NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3849 0.0000 0.0000 62.0037 32.6363 175.9431 3 K 4.0944 8.5237 121.8831 55.1964 32.8116 175.2771 4 K 4.1160 9.6032 127.3722 56.6706 33.7624 175.2178 5 V 4.9607 8.3837 126.3423 61.1939 33.9531 174.3369 6 L 4.8769 8.7953 125.9654 53.2434 46.2302 175.2194 7 T 5.0632 8.2455 116.6403 62.0929 71.6662 173.8302 8 G 4.1525 8.8107 112.0776 45.5803 0.0000 171.0880 9 V 4.8503 7.9053 118.9871 60.8443 34.7173 175.7121 10 V 4.1674 8.5718 127.5383 62.9820 31.2205 176.3881 11 V 4.1533 8.5401 121.9285 61.8785 32.7628 176.6156 12 S 4.5784 7.7756 115.4087 56.5070 66.0178 173.4016 13 D 4.8707 8.6691 123.8597 53.8492 41.9245 176.8223 14 K 4.1926 7.8013 115.4342 58.2227 32.0257 176.5688 15 M 4.5696 7.2782 117.5970 53.6105 34.3243 174.8931 16 Q 4.7549 8.2649 117.7171 55.3877 30.2396 176.2147 17 K 4.7349 8.5874 118.5441 56.3163 30.6935 174.3276 18 T 5.3264 7.6087 113.1383 62.1699 72.6173 173.8579 19 V 4.6714 9.1287 116.8865 60.1071 36.6897 174.9478 20 T 4.7729 8.6432 120.9529 62.4497 69.5768 173.8354 21 V 4.3815 8.8788 128.0621 61.5837 33.5606 174.7953 22 L 4.8421 8.9371 130.9734 53.2915 42.4125 173.9176 23 V 4.0496 8.5130 124.6367 61.7604 32.5837 174.3778 24 E 5.0551 8.7301 128.6017 55.1591 31.7085 174.6481 25 R 4.8261 9.0653 123.2218 55.1212 34.1014 173.6328 26 Q 5.3622 9.4228 122.5887 53.2262 32.7672 174.5684 27 F 5.2410 7.5021 120.0138 56.0341 41.0195 171.5828 28 P 4.7751 0.0000 0.0000 62.9256 32.1558 175.6149 29 H 4.4277 9.4963 124.4292 55.2496 30.3528 174.2915 30 P 4.3261 0.0000 0.0000 65.0454 31.0255 176.6210 31 L 4.4828 7.9163 117.7326 55.4169 44.2521 176.1549 32 Y 4.7854 7.9706 113.8278 57.0093 38.5462 177.1733 33 G 4.0870 8.3335 106.4597 46.0370 0.0000 174.2813 34 K 4.2116 7.8582 119.4385 56.6361 34.0681 176.6155 35 V 4.2538 8.3358 122.8933 62.9493 31.6066 175.2189 36 I 4.4316 8.2584 121.7788 58.9662 40.7462 174.2103 37 K 4.7938 8.3083 123.4208 54.6915 34.6987 174.7633 38 R 4.9649 9.0308 126.8321 54.8659 34.2512 173.2738 39 S 5.1192 8.2825 114.3603 57.6294 66.5743 173.1583 40 K 4.3827 8.7624 118.3959 55.4798 35.8656 173.9184 41 K 4.9392 8.5456 126.5528 55.4450 33.6179 175.4003 42 Y 4.6202 9.3792 122.8428 56.1018 41.1358 175.1079 43 L 4.9760 8.7351 123.4410 53.7907 42.3831 175.8262 44 A 4.8963 9.2565 127.1572 50.9195 20.8466 175.3326 45 H 4.9352 9.3215 122.0738 55.7827 31.3323 173.6848 46 D 4.8916 9.3857 126.4375 51.5160 41.7148 174.1598 47 P 4.1832 0.0000 0.0000 65.4933 31.6513 178.3730 48 E 4.3230 8.2594 112.6914 56.1138 29.1620 176.5397 49 E 3.8958 7.9566 118.0910 57.1039 27.1876 176.9967 50 K 4.0564 7.3382 120.7707 57.3487 32.8146 175.9081 51 Y 4.1646 7.3641 115.2314 58.8426 38.8503 176.5531 52 K 4.7923 8.9260 123.1832 53.0936 34.5315 175.2021 53 L 4.0972 8.5114 123.1036 58.3513 42.0596 175.9974 54 G 3.6368 8.2554 115.5033 45.4971 0.0000 172.8661 55 D 4.8203 8.0263 120.9345 54.0679 42.6511 175.4356 56 V 4.6868 8.5516 120.9410 61.8922 33.6975 175.1807 57 V 4.9220 8.7753 119.2889 60.2098 37.0412 173.3168 58 E 4.9624 8.8780 121.4489 55.2267 31.6149 175.5634 59 I 4.7929 9.0271 124.9168 59.5261 40.7542 174.3658 60 I 4.9564 8.7315 124.7456 58.7869 41.2425 174.0847 61 E 3.5081 9.4133 131.0870 56.8960 29.8946 175.8264 62 S 4.7566 8.0313 122.4476 56.3465 67.3259 173.5661 63 R 4.0134 8.4727 120.5176 55.2643 30.4166 174.0807 64 P 4.1764 0.0000 0.0000 63.3790 31.7459 175.9697 65 I 4.4673 7.7764 120.6072 60.7406 39.4054 175.7370 66 S 4.5120 7.6361 111.5693 57.0121 64.4715 176.1152 67 K 3.5944 8.7827 122.9920 58.2543 32.2289 175.4712 68 R 3.6069 8.4569 127.1355 54.1359 27.3381 174.8932 69 K 5.4776 6.7549 130.3671 56.7292 34.1533 173.7848 70 R 4.9936 7.8119 127.3268 55.4838 32.4591 174.5255 71 F 5.2541 8.3370 116.1756 55.9819 43.4932 174.0916 72 R 4.8563 8.8148 121.3468 54.3305 33.4187 176.0304 73 V 3.7682 7.8465 121.9020 62.2656 30.3306 175.7042 74 L 4.2134 8.3931 129.2813 57.1833 41.8414 176.9168 75 R 4.8122 7.4827 112.2497 55.0655 33.1504 172.5676 76 L 4.6815 8.5999 121.4998 54.8785 42.7887 175.6239 77 V 4.3677 8.4218 124.5964 64.0683 33.2372 175.8683 78 E 4.7273 7.6884 115.9104 55.3964 32.4377 174.8978 79 S 4.7717 8.9872 118.7559 57.3928 64.2767 174.2029 80 G 3.6902 8.2842 104.9172 47.0636 0.0000 174.3281 81 R 4.8434 7.4362 119.9522 55.2185 31.2867 175.0420 82 M 4.2142 7.4908 123.9759 58.3219 32.3052 177.3101 83 D 4.4728 8.2393 119.6597 56.8779 38.6216 178.8008 84 L 4.1433 7.9813 119.9590 57.3563 41.5964 179.5201 85 V 3.7424 7.6952 117.7821 65.7974 31.4351 177.5947 86 E 4.1431 8.8220 118.9490 59.3664 29.2385 179.0488 87 K 3.8763 7.7308 116.8549 60.3367 32.2584 178.2486 88 Y 4.1096 7.8517 118.4860 60.2218 38.7603 177.4082 89 L 3.6897 8.9245 120.5705 58.0900 41.9801 179.7122 90 I 3.5859 8.0194 119.5951 64.4956 36.8537 178.1542 91 R 3.7737 7.2484 118.0249 59.4919 29.9742 178.0918 92 R 3.1168 7.2395 117.8565 59.3589 29.6288 178.0561 93 Q 3.8612 8.1803 119.6105 59.5527 28.5676 178.6843 94 N 4.2417 7.8559 116.6863 56.2728 38.8528 176.4283 95 Y 4.3497 8.3537 118.4835 61.1415 37.7695 178.1731 96 Q 4.1407 7.5096 117.6457 55.5664 29.4985 176.2618 97 S 4.4501 8.0242 111.9563 59.4208 62.8989 178.7509 98 L 3.6240 8.0159 113.1524 55.9576 37.8330 174.6234 99 S 4.8110 7.4840 118.2080 59.7043 70.0800 176.5318 100 K 4.6083 7.8584 117.5220 54.4959 34.1787 176.4088 101 R 4.3287 8.3928 114.2614 53.3140 32.8342 174.9963 102 G 4.4026 7.5114 106.0324 43.5637 0.0000 172.9020 103 G 3.9856 8.0778 108.8941 44.5978 0.0000 171.8941 104 K 4.4438 7.0577 120.3585 53.2543 36.0211 175.1517 105 A 4.0929 8.1916 120.4602 53.6918 19.0204 176.3757 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 P 0.00 4.38 0.00 2.19 2.12 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 3 K 8.52 4.09 0.00 1.74 1.90 0.00 1.73 0.00 0.00 1.91 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.48 7.81 4 K 9.60 4.12 0.00 1.93 1.81 0.00 1.47 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.50 1.46 7.81 5 V 8.38 4.96 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 0.91 0.00 0.00 0.98 0.00 0.00 6 L 8.80 4.88 0.00 1.15 1.22 0.25 0.59 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 7 T 8.25 5.06 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 8 G 8.81 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 0.00 0.00 0.00 9 V 7.91 4.85 2.02 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 0.96 0.00 0.00 0.91 0.00 0.00 10 V 8.57 4.17 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 0.91 0.00 0.00 0.91 0.00 0.00 11 V 8.54 4.15 1.68 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 0.26 0.00 0.00 0.41 0.00 0.00 12 S 7.78 4.58 0.00 3.86 3.63 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 13 D 8.67 4.87 0.00 2.72 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 14 K 7.80 4.19 0.00 1.85 1.87 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.43 7.81 15 M 7.28 4.57 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 16 Q 8.26 4.75 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.20 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 17 K 8.59 4.73 0.00 2.14 1.91 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.38 7.81 18 T 7.61 5.33 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 1.31 0.00 0.00 19 V 9.13 4.67 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 0.83 0.00 0.00 0.95 0.00 0.00 20 T 8.64 4.77 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 1.15 0.00 0.00 21 V 8.88 4.38 2.03 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 0.82 0.00 0.00 0.83 0.00 0.00 22 L 8.94 4.84 0.00 1.46 1.46 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.51 4.05 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 0.99 0.00 0.00 0.72 0.00 0.00 24 E 8.73 5.06 0.00 2.03 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 2.47 0.00 25 R 9.07 4.83 0.00 1.93 1.79 0.00 3.11 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.74 0.00 26 Q 9.42 5.36 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.89 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 27 F 7.50 5.24 0.00 3.23 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 28 P 0.00 4.78 0.00 2.18 2.17 0.00 4.05 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 29 H 9.50 4.43 0.00 3.20 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.33 0.00 2.13 2.15 0.00 3.39 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 31 L 7.92 4.48 0.00 1.34 1.16 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.97 4.79 0.00 2.90 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 33 G 8.33 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.86 4.21 0.00 1.90 1.97 0.00 1.17 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.44 7.81 35 V 8.34 4.25 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 0.75 0.00 0.00 0.93 0.00 0.00 36 I 8.26 4.43 1.69 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 -0.08 0.90 0.00 0.00 37 K 8.31 4.79 0.00 1.69 1.65 0.00 1.72 0.00 0.00 2.15 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.31 1.39 7.81 38 R 9.03 4.96 0.00 2.14 1.91 0.00 3.40 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 39 S 8.28 5.12 0.00 3.89 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 40 K 8.76 4.38 0.00 1.78 1.62 0.00 1.47 0.00 0.00 1.45 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.46 1.07 7.81 41 K 8.55 4.94 0.00 1.61 1.65 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.18 1.40 7.81 42 Y 9.38 4.62 0.00 2.71 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 43 L 8.74 4.98 0.00 1.60 1.70 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.26 4.90 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 45 H 9.32 4.94 0.00 3.24 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.39 4.89 0.00 2.79 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 47 P 0.00 4.18 0.00 2.21 2.09 0.00 3.63 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 2.08 1.82 0.00 48 E 8.26 4.32 0.00 1.92 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 2.30 2.33 0.00 49 E 7.96 3.90 0.00 2.01 1.98 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 2.27 2.38 0.00 50 K 7.34 4.06 0.00 1.50 1.25 0.00 1.75 0.00 0.00 1.11 0.00 0.00 2.71 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.78 1.13 7.81 51 Y 7.36 4.16 0.00 3.00 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 52 K 8.93 4.79 0.00 1.80 1.70 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.43 7.81 53 L 8.51 4.10 0.00 1.60 1.65 1.04 1.13 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 54 G 8.26 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 0.00 0.00 0.00 55 D 8.03 4.82 0.00 2.67 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 56 V 8.55 4.69 2.21 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 0.94 0.00 0.00 0.93 0.00 0.00 57 V 8.78 4.92 1.91 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 0.56 0.00 0.00 0.82 0.00 0.00 58 E 8.88 4.96 0.00 1.87 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 2.21 2.25 0.00 59 I 9.03 4.79 1.46 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.65 0.65 0.00 0.00 60 I 8.73 4.96 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 1.13 1.77 0.93 0.00 0.00 61 E 9.41 3.51 0.00 2.10 1.83 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 2.10 1.92 0.00 62 S 8.03 4.76 0.00 3.65 3.68 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 63 R 8.47 4.01 0.00 1.73 1.78 0.00 3.25 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 64 P 0.00 4.18 0.00 2.04 1.99 0.00 3.62 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 2.00 2.10 0.00 65 I 7.78 4.47 1.82 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 1.31 0.68 0.72 0.00 0.00 66 S 7.64 4.51 0.00 3.92 3.77 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 67 K 8.78 3.59 0.00 1.74 1.81 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.46 7.81 68 R 8.46 3.61 0.00 2.00 2.00 0.00 3.44 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 69 K 6.75 5.48 0.00 1.95 1.93 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.53 7.81 70 R 7.81 4.99 0.00 1.67 1.53 0.00 3.18 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 71 F 8.34 5.25 0.00 2.93 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 72 R 8.81 4.86 0.00 1.78 1.83 0.00 3.16 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 73 V 7.85 3.77 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 0.74 0.00 0.00 74 L 8.39 4.21 0.00 1.71 1.62 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.48 4.81 0.00 1.94 2.02 0.00 3.03 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 76 L 8.60 4.68 0.00 1.95 1.70 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.42 4.37 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 0.85 0.00 0.00 0.92 0.00 0.00 78 E 7.69 4.73 0.00 2.04 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 0.00 2.26 2.29 0.00 79 S 8.99 4.77 0.00 3.92 3.82 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 80 G 8.28 3.69 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 0.00 81 R 7.44 4.84 0.00 2.28 2.05 0.00 2.93 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 0.00 82 M 7.49 4.21 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.24 4.47 0.00 2.87 2.96 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 84 L 7.98 4.14 0.00 1.93 1.75 0.92 0.82 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 85 V 7.70 3.74 2.25 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 1.14 0.00 0.00 0.94 0.00 0.00 86 E 8.82 4.14 0.00 2.24 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 0.00 2.57 2.51 0.00 87 K 7.73 3.88 0.00 2.03 1.93 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.51 7.81 88 Y 7.85 4.11 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 89 L 8.92 3.69 0.00 1.65 1.68 0.95 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.02 3.59 1.90 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 1.38 0.84 0.88 0.00 0.00 91 R 7.25 3.77 0.00 1.85 1.76 0.00 3.19 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 92 R 7.24 3.12 0.00 1.31 1.77 0.00 3.01 0.00 0.00 2.99 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 93 Q 8.18 3.86 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 94 N 7.86 4.24 0.00 3.07 2.97 0.00 0.00 7.02 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 95 Y 8.35 4.35 0.00 3.10 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 96 Q 7.51 4.14 0.00 1.96 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 97 S 8.02 4.45 0.00 4.02 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 98 L 8.02 3.62 0.00 1.75 1.82 0.77 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.48 4.81 0.00 3.94 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 0.00 100 K 7.86 4.61 0.00 1.70 1.81 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.42 7.81 101 R 8.39 4.33 0.00 1.74 1.71 0.00 3.36 0.00 0.00 3.23 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 102 G 7.51 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 0.00 0.00 0.00 0.00 103 G 8.08 3.99 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 0.00 0.00 0.00 104 K 7.06 4.44 0.00 1.80 1.92 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.43 7.81 105 A 8.19 4.09 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