NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.1039 8.0976 119.7027 58.4776 31.8029 176.3349 3 H 4.2040 8.0544 119.3517 56.4373 27.3993 172.9111 4 L 4.5976 8.2682 119.3599 55.6031 43.4791 178.6793 5 K 3.9995 8.0732 117.2544 58.7397 32.2545 177.2267 6 S 4.5055 7.4300 113.5230 57.3127 65.0856 172.8377 7 G 3.9018 8.5839 109.1843 45.8860 0.0000 175.0623 8 R 3.4475 8.5538 120.0763 57.4896 30.1968 174.9773 9 K 4.6455 8.1771 112.8683 56.8692 35.1114 174.5933 10 L 4.4965 8.0732 118.1845 53.9419 45.4301 174.3727 11 N 4.7812 8.3480 119.6948 52.6889 41.7546 175.3753 12 R 3.8891 9.5335 118.0081 55.9928 28.3980 175.4400 13 H 4.9718 7.5502 114.1672 54.6656 31.0745 175.0682 14 S 3.3858 7.3148 110.7741 58.3839 64.7121 176.0164 15 S 4.1160 8.2634 116.1850 61.9607 63.0021 175.6788 16 H 3.9529 8.5406 122.6078 58.2093 29.3208 176.6963 17 R 3.8029 7.9508 116.9414 59.6904 29.1573 178.2420 18 L 4.0296 8.5019 120.7814 58.0284 42.1762 178.6384 19 A 4.0034 8.3598 120.8770 55.2207 18.1487 179.0597 20 L 3.7240 8.1890 119.1678 58.4817 42.0272 178.4547 21 Y 3.8821 7.5934 116.2947 61.2798 37.8424 179.0633 22 R 3.9691 7.7982 118.3909 59.5331 30.1495 178.8106 23 N 4.2973 8.4703 116.2189 56.6421 38.6489 177.6484 24 Q 3.9794 8.4530 119.1071 58.3099 28.6090 178.7769 25 A 4.0217 8.2459 122.7255 55.0569 18.3559 179.3310 26 K 3.8098 8.2224 115.9719 60.0765 32.5939 179.1855 27 S 4.3090 8.3507 115.1625 61.5277 62.6886 176.5535 28 L 3.9598 7.8870 122.7570 58.3095 41.7715 178.8207 29 L 4.1285 8.1393 116.2832 56.6692 41.5495 178.7083 30 T 4.2040 7.5710 115.7172 65.4571 68.9786 175.6741 31 H 4.8232 8.2982 115.0405 54.7103 30.8818 174.7763 32 G 4.2031 9.1170 115.7272 45.1710 0.0000 173.3554 33 R 4.6612 7.6183 123.6892 54.3874 30.7902 175.4780 34 I 4.7627 8.2514 124.3805 59.4066 41.0204 174.7833 35 T 5.0250 8.3276 115.3311 59.8510 70.7822 173.4695 36 T 4.5455 7.8736 119.1348 61.8378 70.7669 172.6330 37 T 4.6508 8.4978 109.7014 61.0943 70.3189 175.2970 38 V 3.5292 8.1140 121.3038 66.1439 31.4047 176.3740 39 P 4.2133 0.0000 0.0000 65.5307 31.3441 178.5255 40 K 3.8366 7.8414 116.7210 59.8251 32.0043 178.9112 41 A 3.9798 8.0852 120.6141 55.0466 18.5630 179.4312 42 K 3.8111 8.0823 116.6479 59.9135 32.3536 179.3791 43 E 4.1020 8.3323 118.2415 59.5025 29.4383 178.9795 44 L 4.1950 8.1856 120.3718 58.2713 42.1056 178.6572 45 R 4.0226 8.7954 119.0563 59.6955 29.8024 178.5349 46 G 3.6677 7.7588 103.9512 47.7320 0.0000 175.1223 47 F 3.9543 8.0669 122.7980 60.9211 39.3539 177.3265 48 V 3.6278 8.2300 117.7829 66.2224 31.4152 177.2970 49 D 4.3109 7.8682 118.3777 57.8601 40.7213 178.5224 50 H 3.8901 7.7573 118.2053 59.5108 29.8074 177.0575 51 L 3.8193 7.3017 119.5238 57.7223 41.3430 179.7567 52 I 3.4082 7.5301 119.6599 64.6104 36.8360 177.9677 53 H 3.6917 7.6146 117.8880 59.0078 29.3968 176.7145 54 L 3.9926 8.3392 122.2229 57.8822 41.6135 178.6664 55 A 4.2519 7.6158 119.8916 54.3052 18.4408 178.9707 56 K 3.9082 7.9621 118.1563 60.7489 32.5831 178.8949 57 R 4.4133 7.8325 122.8093 55.9952 29.7831 175.5350 58 G 4.3024 8.8465 101.7011 46.6642 0.0000 172.4683 59 D 4.3111 8.0249 120.4120 52.5006 39.8106 177.9447 60 L 3.8879 8.5029 122.4255 58.7277 40.2062 179.0935 61 H 4.0305 8.1723 119.0065 59.3285 29.6961 176.6487 62 A 4.0163 7.7999 120.5890 55.5076 18.4469 178.9893 63 R 4.1185 7.8447 116.5273 59.8500 30.0036 178.5447 64 R 3.9637 8.9065 118.2408 59.2474 30.2450 178.9811 65 L 3.9394 7.9118 120.3039 57.9670 42.0352 178.6876 66 V 3.8699 7.9365 116.9063 64.5051 31.3678 176.9330 67 L 4.8760 7.2428 118.2981 55.7937 41.7354 178.3050 68 R 4.2093 7.6060 118.1803 59.3485 30.3080 177.2565 69 D 4.6686 8.1160 117.8330 55.1755 41.6292 176.0522 70 L 4.2359 7.8712 117.8423 54.8767 42.7482 177.9343 71 Q 4.0487 8.6211 124.0897 57.8136 30.1187 174.9904 72 D 4.3428 7.9749 117.5272 54.4943 41.8039 176.5246 73 V 3.6541 8.4265 127.7486 66.0854 31.3650 177.8092 74 K 4.0009 8.2431 117.5522 59.1228 32.1810 178.9212 75 L 4.0877 7.9149 120.4192 58.1715 42.3393 179.0158 76 V 3.5540 7.7650 119.1766 64.8898 31.0421 177.8890 77 R 4.0148 8.2269 119.3109 59.3906 29.8677 178.3036 78 K 4.0445 7.9447 118.9790 59.3584 32.0708 178.4216 79 L 3.9224 7.6877 120.4832 57.9480 41.6765 178.0540 80 F 4.8269 7.3018 113.4095 57.5590 38.8832 175.2702 81 D 4.7194 7.7889 117.2271 55.2659 43.4168 176.3458 82 E 4.4260 8.7482 117.7343 58.0516 30.5315 177.6966 83 I 3.7504 7.6960 117.4232 64.3854 37.5975 177.7428 84 A 4.2104 8.3306 121.5747 54.9426 18.3446 177.6685 85 P 4.2279 0.0000 0.0000 66.0489 31.2276 178.7579 86 R 3.9502 7.4179 115.3787 58.9757 30.1157 177.6091 87 Y 4.6976 7.6649 114.4465 56.6968 38.5722 175.3390 88 R 4.1789 7.7856 120.7033 58.3167 30.4796 175.7528 89 D 4.4414 8.8733 121.4835 55.2563 39.0687 174.6329 90 R 4.5100 7.7104 117.8549 54.7631 29.4206 176.7931 91 Q 4.1579 7.2184 116.4794 56.7641 29.6319 177.5186 92 G 3.9121 8.8124 111.6669 45.4466 0.0000 173.1818 93 G 3.8936 8.3151 105.8250 46.7744 0.0000 173.0237 94 Y 3.9949 8.5630 115.2842 59.0002 38.9937 175.3328 95 T 4.9976 7.5436 113.0884 60.3089 71.4803 172.3573 96 R 4.7449 9.5663 124.7028 54.4354 33.5684 174.1657 97 V 4.9882 8.4623 118.1154 59.6076 34.2597 174.9989 98 L 4.8753 8.9976 125.0066 52.5957 45.6316 176.1637 99 K 4.4061 8.7885 122.7567 56.4849 32.7093 176.3984 100 L 4.7807 8.1142 124.1283 53.1786 43.2164 176.9350 101 A 4.1458 8.6235 123.8803 54.2837 17.6298 177.8495 102 E 4.2954 7.8716 115.3610 56.6864 31.3157 176.7949 103 R 4.7538 8.2861 119.5705 54.7881 33.2727 174.7498 104 R 3.7599 8.6164 124.8985 56.2481 30.7478 175.9845 105 R 4.1879 8.6053 126.6678 57.7085 30.9563 175.0079 106 G 4.3839 9.2079 115.4967 45.4389 0.0000 174.1763 107 D 4.7214 7.7235 115.4101 51.5044 40.6760 176.0120 108 G 3.8492 8.0924 107.6852 46.5159 0.0000 173.6724 109 A 4.2451 8.1916 121.8819 50.6764 20.0382 176.3255 110 P 4.3785 0.0000 0.0000 62.1292 32.2038 176.0814 111 L 4.8701 8.0954 124.9095 55.1886 43.5040 175.6188 112 A 4.8915 8.4894 119.3972 51.9457 22.9468 174.4286 113 L 4.7550 8.7117 117.0313 54.1914 45.5496 176.4883 114 V 4.4984 8.9718 127.5659 61.5079 31.8381 172.8599 115 E 4.6477 9.3206 128.3658 54.2727 31.6815 174.8528 116 L 4.5895 8.1141 127.5049 53.9744 41.5191 176.8929 117 V 3.6874 7.3227 121.7515 62.2215 32.0758 176.2384 118 E 4.4857 8.5432 121.7631 57.1920 29.4828 175.4303 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 2 R 8.10 4.10 0.00 1.82 1.98 0.00 3.32 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 3 H 8.05 4.20 0.00 3.44 3.70 0.00 5.48 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.27 4.60 0.00 1.67 1.60 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.07 4.00 0.00 1.78 1.88 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.51 7.81 6 S 7.43 4.51 0.00 3.95 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 7 G 8.58 3.90 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 0.00 0.00 0.00 8 R 8.55 3.45 0.00 2.20 2.02 0.00 3.06 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 9 K 8.18 4.65 0.00 1.85 1.78 0.00 1.63 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.41 7.81 10 L 8.07 4.50 0.00 1.64 1.63 0.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.35 4.78 0.00 2.62 2.64 0.00 0.00 7.13 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 12 R 9.53 3.89 0.00 1.85 1.68 0.00 2.89 0.00 0.00 2.50 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.35 0.00 13 H 7.55 4.97 0.00 3.31 3.37 0.00 5.67 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.31 3.39 0.00 4.14 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 0.00 15 S 8.26 4.12 0.00 4.10 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 0.00 16 H 8.54 3.95 0.00 2.77 3.10 0.00 5.62 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.95 3.80 0.00 2.03 2.36 0.00 3.11 0.00 0.00 3.44 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.87 0.00 18 L 8.50 4.03 0.00 1.90 1.90 0.98 1.02 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 19 A 8.36 4.00 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 20 L 8.19 3.72 0.00 1.58 1.54 0.75 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.59 3.88 0.00 2.67 1.53 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.80 3.97 0.00 2.02 2.03 0.00 3.17 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 23 N 8.47 4.30 0.00 2.90 2.83 0.00 0.00 7.10 8.00 0.00 0.00 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 8.45 3.98 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 25 A 8.25 4.02 1.56 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 0.00 0.00 26 K 8.22 3.81 0.00 1.88 1.93 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.68 7.81 27 S 8.35 4.31 0.00 3.87 3.96 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 0.00 0.00 0.00 28 L 7.89 3.96 0.00 1.98 1.89 0.95 0.70 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 29 L 8.14 4.13 0.00 1.63 1.70 0.89 0.78 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 30 T 7.57 4.20 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 1.01 0.00 0.00 31 H 8.30 4.82 0.00 3.10 3.32 0.00 5.72 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 32 G 9.12 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 0.00 0.00 0.00 0.00 33 R 7.62 4.66 0.00 1.71 1.93 0.00 3.24 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 34 I 8.25 4.76 1.89 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 1.32 1.14 0.91 0.00 0.00 35 T 8.33 5.02 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 36 T 7.87 4.55 4.22 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 1.20 0.00 0.00 37 T 8.50 4.65 4.22 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 1.19 0.00 0.00 38 V 8.11 3.53 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 1.02 0.00 0.00 0.97 0.00 0.00 39 P 0.00 4.21 0.00 2.18 2.08 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 40 K 7.84 3.84 0.00 1.74 1.84 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.45 7.81 41 A 8.09 3.98 1.43 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 42 K 8.08 3.81 0.00 1.99 1.93 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.72 7.81 43 E 8.33 4.10 0.00 2.26 2.40 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 2.50 2.46 0.00 44 L 8.19 4.20 0.00 1.95 1.98 0.99 0.82 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 45 R 8.80 4.02 0.00 1.90 2.22 0.00 3.17 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 46 G 7.76 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.07 3.95 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 48 V 8.23 3.63 2.14 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 1.04 0.00 0.00 1.11 0.00 0.00 49 D 7.87 4.31 0.00 3.01 2.88 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 50 H 7.76 3.89 0.00 3.07 3.30 0.00 5.79 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 51 L 7.30 3.82 0.00 1.80 1.57 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.53 3.41 1.41 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.66 0.50 0.00 0.00 53 H 7.61 3.69 0.00 2.63 3.07 0.00 5.76 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.34 3.99 0.00 1.61 1.64 0.82 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.62 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.96 3.91 0.00 1.59 1.90 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.59 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.43 1.51 7.81 57 R 7.83 4.41 0.00 1.90 1.83 0.00 3.59 0.00 0.00 3.24 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 58 G 8.85 4.30 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 0.00 59 D 8.02 4.31 0.00 2.84 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 60 L 8.50 3.89 0.00 1.81 1.89 0.89 0.60 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 61 H 8.17 4.03 0.00 3.19 3.50 0.00 5.68 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 62 A 7.80 4.02 1.45 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 0.00 0.00 0.00 63 R 7.84 4.12 0.00 1.52 1.96 0.00 2.96 0.00 0.00 3.26 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 64 R 8.91 3.96 0.00 1.92 1.97 0.00 3.17 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 65 L 7.91 3.94 0.00 1.83 1.87 0.90 0.71 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 66 V 7.94 3.87 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 0.93 0.00 0.00 1.04 0.00 0.00 67 L 7.24 4.88 0.00 1.75 1.72 1.02 0.99 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 68 R 7.61 4.21 0.00 1.98 2.01 0.00 3.16 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 69 D 8.12 4.67 0.00 2.74 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 70 L 7.87 4.24 0.00 1.68 1.62 0.91 0.95 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 71 Q 8.62 4.05 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.07 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 72 D 7.97 4.34 0.00 2.79 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 73 V 8.43 3.65 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 1.04 0.00 0.00 1.01 0.00 0.00 74 K 8.24 4.00 0.00 1.99 1.87 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.46 7.81 75 L 7.91 4.09 0.00 1.89 1.80 0.91 0.92 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 76 V 7.77 3.55 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 0.84 0.00 0.00 1.15 0.00 0.00 77 R 8.23 4.01 0.00 2.15 2.19 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.72 0.00 78 K 7.94 4.04 0.00 1.90 2.04 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.45 7.81 79 L 7.69 3.92 0.00 1.62 1.13 0.64 0.72 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 F 7.30 4.83 0.00 3.15 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 81 D 7.79 4.72 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.75 4.43 0.00 1.95 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 2.20 2.29 0.00 83 I 7.70 3.75 1.99 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 1.74 0.91 1.04 0.00 0.00 84 A 8.33 4.21 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 85 P 0.00 4.23 0.00 2.16 2.14 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 86 R 7.42 3.95 0.00 1.56 1.40 0.00 3.06 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 87 Y 7.66 4.70 0.00 3.23 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 88 R 7.79 4.18 0.00 1.90 1.88 0.00 3.49 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 89 D 8.87 4.44 0.00 2.88 2.75 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 0.00 0.00 0.00 90 R 7.71 4.51 0.00 1.82 2.06 0.00 3.59 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.49 0.00 91 Q 7.22 4.16 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.71 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 92 G 8.81 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 0.00 0.00 0.00 93 G 8.32 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 94 Y 8.56 3.99 0.00 2.88 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 95 T 7.54 5.00 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 1.26 0.00 0.00 96 R 9.57 4.74 0.00 1.83 1.88 0.00 3.33 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 97 V 8.46 4.99 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 0.81 0.00 0.00 0.94 0.00 0.00 98 L 9.00 4.88 0.00 1.52 1.51 0.93 0.75 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 99 K 8.79 4.41 0.00 1.64 1.74 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.42 7.81 100 L 8.11 4.78 0.00 1.54 1.57 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.62 4.15 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 0.00 102 E 7.87 4.30 0.00 1.94 1.89 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 2.40 2.34 0.00 103 R 8.29 4.75 0.00 1.63 1.82 0.00 3.25 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 104 R 8.62 3.76 0.00 1.95 2.05 0.00 3.14 0.00 0.00 3.08 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 105 R 8.61 4.19 0.00 1.80 1.81 0.00 3.29 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 1.61 1.63 0.00 106 G 9.21 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 0.00 0.00 0.00 0.00 107 D 7.72 4.72 0.00 2.75 2.75 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 0.00 0.00 0.00 108 G 8.09 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 0.00 109 A 8.19 4.25 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 0.00 110 P 0.00 4.38 0.00 2.12 2.24 0.00 3.69 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 111 L 8.10 4.87 0.00 1.67 1.64 0.91 0.54 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 0.00 112 A 8.49 4.89 1.25 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 0.00 0.00 113 L 8.71 4.75 0.00 1.73 1.47 1.00 0.91 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 0.00 114 V 8.97 4.50 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 0.96 0.00 0.00 115 E 9.32 4.65 0.00 2.06 1.81 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 2.28 2.31 0.00 116 L 8.11 4.59 0.00 1.64 1.89 1.02 0.88 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 0.00 117 V 7.32 3.69 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 0.78 0.00 0.00 0.99 0.00 0.00 118 E 8.54 4.49 0.00 2.06 1.81 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 2.07 2.23 0.00