.00 1.06 0.00 0.00 55 Q 8.63 3.89 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 56 A 8.19 4.06 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 57 V 7.64 3.42 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 0.98 0.00 0.00 0.95 0.00 0.00 58 C 7.78 3.69 0.00 2.81 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.51 4.69 0.00 3.91 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 60 Q 7.25 4.10 0.00 1.61 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.99 0.00 0.00 0.00 0.00 0.00 1.76 2.14 0.00 61 K 8.57 4.34 0.00 2.12 1.88 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.49 7.81 62 N 8.79 4.33 0.00 2.74 2.65 0.00 0.00 7.00 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 63 V 8.38 4.59 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 0.81 0.00 0.00 64 A 8.41 4.25 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 65 C 8.97 4.73 0.00 3.10 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 66 K 8.70 3.71 0.00 1.78 1.90 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.62 7.81 67 N 8.04 4.51 0.00 2.79 2.90 0.00 0.00 6.17 7.00 0.00 0.00 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 G 8.25 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 0.00 0.00 0.00 69 Q 8.56 4.28 0.00 2.21 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 70 T 8.20 4.72 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 1.17 0.00 0.00 71 N 8.09 5.01 0.00 3.08 3.15 0.00 0.00 6.04 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 72 C 7.53 5.34 0.00 2.98 2.90 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 0.00 0.00 0.00 73 Y 8.79 5.06 0.00 2.81 2.86 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 74 Q 9.16 4.97 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 75 S 8.83 4.51 0.00 3.90 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 76 Y 9.13 4.53 0.00 3.01 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 77 S 7.85 4.79 0.00 3.90 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 78 T 8.05 4.12 4.26 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 1.03 0.00 0.00 79 M 9.11 5.03 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 9.41 4.90 0.00 3.91 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 81 I 9.08 5.09 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.58 1.04 0.00 0.00 82 T 8.91 4.96 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 1.26 0.00 0.00 83 D 9.23 4.91 0.00 2.60 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 84 C 9.17 5.46 0.00 2.89 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 85 R 8.75 5.28 0.00 1.94 1.79 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 86 E 9.27 4.12 0.00 1.85 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 2.12 1.90 0.00 87 T 8.64 4.19 4.21 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 1.23 0.00 0.00 88 G 8.56 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 0.00 0.00 0.00 89 S 7.26 4.49 0.00 3.86 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 90 S 7.36 4.14 0.00 3.77 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 91 K 8.28 4.47 0.00 1.76 1.58 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.44 7.81 92 Y 8.77 4.39 0.00 2.92 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 93 P 0.00 3.26 0.00 1.82 1.30 0.00 3.64 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 94 N 7.45 4.67 0.00 2.70 2.78 0.00 0.00 6.95 7.73 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 95 C 7.89 4.35 0.00 3.14 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 96 A 8.77 5.07 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.42 5.12 0.00 2.86 2.90 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 0.00 0.00 0.00 98 K 9.13 4.57 0.00 1.72 1.77 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.58 7.81 99 T 8.56 4.99 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 1.32 0.00 0.00 100 T 8.79 4.61 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 1.23 0.00 0.00 101 Q 8.83 4.76 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 102 A 8.95 4.62 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 0.00 103 N 8.72 5.29 0.00 2.70 2.72 0.00 0.00 6.75 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 0.00 104 K 8.91 4.82 0.00 1.76 1.82 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.44 7.81 105 H 9.00 4.78 0.00 3.20 3.34 0.00 5.59 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.62 4.76 1.75 0.00 0.00 1.00 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 1.25 1.12 0.00 0.00 107 I 8.31 4.91 1.68 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 1.15 0.73 0.85 0.00 0.00 108 V 8.61 4.82 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 0.73 0.00 0.00 0.80 0.00 0.00 109 A 8.77 4.89 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 0.00 110 C 8.70 5.12 0.00 2.15 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 0.00 0.00 0.00 0.00 111 E 8.74 4.72 0.00 1.98 1.69 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 2.23 2.32 0.00 112 G 9.51 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 0.00 0.00 0.00 113 N 8.16 4.86 0.00 2.66 2.71 0.00 0.00 6.91 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 0.00 114 P 0.00 4.36 0.00 2.22 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.21 5.17 0.00 2.83 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 0.00 116 V 7.89 4.43 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 0.70 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.50 0.00 0.49 1.01 0.00 3.22 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 118 V 8.63 4.59 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 0.64 0.00 0.00 0.93 0.00 0.00 119 H 7.85 4.98 0.00 3.28 3.13 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.77 4.62 0.00 2.65 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 0.00 121 D 8.57 4.60 0.00 2.62 2.59 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 0.00 122 A 6.53 4.59 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 0.00 123 S 8.94 5.19 0.00 4.05 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 0.00 124 V 8.84 4.15 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 0.73 0.00 0.00 0.93 0.00 0.00