NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3457 0.0000 0.0000 61.8986 32.6488 175.7132 3 R 3.6421 8.4706 119.6330 56.8675 30.1452 175.2560 4 A 4.4958 8.9041 128.1292 49.7740 20.5366 175.7091 5 K 4.1332 8.2580 120.5369 57.1169 32.5763 177.2220 6 T 4.5502 8.3111 108.4859 61.3132 69.8050 173.5883 7 G 3.8177 8.0386 111.4927 47.5886 0.0000 175.0869 8 I 3.3378 8.4397 112.3833 62.0402 38.3143 175.9279 9 V 3.6986 8.1342 120.2757 65.2319 31.2384 177.6027 10 R 3.9716 7.5028 116.9876 58.6066 30.1351 178.0695 11 R 3.8303 7.8772 117.4121 60.1001 30.0045 178.2159 12 R 3.8234 7.7078 115.8627 59.6249 29.8357 179.1490 13 R 3.8086 7.5425 117.6749 60.4677 30.5215 177.7812 14 H 4.2284 8.4070 116.5161 57.8268 28.5540 177.7092 15 K 4.0094 8.6617 120.7641 59.8707 31.8922 179.1264 16 K 3.9273 8.1119 118.2273 59.3455 32.2521 179.0231 17 V 3.9499 10.0556 117.8343 65.7908 31.7317 177.7007 18 L 3.9492 8.0899 118.0816 58.2183 41.3430 179.2908 19 K 3.7904 8.1483 118.2458 59.9726 32.0813 178.6717 20 R 3.9941 8.3745 117.3377 57.4025 30.1367 176.7702 21 A 3.3839 7.8715 122.8127 50.5957 19.9367 174.7388 22 K 4.4115 7.7296 118.9829 57.6446 33.1989 179.0200 23 G 4.0049 8.9659 103.0993 44.9598 0.0000 173.4127 24 F 4.8769 9.3057 120.6717 55.2578 39.2591 176.0470 25 W 4.0019 9.2704 135.0000 58.8525 31.1472 176.4954 26 G 3.4597 8.7488 113.5886 48.5298 0.0000 174.5466 27 S 3.6335 7.7709 110.7483 61.2083 65.1771 175.3105 28 R 4.2605 8.1890 116.2472 57.2603 29.5827 177.1255 29 S 4.8063 7.8663 109.4847 57.4519 65.0717 174.6298 30 K 4.4195 8.1589 118.9289 56.6631 33.6481 176.2027 31 Q 4.8403 7.8288 116.8333 53.7228 31.9809 173.8483 32 Y 4.1141 9.3020 122.6421 58.7259 37.3560 182.1189 33 R 2.7468 8.1524 114.6329 57.1268 33.1051 177.2717 34 N 4.2853 7.8241 117.7445 57.0045 39.2394 176.5977 35 A 4.1829 9.0048 121.4703 55.5986 18.6577 178.7749 36 F 4.0875 7.7520 117.0161 61.5890 39.5488 177.1083 37 Q 4.0123 8.2352 118.7789 59.7977 28.6100 178.5941 38 T 3.8867 8.2584 116.8629 66.5125 68.1458 175.6889 39 L 4.4736 7.8324 117.9500 55.0121 41.6547 177.8321 40 L 4.2937 7.3960 120.3562 56.8509 42.7697 178.6497 41 N 4.0913 7.8894 115.4311 55.7899 38.3566 177.1030 42 A 4.1275 7.8107 122.1213 55.1501 18.4687 179.1595 43 A 3.9573 7.8794 118.5844 55.8490 18.2264 179.4748 44 T 3.7036 7.6817 113.7234 67.2024 68.2951 176.1835 45 Y 4.3972 7.4963 116.6077 62.0426 37.6961 177.4558 46 E 3.7768 9.0396 117.9983 60.7129 29.4992 178.8525 47 Y 3.7763 8.8421 116.9300 61.2828 38.6569 178.1165 48 R 4.1694 7.6101 120.8087 58.5190 31.6702 177.2344 49 D 4.6840 9.1478 120.5097 55.8591 41.3908 178.9384 50 R 3.9063 7.3254 119.3610 59.3641 30.0152 178.9162 51 R 3.8757 7.7921 116.2090 59.0969 30.2109 177.8808 52 N 4.5546 7.8839 116.2420 55.9168 39.4773 177.0043 53 K 3.9751 8.5364 120.4407 59.6247 31.8369 178.9177 54 K 3.9959 7.9406 119.6518 59.5512 31.8798 178.9391 55 R 3.9448 8.2187 117.0917 60.2883 30.1962 178.0755 56 D 4.1436 8.5123 116.4747 57.4715 40.5400 178.9546 57 F 4.6478 8.4423 117.8695 61.4155 39.5297 178.4226 58 R 3.8037 7.8602 116.6743 59.3023 29.8356 178.9752 59 R 3.9930 9.1150 119.7747 59.0146 29.5543 178.1428 60 L 4.4649 8.7300 122.1309 57.1816 42.0070 178.8347 61 W 3.9688 8.5327 118.6403 59.7312 29.1909 178.0829 62 I 3.6801 7.9918 119.4495 64.8404 36.5014 178.2907 63 Q 3.9524 7.9118 118.4694 59.2925 28.5163 179.8810 64 R 3.8854 7.6764 117.7032 59.0100 29.9209 178.7580 65 I 3.6453 7.8514 119.5797 63.2884 37.1661 176.6738 66 N 4.6591 7.8208 113.9033 52.1961 38.5665 175.3348 67 A 4.4861 7.9879 121.1732 52.4707 19.0359 177.7623 68 G 3.6615 7.6409 105.4446 46.7237 0.0000 175.6162 69 A 4.2232 7.6267 121.6784 55.2307 17.9846 179.7034 70 R 4.3169 8.6655 115.6509 57.7543 29.9121 177.9197 71 L 4.2772 7.6834 119.5318 56.4683 42.2469 176.4227 72 H 4.8581 9.0436 112.9135 56.7182 31.3022 172.9920 73 G 3.5018 6.6337 106.8884 45.3723 0.0000 173.8995 74 M 4.6695 7.3460 121.5603 54.0438 31.4997 176.4804 75 N 4.5434 9.0761 125.4698 53.4801 38.9734 175.3414 76 Y 3.9918 7.7337 123.3864 60.7783 39.8874 177.6938 77 S 4.0814 8.6675 112.4761 62.8043 62.5026 176.4223 78 T 3.8448 8.2939 116.8126 66.8209 68.4595 176.4123 79 F 4.0279 8.8593 122.9413 61.5299 39.2331 177.3419 80 I 3.7688 8.5100 119.5034 64.2842 37.0513 177.7401 81 N 4.3617 8.0785 117.7228 56.6930 38.6498 176.6097 82 G 4.0756 7.8280 108.2759 47.3587 0.0000 175.3405 83 L 3.8358 7.2264 121.8073 57.0093 41.7597 179.4105 84 K 4.0148 7.8714 118.5774 59.4852 32.1691 178.4335 85 R 4.1700 8.0528 117.4246 58.4360 31.0087 177.9486 86 A 4.3487 7.7198 123.1550 49.8452 17.1777 176.8152 87 N 3.7865 8.4775 121.6140 56.4231 39.6305 176.1917 88 I 3.8217 7.9096 117.8548 64.4542 37.2620 175.9373 89 D 4.6217 8.8214 120.0205 54.0592 41.7626 177.7626 90 L 4.5794 8.0528 121.3721 54.4357 43.2508 173.1744 91 N 4.6248 7.5028 116.6114 51.8018 41.0982 176.6977 92 R 4.3852 8.1686 123.4586 57.0596 28.9620 176.8881 93 K 4.3993 7.8256 115.7110 57.4220 33.7991 174.5228 94 V 3.9851 11.1300 123.3767 63.5105 31.0007 172.4752 95 L 3.9692 8.2294 119.9865 58.2382 42.0510 178.6947 96 A 3.9320 8.0796 120.0911 55.1141 18.2281 178.7352 97 D 3.9809 7.8791 116.7918 57.6626 41.3712 178.6441 98 I 3.6641 7.3639 118.3363 64.0013 36.7685 178.0746 99 A 3.4703 7.9595 121.2477 54.2691 18.4145 179.0828 100 A 3.9518 7.5189 118.0748 54.1682 18.6737 178.1399 101 R 4.3205 8.0398 114.5173 57.4912 32.2527 176.9463 102 E 4.4922 7.3422 119.2491 53.6760 28.4683 174.5172 103 P 4.3349 0.0000 0.0000 65.5198 31.6150 178.0725 104 E 3.8055 8.0935 115.5455 59.7487 29.2356 178.6367 105 A 3.7932 7.7102 118.1545 55.4674 18.2328 179.5369 106 F 3.9572 8.5461 115.9710 60.6020 40.2165 177.9654 107 K 3.7151 8.4528 119.2301 59.5720 31.9519 178.0309 108 A 3.8988 8.5353 120.8680 55.5918 18.0827 179.5760 109 L 3.8025 7.7218 115.0678 58.5301 42.0657 178.9242 110 V 3.1169 8.1025 116.6769 66.5701 31.1411 176.8796 111 D 4.3280 8.1635 117.4393 57.5786 41.2245 178.7362 112 A 3.9249 8.0628 120.7889 55.1753 18.5571 179.4190 113 S 3.9527 8.1689 111.7528 61.6059 62.4405 176.0987 114 R 3.8182 7.8109 120.8737 58.9537 30.3116 176.1711 115 N 5.0671 7.4595 116.0513 51.1465 36.7577 174.9166 116 A 4.4469 7.3854 118.1560 52.3155 24.0490 176.5699 117 R 4.1600 8.1616 116.1806 57.1804 31.1444 175.8195 118 Q 4.1767 9.0475 116.6303 56.1578 28.8548 175.7359 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 4.35 0.00 2.19 2.12 0.00 3.76 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 1.88 1.96 0.00 3 R 8.47 3.64 0.00 1.86 1.90 0.00 3.18 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 4 A 8.90 4.50 1.20 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 5 K 8.26 4.13 0.00 1.74 1.90 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.44 7.81 6 T 8.31 4.55 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 1.18 0.00 0.00 7 G 8.04 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 0.00 0.00 0.00 8 I 8.44 3.34 1.85 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 1.28 0.54 0.90 0.00 0.00 9 V 8.13 3.70 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 0.95 0.00 0.00 0.96 0.00 0.00 10 R 7.50 3.97 0.00 1.86 1.75 0.00 3.03 0.00 0.00 2.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.46 0.00 11 R 7.88 3.83 0.00 1.84 1.96 0.00 3.19 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 12 R 7.71 3.82 0.00 1.94 1.93 0.00 3.26 0.00 0.00 3.08 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 13 R 7.54 3.81 0.00 1.91 2.06 0.00 3.06 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 1.61 1.71 0.00 14 H 8.41 4.23 0.00 3.25 3.11 0.00 5.73 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 15 K 8.66 4.01 0.00 1.81 1.92 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.76 7.81 16 K 8.11 3.93 0.00 2.01 1.95 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.69 7.81 17 V 10.06 3.95 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 1.11 0.00 0.00 1.51 0.00 0.00 18 L 8.09 3.95 0.00 1.87 1.80 1.16 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.15 3.79 0.00 1.74 2.13 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 20 R 8.37 3.99 0.00 1.82 1.94 0.00 3.25 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 21 A 7.87 3.38 1.31 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 0.00 0.00 22 K 7.73 4.41 0.00 1.81 1.61 0.00 1.44 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.01 1.26 7.81 23 G 8.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.31 4.88 0.00 2.96 3.08 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 25 W 9.27 4.00 0.00 3.25 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 26 G 8.75 3.46 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 0.00 0.00 0.00 27 S 7.77 3.63 0.00 4.13 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 0.00 28 R 8.19 4.26 0.00 2.05 2.03 0.00 3.01 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 29 S 7.87 4.81 0.00 3.98 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.16 4.42 0.00 1.77 1.89 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.36 7.81 31 Q 7.83 4.84 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 32 Y 9.30 4.11 0.00 2.93 2.31 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 33 R 8.15 2.75 0.00 1.95 2.11 0.00 3.37 0.00 0.00 3.34 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.63 0.00 34 N 7.82 4.29 0.00 2.84 2.83 0.00 0.00 6.79 8.53 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 35 A 9.00 4.18 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 36 F 7.75 4.09 0.00 2.56 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 37 Q 8.24 4.01 0.00 2.36 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 38 T 8.26 3.89 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 0.85 0.00 0.00 39 L 7.83 4.47 0.00 1.43 1.53 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 40 L 7.40 4.29 0.00 1.57 1.56 0.93 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.89 4.09 0.00 2.64 2.60 0.00 0.00 6.94 7.10 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 42 A 7.81 4.13 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 43 A 7.88 3.96 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 44 T 7.68 3.70 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 0.95 0.00 0.00 45 Y 7.50 4.40 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 46 E 9.04 3.78 0.00 2.27 2.01 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 2.41 2.61 0.00 47 Y 8.84 3.78 0.00 3.16 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 48 R 7.61 4.17 0.00 2.08 2.13 0.00 3.24 0.00 0.00 3.26 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 49 D 9.15 4.68 0.00 3.09 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 50 R 7.33 3.91 0.00 1.84 1.86 0.00 3.00 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 51 R 7.79 3.88 0.00 1.79 2.03 0.00 2.97 0.00 0.00 2.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 52 N 7.88 4.55 0.00 3.04 2.93 0.00 0.00 6.77 7.90 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 53 K 8.54 3.98 0.00 1.97 2.08 0.00 1.52 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.59 7.81 54 K 7.94 4.00 0.00 1.98 1.88 0.00 1.65 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.51 7.81 55 R 8.22 3.94 0.00 1.84 1.99 0.00 3.20 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 56 D 8.51 4.14 0.00 2.76 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 57 F 8.44 4.65 0.00 3.33 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 58 R 7.86 3.80 0.00 2.00 1.97 0.00 3.05 0.00 0.00 3.00 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.69 0.00 59 R 9.11 3.99 0.00 1.85 2.15 0.00 3.07 0.00 0.00 3.07 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 60 L 8.73 4.46 0.00 1.79 2.19 0.99 1.24 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 61 W 8.53 3.97 0.00 3.58 3.38 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 62 I 7.99 3.68 1.71 0.00 0.00 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 1.49 1.21 -0.10 0.00 0.00 63 Q 7.91 3.95 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.62 0.00 64 R 7.68 3.89 0.00 1.85 1.77 0.00 2.94 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.84 0.00 65 I 7.85 3.65 2.26 0.00 0.00 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 1.62 1.24 0.90 0.00 0.00 66 N 7.82 4.66 0.00 3.07 3.24 0.00 0.00 6.70 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 67 A 7.99 4.49 1.30 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 68 G 7.64 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.63 4.22 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 70 R 8.67 4.32 0.00 1.93 2.01 0.00 3.14 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.80 0.00 71 L 7.68 4.28 0.00 1.55 1.73 0.91 0.70 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 72 H 9.04 4.86 0.00 3.23 3.27 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 6.63 3.50 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 0.00 0.00 0.00 74 M 7.35 4.67 0.00 2.16 1.86 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 75 N 9.08 4.54 0.00 2.97 2.99 0.00 0.00 5.61 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 76 Y 7.73 3.99 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.67 4.08 0.00 4.06 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 78 T 8.29 3.84 4.56 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 1.24 0.00 0.00 79 F 8.86 4.03 0.00 3.13 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 80 I 8.51 3.77 1.74 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 0.96 -0.36 0.81 0.00 0.00 81 N 8.08 4.36 0.00 2.86 2.80 0.00 0.00 7.14 7.81 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 82 G 7.83 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 83 L 7.23 3.84 0.00 1.40 1.67 -0.05 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.87 4.01 0.00 1.78 2.04 0.00 1.82 0.00 0.00 1.92 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.48 7.81 85 R 8.05 4.17 0.00 1.94 1.90 0.00 3.23 0.00 0.00 3.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.64 0.00 86 A 7.72 4.35 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 87 N 8.48 3.79 0.00 2.65 2.89 0.00 0.00 7.29 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 88 I 7.91 3.82 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.62 0.89 0.00 0.00 89 D 8.82 4.62 0.00 2.72 2.56 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 90 L 8.05 4.58 0.00 1.60 1.58 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 91 N 7.50 4.62 0.00 2.81 2.99 0.00 0.00 7.29 7.66 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 92 R 8.17 4.39 0.00 2.04 2.19 0.00 3.44 0.00 0.00 3.38 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 93 K 7.83 4.40 0.00 1.84 1.65 0.00 1.53 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.87 7.81 94 V 11.13 3.99 2.23 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 0.87 0.00 0.00 1.11 0.00 0.00 95 L 8.23 3.97 0.00 2.04 2.02 1.33 1.46 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 96 A 8.08 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 7.88 3.98 0.00 2.32 2.66 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 0.00 0.00 0.00 0.00 98 I 7.36 3.66 2.16 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.90 1.03 0.00 0.00 99 A 7.96 3.47 0.54 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 0.00 100 A 7.52 3.95 1.15 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 0.00 101 R 8.04 4.32 0.00 1.73 1.92 0.00 3.14 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.54 0.00 102 E 7.34 4.49 0.00 2.23 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 2.27 2.32 0.00 103 P 0.00 4.33 0.00 2.22 2.17 0.00 3.64 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 104 E 8.09 3.81 0.00 1.98 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 2.34 2.36 0.00 105 A 7.71 3.79 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 0.00 106 F 8.55 3.96 0.00 3.40 3.30 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 0.00 107 K 8.45 3.72 0.00 2.02 2.05 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.42 7.81 108 A 8.54 3.90 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 0.00 109 L 7.72 3.80 0.00 1.67 1.58 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.10 3.12 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 1.05 0.00 0.00 0.63 0.00 0.00 111 D 8.16 4.33 0.00 2.79 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 0.00 112 A 8.06 3.92 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 0.00 113 S 8.17 3.95 0.00 3.52 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 0.00 114 R 7.81 3.82 0.00 1.87 2.06 0.00 3.20 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 115 N 7.46 5.07 0.00 2.69 2.74 0.00 0.00 6.83 7.54 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 0.00 116 A 7.39 4.45 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 0.00 117 R 8.16 4.16 0.00 1.75 1.74 0.00 3.23 0.00 0.00 3.21 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 118 Q 9.05 4.18 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.42 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00