NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.4735 8.2185 120.1979 53.7877 41.2276 175.5679 3 A 3.9934 8.4379 124.4304 51.7543 18.5426 176.9471 4 R 4.3137 10.1120 121.0790 58.3797 32.0132 175.1490 5 Q 4.7252 12.0000 116.3074 56.2940 29.6126 175.1571 6 F 4.9605 8.6523 115.3142 56.4541 41.9011 172.5035 7 L 5.2241 8.6671 118.6257 52.5023 44.6205 175.8711 8 I 4.6464 8.3138 123.3870 60.4768 38.5388 173.8008 9 Y 5.3795 9.3262 129.3473 55.7745 41.7813 173.8151 10 N 4.2403 8.1296 124.8770 51.4352 40.2567 174.6226 11 E 3.5437 8.4889 127.7992 59.2739 30.0691 177.3692 12 D 4.4764 8.0232 116.3526 57.5706 41.2732 176.7947 13 H 4.3845 8.4184 113.9162 55.7555 29.4003 175.1707 14 K 3.9542 7.6250 117.8056 57.5800 29.9361 174.7345 15 R 4.8706 7.2704 114.9821 54.8101 35.3128 176.0361 16 C 5.6930 8.8609 117.6460 54.8428 43.5698 173.9216 17 V 4.1013 8.5377 121.7296 63.2520 32.5823 174.5284 18 D 4.9760 9.3443 126.4404 52.4149 44.2619 173.9856 19 A 4.5066 8.9460 129.2165 51.7731 18.4610 176.7878 20 L 4.4425 8.6293 123.6613 56.1461 43.3782 176.4796 21 S 3.8460 6.9509 110.4149 57.0804 65.1865 176.0931 22 A 3.6041 7.9306 122.9473 54.4323 18.0015 178.9362 23 I 4.2637 7.0960 106.9897 60.3101 37.9474 175.4231 24 S 4.5008 7.9015 116.9194 57.5222 65.5786 173.0504 25 V 4.6291 9.0989 127.7332 61.3174 33.9372 172.8736 26 Q 5.1495 9.3052 131.7555 54.8156 32.5276 174.7146 27 T 5.0360 8.1255 114.4365 61.4886 72.5408 172.8724 28 A 4.5238 8.6497 122.5117 50.9699 23.4137 175.7844 29 T 4.1382 8.4185 116.1609 63.7880 69.0392 175.6988 30 C 4.3068 8.7383 123.8745 57.1730 40.7732 173.0784 31 N 4.7966 9.3647 123.3450 51.3727 40.0787 172.9407 32 P 4.5131 0.0000 0.0000 64.4414 31.5281 176.7872 33 E 4.2148 8.4889 117.7699 56.4923 30.2613 175.8006 34 A 4.2865 7.7868 123.7526 50.8753 18.7900 177.7991 35 E 3.8383 8.8858 123.6337 60.0803 29.8887 180.0424 36 S 4.0907 7.9637 112.3693 60.5119 63.4261 175.2029 37 Q 4.6810 7.9188 118.6257 55.0279 29.3002 174.8281 38 K 4.4624 7.4619 119.4289 55.5013 33.6838 175.9982 39 F 5.1468 8.5757 122.4675 55.9199 44.0792 173.6797 40 R 4.9806 8.3619 114.4527 55.0284 32.7730 174.7783 41 W 4.7289 9.2952 122.1936 57.1680 29.7049 176.5064 42 V 4.6532 8.5173 114.5922 60.7204 31.9457 175.1518 43 S 4.7641 7.7876 113.9090 58.2823 64.9663 176.1795 44 D 4.3254 9.0405 119.4957 56.7115 40.6947 177.1019 45 S 5.3530 8.2840 110.9357 57.6765 65.4801 173.4261 46 Q 5.2599 8.9144 120.5611 54.3838 31.8398 174.4410 47 I 4.5509 8.3429 123.0345 59.6574 40.1943 173.9552 48 M 5.0070 9.1364 127.5001 53.7584 34.7733 174.7478 49 S 4.0790 9.1377 121.2626 58.0121 63.1233 174.9601 50 V 3.4743 8.1265 128.0216 66.0961 31.2254 177.2639 51 A 3.8332 7.8617 122.0247 54.3665 18.2878 177.8589 52 F 4.5090 7.8172 111.2710 56.3892 40.3251 175.7356 53 K 3.9769 8.1334 119.1081 57.5336 30.1312 174.9014 54 L 5.0229 7.6113 115.5155 53.2777 46.5881 176.9592 55 C 5.3367 9.4010 119.1455 55.5520 42.4607 173.3163 56 L 4.8515 8.8361 123.6946 55.3839 42.0344 176.7238 57 G 4.3418 9.4013 109.8579 45.9921 0.0000 171.8196 58 V 5.3088 8.3057 112.5864 58.7542 35.0292 175.1092 59 P 4.1797 0.0000 0.0000 65.4163 31.6651 176.4333 60 S 4.7172 7.3117 109.9626 57.6841 65.1283 176.1054 61 K 4.3391 8.6113 122.5400 55.5244 30.6091 176.3606 62 T 4.7264 7.3459 117.2764 60.9067 73.0068 173.3594 63 D 4.6225 8.5288 123.7383 55.5885 41.7193 176.4723 64 W 3.9593 9.5449 134.8525 58.0067 30.0093 173.5246 65 A 4.3218 7.7954 118.4598 51.4657 18.9908 178.0018 66 S 4.4587 8.5377 117.8294 58.3472 64.0322 174.0422 67 V 4.4906 8.2343 124.9172 62.0054 31.7849 174.3697 68 T 4.6411 8.9593 123.2779 60.9569 72.2108 172.2794 69 L 5.3506 8.2927 120.6210 53.4413 44.3864 175.8780 70 Y 4.8620 9.3887 119.8090 55.5150 42.6368 174.7069 71 A 4.3537 8.8511 123.1181 52.4449 19.0599 178.4125 72 C 4.3337 8.9524 120.3862 57.1967 36.8661 173.0149 73 D 4.7009 8.7097 123.4622 52.3362 42.7581 175.8468 74 S 4.3391 8.8686 122.0884 60.4359 63.1563 175.1604 75 K 4.2264 8.3065 119.4629 56.9276 32.8450 176.4630 76 S 4.4823 7.9596 115.5274 57.4587 62.6999 174.2869 77 E 4.0732 8.5375 126.4172 57.8220 29.7223 176.7470 78 Y 4.1975 7.6634 116.5078 58.4627 38.0496 175.8768 79 Q 4.9174 7.5062 116.2632 55.7272 30.2298 174.6854 80 K 4.8287 7.7105 119.0745 55.3620 34.1986 175.5004 81 W 5.3431 9.5377 124.5914 55.0151 32.7946 174.4593 82 E 4.9511 8.7436 117.9465 55.4635 32.9485 173.2551 83 C 4.9657 8.9025 118.8703 56.2488 41.2562 173.9224 84 K 4.4333 9.1233 128.0969 56.0055 33.1450 176.0842 85 N 4.7343 8.6944 118.6717 53.6695 38.8883 174.1061 86 D 4.3872 9.5189 116.1388 55.8575 38.6846 174.6474 87 T 3.5145 8.1313 104.0793 62.0552 67.8877 170.7490 88 L 4.6384 8.0694 125.4410 55.5679 43.2887 175.4585 89 F 5.4167 9.2055 127.9745 56.8601 43.0007 174.0321 90 G 4.4462 7.9598 110.6089 45.6589 0.0000 172.1449 91 I 3.7709 8.0275 120.9352 60.5200 38.0707 176.5300 92 K 4.0004 7.5743 127.8158 57.3181 32.3315 177.1205 93 G 3.8755 9.4372 113.8451 45.7560 0.0000 172.3048 94 T 4.6586 7.3197 108.2540 59.9819 71.9167 173.1450 95 E 4.3422 8.3232 118.6966 56.3583 30.2944 176.0145 96 L 4.6614 7.3397 118.3196 53.1367 44.5773 175.6916 97 Y 5.4762 8.9029 121.5697 55.7939 41.6900 174.9715 98 F 4.6945 9.7375 125.3346 58.9233 40.4565 173.5870 99 N 6.0927 9.5355 124.7637 52.5749 42.9423 172.3021 100 Y 4.9536 9.1646 124.3649 56.8997 41.6540 173.6834 101 G 2.0870 7.8529 115.5754 45.1147 0.0000 173.9789 102 N 4.7752 8.1286 118.0361 53.8686 39.4501 174.9061 103 R 3.6581 9.2908 117.9928 57.5083 27.8949 176.2142 104 Q 3.3867 8.2710 111.4412 56.6199 26.5297 173.2155 105 E 4.2814 8.0699 118.8832 55.5352 29.8671 176.8340 106 K 4.2524 8.6854 126.2793 59.0855 32.6545 176.9943 107 N 4.6492 8.1487 116.4202 52.6985 39.7642 174.5635 108 I 3.8931 8.0900 125.1237 61.6093 38.3647 175.2663 109 K 4.8646 8.8847 124.3183 54.4588 36.7896 175.0453 110 L 5.1567 8.5558 121.8668 54.3479 43.3808 175.5100 111 Y 6.1223 9.4651 123.6379 55.1174 42.1820 176.1794 112 K 4.3397 8.5280 124.2345 59.0107 33.3253 177.8830 113 G 3.8194 6.4103 108.7837 45.5654 0.0000 173.3512 114 S 4.4811 8.4810 117.0992 57.5592 63.8867 174.9362 115 G 3.9099 7.8393 111.9923 45.7418 0.0000 174.6518 116 L 3.9793 8.3208 118.2490 57.1692 41.6960 178.1056 117 W 4.7313 8.1013 116.9549 57.5166 29.7649 177.2155 118 S 5.8619 8.5060 113.9708 57.5504 62.9736 173.3061 119 R 5.2922 7.7433 119.7542 54.2546 31.9219 175.3576 120 W 5.3579 9.1351 121.5193 55.0089 33.2077 174.5486 121 K 4.9575 9.2443 121.8298 54.2463 36.5029 175.4631 122 V 4.2455 8.4310 122.1872 62.5188 32.3716 174.9929 123 Y 4.3150 8.8535 129.8341 59.7748 38.9015 176.4915 124 G 3.6114 9.1493 114.9545 45.2474 0.0000 172.0698 125 T 4.6554 7.4740 108.5088 60.6244 71.9682 173.6265 126 T 4.5717 8.4087 108.2998 61.5038 69.2034 173.5310 127 D 4.8792 7.8945 122.0216 52.9493 43.1335 175.9802 128 D 5.0433 8.2065 120.9001 52.6017 40.8777 177.2985 129 L 3.8713 8.3664 118.5290 57.8464 41.4140 179.8908 130 C 4.1876 8.1914 115.3562 58.3170 39.9230 175.4141 131 S 3.9695 7.8369 115.3003 60.0101 62.7567 175.3722 132 R 4.4363 7.3162 119.7036 57.0824 30.7871 176.0608 133 G 3.1636 7.3175 109.1148 44.2727 0.0000 172.7591 134 Y 4.5080 7.8613 114.6656 57.7971 39.3670 175.4734 135 E 4.1914 7.7536 124.9055 56.0481 29.8563 175.1368 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 D 8.22 4.47 0.00 2.73 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 3 A 8.44 3.99 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 4 R 10.11 4.31 0.00 2.21 2.05 0.00 3.38 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 5 Q 12.00 4.73 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.42 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 6 F 8.65 4.96 0.00 3.18 3.15 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 7 L 8.67 5.22 0.00 1.86 1.65 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.31 4.65 1.58 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.39 0.49 0.00 0.00 9 Y 9.33 5.38 0.00 3.18 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 10 N 8.13 4.24 0.00 1.44 2.04 0.00 0.00 6.65 7.22 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 11 E 8.49 3.54 0.00 1.94 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 2.33 2.46 0.00 12 D 8.02 4.48 0.00 2.70 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.42 4.38 0.00 3.12 3.33 0.00 6.06 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.63 3.95 0.00 1.98 2.04 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.55 7.81 15 R 7.27 4.87 0.00 1.62 1.66 0.00 3.11 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.87 0.00 16 C 8.86 5.69 0.00 2.85 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.54 4.10 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 0.70 0.00 0.00 0.62 0.00 0.00 18 D 9.34 4.98 0.00 2.71 2.42 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 0.00 0.00 0.00 0.00 19 A 8.95 4.51 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.63 4.44 0.00 1.67 1.70 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 21 S 6.95 3.85 0.00 3.79 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 22 A 7.93 3.60 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 23 I 7.10 4.26 1.76 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 1.07 0.63 0.77 0.00 0.00 24 S 7.90 4.50 0.00 3.79 3.59 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 25 V 9.10 4.63 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 0.86 0.00 0.00 0.87 0.00 0.00 26 Q 9.31 5.15 0.00 1.91 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.42 0.00 0.00 0.00 0.00 0.00 2.28 2.03 0.00 27 T 8.13 5.04 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 0.38 0.00 0.00 28 A 8.65 4.52 1.21 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 0.00 0.00 29 T 8.42 4.14 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 1.23 0.00 0.00 30 C 8.74 4.31 0.00 2.63 2.16 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 31 N 9.36 4.80 0.00 2.62 2.61 0.00 0.00 6.60 8.48 0.00 0.00 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 P 0.00 4.51 0.00 2.28 2.32 0.00 3.86 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 2.03 2.08 0.00 33 E 8.49 4.21 0.00 2.12 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 2.28 2.25 0.00 34 A 7.79 4.29 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 35 E 8.89 3.84 0.00 1.87 1.86 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 2.32 2.16 0.00 36 S 7.96 4.09 0.00 4.29 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 37 Q 7.92 4.68 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.24 0.00 38 K 7.46 4.46 0.00 1.61 1.53 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.52 7.81 39 F 8.58 5.15 0.00 2.02 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.36 4.98 0.00 1.99 2.00 0.00 2.75 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 41 W 9.30 4.73 0.00 3.19 3.43 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 42 V 8.52 4.65 2.24 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 0.91 0.00 0.00 1.10 0.00 0.00 43 S 7.79 4.76 0.00 4.07 4.11 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 0.00 0.00 0.00 0.00 44 D 9.04 4.33 0.00 2.77 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 45 S 8.28 5.35 0.00 3.88 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 46 Q 8.91 5.26 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.79 0.00 0.00 0.00 0.00 0.00 2.58 2.49 0.00 47 I 8.34 4.55 1.35 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.50 0.00 0.00 48 M 9.14 5.01 0.00 2.08 1.97 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 2.65 2.48 0.00 49 S 9.14 4.08 0.00 3.95 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.13 3.47 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.76 0.00 0.00 51 A 7.86 3.83 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 52 F 7.82 4.51 0.00 3.00 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 53 K 8.13 3.98 0.00 1.92 1.90 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.52 7.81 54 L 7.61 5.02 0.00 1.60 1.67 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 55 C 9.40 5.34 0.00 3.09 3.16 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 56 L 8.84 4.85 0.00 1.54 1.75 0.22 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 57 G 9.40 4.34 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 0.00 58 V 8.31 5.31 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 0.84 0.00 0.00 1.00 0.00 0.00 59 P 0.00 4.18 0.00 2.15 2.23 0.00 3.84 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 1.99 1.98 0.00 60 S 7.31 4.72 0.00 4.00 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 61 K 8.61 4.34 0.00 1.73 1.73 0.00 1.49 0.00 0.00 1.50 0.00 0.00 2.48 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.23 1.30 7.81 62 T 7.35 4.73 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 1.28 0.00 0.00 63 D 8.53 4.62 0.00 2.81 2.65 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 0.00 0.00 0.00 0.00 64 W 9.54 3.96 0.00 3.56 3.28 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 65 A 7.80 4.32 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 66 S 8.54 4.46 0.00 3.71 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.23 4.49 1.84 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 1.00 0.00 0.00 1.00 0.00 0.00 68 T 8.96 4.64 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 1.15 0.00 0.00 69 L 8.29 5.35 0.00 1.40 1.53 0.63 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 70 Y 9.39 4.86 0.00 2.89 2.85 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 71 A 8.85 4.35 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 72 C 8.95 4.33 0.00 3.05 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 73 D 8.71 4.70 0.00 2.69 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 74 S 8.87 4.34 0.00 4.06 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 75 K 8.31 4.23 0.00 1.89 1.91 0.00 1.61 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.42 7.81 76 S 7.96 4.48 0.00 3.94 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 77 E 8.54 4.07 0.00 1.47 1.60 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 2.16 2.18 0.00 78 Y 7.66 4.20 0.00 2.87 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 79 Q 7.51 4.92 0.00 2.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 80 K 7.71 4.83 0.00 1.52 1.69 0.00 1.51 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.57 7.81 81 W 9.54 5.34 0.00 3.23 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.74 4.95 0.00 2.07 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 0.00 2.24 2.31 0.00 83 C 8.90 4.97 0.00 3.02 3.25 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 84 K 9.12 4.43 0.00 1.94 1.86 0.00 1.90 0.00 0.00 2.01 0.00 0.00 3.21 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.66 1.96 7.81 85 N 8.69 4.73 0.00 2.90 2.97 0.00 0.00 6.15 8.07 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 86 D 9.52 4.39 0.00 2.81 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 87 T 8.13 3.51 4.57 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 1.27 0.00 0.00 88 L 8.07 4.64 0.00 1.95 1.70 0.66 0.56 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 89 F 9.21 5.42 0.00 3.36 3.09 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 90 G 7.96 4.45 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 0.00 91 I 8.03 3.77 1.60 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.07 0.54 0.00 0.00 92 K 7.57 4.00 0.00 1.64 1.57 0.00 1.69 0.00 0.00 1.50 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.47 7.81 93 G 9.44 3.88 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 0.00 0.00 0.00 94 T 7.32 4.66 4.10 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 0.00 0.00 0.00 1.07 0.00 0.00 95 E 8.32 4.34 0.00 1.87 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 2.21 2.25 0.00 96 L 7.34 4.66 0.00 1.43 1.52 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.90 5.48 0.00 3.25 3.35 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 98 F 9.74 4.69 0.00 3.35 3.10 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 0.00 0.00 0.00 0.00 99 N 9.54 6.09 0.00 3.29 3.05 0.00 0.00 6.16 7.50 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 0.00 100 Y 9.16 4.95 0.00 3.04 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 0.00 101 G 7.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.13 4.78 0.00 2.92 2.65 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 0.00 103 R 9.29 3.66 0.00 2.12 2.04 0.00 3.46 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.30 0.00 104 Q 8.27 3.39 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 105 E 8.07 4.28 0.00 2.18 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 1.86 2.33 0.00 106 K 8.69 4.25 0.00 1.86 1.97 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.56 1.44 7.81 107 N 8.15 4.65 0.00 2.62 2.56 0.00 0.00 7.25 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 0.00 108 I 8.09 3.89 1.40 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.22 -0.48 0.00 0.00 109 K 8.88 4.86 0.00 1.19 1.18 0.00 0.61 0.00 0.00 1.16 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 0.21 7.81 110 L 8.56 5.16 0.00 1.71 1.69 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 111 Y 9.47 6.12 0.00 3.34 3.09 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 0.00 112 K 8.53 4.34 0.00 1.80 1.82 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.85 1.00 7.81 113 G 6.41 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 0.00 114 S 8.48 4.48 0.00 3.63 3.57 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 0.00 115 G 7.84 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 0.00 116 L 8.32 3.98 0.00 1.54 1.77 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 117 W 8.10 4.73 0.00 3.47 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 S 8.51 5.86 0.00 4.10 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 0.00 119 R 7.74 5.29 0.00 1.72 1.84 0.00 3.14 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 120 W 9.14 5.36 0.00 2.95 3.02 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 0.00 121 K 9.24 4.96 0.00 1.89 1.88 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.42 1.43 7.81 122 V 8.43 4.25 2.05 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 0.92 0.00 0.00 0.68 0.00 0.00 123 Y 8.85 4.31 0.00 3.03 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 0.00 124 G 9.15 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 0.00 125 T 7.47 4.66 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 1.17 0.00 0.00 126 T 8.41 4.57 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 1.22 0.00 0.00 127 D 7.89 4.88 0.00 2.70 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 0.00 128 D 8.21 5.04 0.00 3.02 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 0.00 129 L 8.37 3.87 0.00 1.55 1.65 -0.55 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 130 C 8.19 4.19 0.00 3.08 2.91 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 0.00 131 S 7.84 3.97 0.00 3.99 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 0.00 132 R 7.32 4.44 0.00 1.36 1.80 0.00 3.61 0.00 0.00 3.15 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.12 0.00 133 G 7.32 3.16 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 0.00 0.00 0.00 134 Y 7.86 4.51 0.00 3.10 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 E 7.75 4.19 0.00 1.85 1.61 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 2.16 2.18 0.00