NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9293 8.3544 109.7364 46.4684 0.0000 172.1418 2 S 4.4209 8.1594 111.2565 57.5959 64.9489 172.7979 3 S 4.6870 8.3841 118.2503 57.7208 67.4325 173.8571 4 G 4.1667 8.1290 110.9716 44.8489 0.0000 173.3043 5 S 4.3634 8.0750 114.4518 57.8730 64.5943 174.6918 6 S 4.5098 9.2363 119.6084 55.0388 65.3029 173.1453 7 G 4.2313 8.0748 121.1331 45.1056 0.0000 171.4025 8 M 4.4031 7.7191 122.8748 54.8773 35.1807 173.7383 9 S 4.4497 8.1760 116.3194 58.0883 65.4309 175.7130 10 S 4.6978 8.5458 124.2009 56.0454 62.8401 171.7990 11 H 4.6748 7.7726 119.9946 54.3899 33.0635 173.1763 12 V 3.7664 8.0980 126.7958 61.8573 32.3321 174.2569 13 P 4.5302 0.0000 0.0000 62.5469 32.6393 176.1070 14 A 4.6979 8.3526 119.2717 52.3563 19.2606 176.5948 15 D 3.9684 7.7060 115.6217 54.4794 42.9402 175.9876 16 M 4.7364 7.7754 116.9616 53.5523 35.9317 174.7800 17 I 4.6861 8.4740 121.1232 59.5153 40.2662 174.6578 18 N 5.6164 8.5904 126.8159 52.8699 40.0281 173.6680 19 L 5.1487 8.6995 125.3073 52.9519 45.9444 175.3804 20 R 4.9673 9.0261 123.9533 54.8772 31.8213 174.8437 21 L 4.8963 8.8708 127.8253 54.1412 42.5280 176.3310 22 I 5.0210 8.2921 124.5975 58.8176 40.6201 175.2246 23 L 5.4121 7.7306 125.8364 53.5852 44.3827 176.1694 24 V 3.6644 8.1430 110.4791 62.8742 31.9168 174.6957 25 S 4.3427 9.5904 123.0483 57.3046 63.0392 170.2639 26 G 3.7247 7.2826 111.8355 43.3826 0.0000 173.4113 27 K 3.6029 8.7333 133.4399 56.4209 30.0682 173.5473 28 T 5.5011 7.9120 115.9846 60.1943 71.2301 172.4411 29 K 4.6182 8.4056 123.9097 54.9333 35.8987 174.4701 30 E 4.6442 8.5336 125.8714 56.3385 30.6184 175.7222 31 F 4.8669 9.2355 121.8866 55.6564 43.7610 173.4135 32 L 5.0877 7.6513 117.5159 53.5754 45.2773 176.3223 33 F 5.0472 8.6683 118.8955 56.6019 44.2688 173.4071 34 S 5.1740 9.1491 115.7344 56.2373 64.5257 173.1293 35 P 4.6526 0.0000 0.0000 64.2843 31.4946 177.1444 36 N 4.7068 8.5440 116.0134 53.5811 39.4484 174.8936 37 D 4.6644 7.8006 119.3466 53.6511 42.1050 175.8923 38 S 4.8362 8.1456 117.5587 56.4152 65.5873 174.9166 39 A 3.8147 8.2421 123.9251 55.8010 17.5451 179.9408 40 S 4.1456 8.0177 110.7719 61.7669 62.3675 175.6860 41 D 4.5443 8.0096 121.2029 58.3696 40.6598 178.6863 42 I 3.3051 7.5967 119.4376 63.0567 36.9002 177.6845 43 A 3.9496 8.9441 122.2020 55.6256 18.3549 179.8598 44 K 3.8006 9.0110 117.4912 59.8187 32.1988 178.6098 45 H 4.0009 8.8082 119.3736 59.5570 29.4703 176.7573 46 V 3.0827 7.6288 119.7908 65.2583 31.6593 176.8057 47 Y 4.1457 7.9619 118.7491 61.0174 38.3781 177.7691 48 D 4.5876 8.5973 118.6187 56.7154 41.2677 177.2466 49 N 4.3674 7.7026 116.1518 53.1089 39.2152 172.1917 50 W 3.9164 8.5397 124.5502 55.5153 28.8508 173.2733 51 P 4.3437 0.0000 0.0000 63.9929 31.2460 176.4185 52 M 4.4491 7.1805 116.1982 54.6087 34.6955 174.2887 53 D 4.7036 7.8571 128.9485 52.1382 41.6485 176.0015 54 W 4.3710 8.2131 110.2004 55.9651 30.3690 173.7142 55 E 4.1204 9.5367 124.5238 59.3552 29.1215 177.7652 56 E 4.0769 8.1267 115.4343 56.8931 30.1093 176.6593 57 E 4.9308 7.6520 115.4363 54.9700 31.4295 174.9467 58 Q 4.9082 7.5230 125.9311 55.5053 31.1979 171.6966 59 V 4.4958 7.1455 110.3874 60.7946 36.2737 176.5842 60 S 4.5609 7.9915 109.6543 58.1232 64.7958 175.2707 61 S 4.5818 7.2365 118.2019 56.6067 66.7833 174.4073 62 P 4.2915 0.0000 0.0000 65.1701 31.5454 177.5504 63 N 4.4169 7.9759 116.7107 56.2429 39.0940 175.7978 64 I 3.8279 7.9002 111.2411 64.0263 38.3473 174.5381 65 L 4.7112 7.5759 127.3847 53.1693 40.5732 174.7330 66 R 4.6921 8.3186 125.3060 54.1219 32.9306 173.9283 67 L 4.8514 8.4662 126.8943 53.7240 44.3290 174.7745 68 I 4.6857 8.9967 127.0598 59.9448 39.9447 174.1224 69 Y 5.0296 9.1268 127.6570 56.7401 41.7920 175.2067 70 Q 3.2785 9.6583 123.5185 56.8618 27.1751 173.2942 71 G 4.0078 8.2805 108.0613 46.1632 0.0000 174.9930 72 R 4.3841 7.7853 118.4827 55.4749 31.2989 174.5871 73 F 5.3156 8.6918 116.8203 55.9869 41.2388 175.5972 74 L 4.6721 8.9428 123.7042 53.8256 42.6952 176.3231 75 H 4.3615 8.8350 121.9656 56.0196 30.8297 176.3857 76 G 3.6820 8.5377 110.8589 47.8460 0.0000 174.4668 77 N 4.5086 8.1016 116.7912 54.7656 39.7495 175.4071 78 V 3.8227 7.2037 117.3222 63.3674 32.4102 174.7120 79 T 5.1057 7.9365 113.1617 57.7425 72.0379 174.6447 80 L 4.0910 8.8522 124.4683 58.2262 41.5341 180.1533 81 G 3.6588 8.4341 105.4555 47.8731 0.0000 175.6843 82 A 4.0994 8.2433 122.1991 53.9969 18.4556 178.7066 83 L 4.1880 7.6440 115.3530 54.7590 42.4569 177.0962 84 K 3.8899 7.9393 118.2530 57.5650 32.1514 175.0583 85 L 4.1678 7.5235 119.6164 54.7685 42.5770 175.5843 86 P 4.1604 0.0000 0.0000 62.3497 32.0064 176.4945 87 F 4.6986 8.2988 120.8808 57.3280 39.9102 174.5946 88 G 4.5098 8.3308 108.4512 46.6548 0.0000 172.1469 89 K 4.7998 7.6084 115.6967 54.9674 37.8211 176.1318 90 T 4.9729 8.4335 116.4429 62.4938 71.1911 174.0969 91 T 4.6845 8.8333 123.0221 61.8299 70.2837 173.5248 92 V 4.6844 8.2957 123.9521 61.6676 33.6979 174.3584 93 M 5.2757 8.8657 125.6963 54.3240 36.9456 173.7105 94 H 5.0266 9.3229 118.6105 54.1063 32.1284 173.2477 95 L 5.2375 8.1160 121.0034 53.8890 44.3558 175.7174 96 V 4.7337 8.1848 115.4061 60.4549 37.1040 173.1250 97 A 4.9662 8.2853 122.8630 51.1662 21.1622 175.7020 98 R 4.3080 8.7613 118.6230 56.5359 34.1130 175.1102 99 E 4.1371 9.4787 128.0311 58.0909 30.0684 175.3929 100 T 4.7888 6.9655 106.3498 59.9115 71.4870 173.4795 101 L 4.1930 8.2002 120.5223 54.4131 42.2176 175.6637 102 P 4.4306 0.0000 0.0000 65.3058 31.7981 176.2465 103 E 4.8282 7.7234 117.9038 52.7291 33.0599 175.2182 104 P 4.5802 0.0000 0.0000 60.8466 29.4049 174.5470 105 N 4.3535 7.5175 114.8932 53.6073 42.4523 174.1336 106 S 4.7882 8.4954 118.0923 55.8888 64.9212 173.4297 107 Q 4.0554 8.5736 126.8406 56.7946 29.8172 175.5408 108 G 3.8547 7.8962 110.3445 45.7277 0.0000 172.8913 109 Q 4.2817 7.6941 118.8107 55.3253 31.4230 173.5195 110 R 4.6037 8.4762 122.5375 54.4475 31.4446 175.7579 111 S 4.7201 8.4536 114.4860 56.4796 65.4246 174.1579 112 G 3.9637 8.2677 110.6933 42.8808 0.0000 170.8961 113 P 4.4061 0.0000 0.0000 61.7818 32.1941 177.9433 114 S 4.3630 8.4948 116.3909 57.3672 60.0445 172.8800 115 S 4.6289 7.4546 117.7224 57.5830 64.9036 177.8078 116 G 3.7081 8.5178 109.1823 45.9232 0.0000 172.5120 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 G 8.35 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 0.00 0.00 0.00 2 S 8.16 4.42 0.00 3.87 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 3 S 8.38 4.69 0.00 3.85 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 4 G 8.13 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 0.00 0.00 0.00 0.00 5 S 8.08 4.36 0.00 3.82 3.78 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 0.00 0.00 0.00 0.00 6 S 9.24 4.51 0.00 3.90 3.78 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 0.00 0.00 0.00 0.00 7 G 8.07 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 M 7.72 4.40 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 9 S 8.18 4.45 0.00 3.80 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 10 S 8.55 4.70 0.00 3.85 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 H 7.77 4.67 0.00 3.06 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 12 V 8.10 3.77 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 0.88 0.00 0.00 0.97 0.00 0.00 13 P 0.00 4.53 0.00 2.20 2.18 0.00 3.71 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 2.02 1.93 0.00 14 A 8.35 4.70 1.32 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 0.00 0.00 0.00 15 D 7.71 3.97 0.00 2.49 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.78 4.74 0.00 1.97 1.90 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 2.53 2.48 0.00 17 I 8.47 4.69 2.04 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.49 0.99 0.00 0.00 18 N 8.59 5.62 0.00 2.92 2.77 0.00 0.00 6.83 6.40 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 19 L 8.70 5.15 0.00 2.08 1.81 0.84 0.96 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 20 R 9.03 4.97 0.00 1.92 1.99 0.00 3.13 0.00 0.00 3.20 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 21 L 8.87 4.90 0.00 2.19 1.94 0.99 1.22 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 22 I 8.29 5.02 1.60 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.85 0.91 0.00 0.00 23 L 7.73 5.41 0.00 1.44 1.43 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 24 V 8.14 3.66 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 0.76 0.00 0.00 0.90 0.00 0.00 25 S 9.59 4.34 0.00 3.99 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 26 G 7.28 3.72 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 0.00 27 K 8.73 3.60 0.00 1.83 1.63 0.00 1.48 0.00 0.00 1.52 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.30 7.81 28 T 7.91 5.50 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 1.21 0.00 0.00 29 K 8.41 4.62 0.00 1.89 1.47 0.00 1.58 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.18 1.31 7.81 30 E 8.53 4.64 0.00 1.78 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 2.30 2.30 0.00 31 F 9.24 4.87 0.00 2.93 2.19 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 32 L 7.65 5.09 0.00 1.28 1.37 0.85 0.68 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 33 F 8.67 5.05 0.00 2.96 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.15 5.17 0.00 3.95 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 35 P 0.00 4.65 0.00 2.39 2.50 0.00 3.80 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 36 N 8.54 4.71 0.00 2.70 2.91 0.00 0.00 6.99 7.98 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 37 D 7.80 4.66 0.00 2.95 2.54 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 38 S 8.15 4.84 0.00 3.82 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 39 A 8.24 3.81 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 40 S 8.02 4.15 0.00 3.84 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 41 D 8.01 4.54 0.00 2.94 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 42 I 7.60 3.31 1.58 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.06 0.22 0.00 0.00 43 A 8.94 3.95 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 44 K 9.01 3.80 0.00 1.84 1.82 0.00 1.60 0.00 0.00 1.43 0.00 0.00 2.72 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.50 7.81 45 H 8.81 4.00 0.00 3.32 3.64 0.00 5.80 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 46 V 7.63 3.08 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 0.91 0.00 0.00 0.72 0.00 0.00 47 Y 7.96 4.15 0.00 3.16 2.94 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 0.00 0.00 0.00 48 D 8.60 4.59 0.00 2.84 2.68 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 49 N 7.70 4.37 0.00 1.64 2.39 0.00 0.00 6.87 7.14 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 50 W 8.54 3.92 0.00 3.57 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 51 P 0.00 4.34 0.00 2.24 2.23 0.00 3.94 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 52 M 7.18 4.45 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 53 D 7.86 4.70 0.00 2.16 1.58 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 54 W 8.21 4.37 0.00 3.28 3.14 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 55 E 9.54 4.12 0.00 2.05 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 0.00 2.37 2.39 0.00 56 E 8.13 4.08 0.00 2.08 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 2.32 2.27 0.00 57 E 7.65 4.93 0.00 1.92 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 2.19 2.16 0.00 58 Q 7.52 4.91 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 59 V 7.15 4.50 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 0.73 0.00 0.00 0.87 0.00 0.00 60 S 7.99 4.56 0.00 3.70 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 61 S 7.24 4.58 0.00 3.78 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 62 P 0.00 4.29 0.00 2.13 2.13 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 63 N 7.98 4.42 0.00 2.70 2.87 0.00 0.00 6.88 7.42 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 64 I 7.90 3.83 1.86 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 1.25 1.14 0.90 0.00 0.00 65 L 7.58 4.71 0.00 1.61 1.77 1.04 0.96 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 66 R 8.32 4.69 0.00 2.42 1.99 0.00 3.33 0.00 0.00 3.11 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.80 0.00 67 L 8.47 4.85 0.00 1.81 1.51 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 68 I 9.00 4.69 1.81 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 -0.12 -0.36 0.57 0.00 0.00 69 Y 9.13 5.03 0.00 2.78 2.68 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 70 Q 9.66 3.28 0.00 1.67 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 5.55 0.00 0.00 0.00 0.00 0.00 2.23 1.74 0.00 71 G 8.28 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 72 R 7.79 4.38 0.00 1.98 1.95 0.00 3.00 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 73 F 8.69 5.32 0.00 2.82 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 74 L 8.94 4.67 0.00 1.55 1.65 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.84 4.36 0.00 3.23 3.18 0.00 5.67 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 76 G 8.54 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 0.00 0.00 0.00 77 N 8.10 4.51 0.00 2.77 2.87 0.00 0.00 6.93 7.72 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 78 V 7.20 3.82 2.36 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 0.94 0.00 0.00 1.00 0.00 0.00 79 T 7.94 5.11 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 1.24 0.00 0.00 80 L 8.85 4.09 0.00 1.92 1.86 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.43 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 82 A 8.24 4.10 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 83 L 7.64 4.19 0.00 1.85 1.77 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.94 3.89 0.00 1.86 2.02 0.00 1.48 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.44 7.81 85 L 7.52 4.17 0.00 1.61 1.60 1.10 0.98 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 86 P 0.00 4.16 0.00 2.16 2.00 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 87 F 8.30 4.70 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 88 G 8.33 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.61 4.80 0.00 1.88 1.71 0.00 1.65 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.49 7.81 90 T 8.43 4.97 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 1.30 0.00 0.00 91 T 8.83 4.68 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 0.80 0.00 0.00 92 V 8.30 4.68 2.19 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 1.07 0.00 0.00 0.99 0.00 0.00 93 M 8.87 5.28 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.66 0.00 94 H 9.32 5.03 0.00 3.02 3.21 0.00 5.75 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.12 5.24 0.00 1.78 1.69 1.11 1.10 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 96 V 8.18 4.73 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 0.74 0.00 0.00 1.11 0.00 0.00 97 A 8.29 4.97 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 98 R 8.76 4.31 0.00 1.93 1.97 0.00 3.19 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 99 E 9.48 4.14 0.00 1.96 1.95 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 2.27 2.28 0.00 100 T 6.97 4.79 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 101 L 8.20 4.19 0.00 1.65 1.62 0.89 0.88 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 0.00 102 P 0.00 4.43 0.00 2.26 2.28 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 103 E 7.72 4.83 0.00 1.97 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 2.22 2.28 0.00 104 P 0.00 4.58 0.00 2.18 2.10 0.00 3.82 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 105 N 7.52 4.35 0.00 2.67 2.75 0.00 0.00 7.01 7.58 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 0.00 106 S 8.50 4.79 0.00 3.79 3.71 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 0.00 107 Q 8.57 4.06 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.49 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 108 G 7.90 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 Q 7.69 4.28 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 110 R 8.48 4.60 0.00 1.93 1.90 0.00 3.10 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 111 S 8.45 4.72 0.00 3.97 3.87 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 0.00 112 G 8.27 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 0.00 0.00 0.00 113 P 0.00 4.41 0.00 2.19 2.06 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 114 S 8.49 4.36 0.00 3.85 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 0.00 115 S 7.45 4.63 0.00 3.96 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 0.00 116 G 8.52 3.71 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 0.00 0.00 0.00