NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1978 8.1727 122.0529 56.2908 34.1225 173.9288 2 V 4.6187 8.1599 126.9648 60.7070 32.4544 174.5874 3 F 4.3277 9.9831 129.0443 57.5486 40.1918 174.9154 4 E 4.2755 9.0306 121.4294 55.7860 30.8671 177.2843 5 R 3.3804 8.9437 122.3142 60.4397 30.0226 179.6902 6 C 4.3715 8.0549 115.2347 59.5353 40.2304 175.6426 7 E 3.9001 8.0979 120.8960 59.1353 29.2815 178.4525 8 L 3.6684 8.0474 120.1159 57.9554 42.0989 178.6562 9 A 3.9606 7.8134 120.7173 55.4008 18.3130 179.8953 10 R 3.9054 8.1352 116.4788 59.4831 30.0855 179.4726 11 T 3.8503 7.9575 115.5613 66.7552 68.5424 176.7487 12 L 3.8624 8.1717 121.2266 57.3516 41.5451 179.5634 13 K 3.9011 7.9932 119.6732 59.7215 31.9961 179.0596 14 R 3.9819 7.8148 116.7976 59.1080 30.0241 178.2039 15 L 4.3377 7.5759 115.7719 54.4338 41.5697 177.2439 16 G 3.8749 7.8253 106.8073 46.7966 0.0000 175.1952 17 M 3.9209 7.9468 121.5932 56.6851 32.2903 175.8329 18 D 4.5637 8.0288 118.0835 55.8273 41.3030 175.9186 19 G 3.9479 9.4791 115.8353 45.4263 0.0000 171.5705 20 Y 4.2673 8.3225 122.1887 58.6463 38.9174 176.2636 21 R 3.6086 8.9354 126.8064 57.3067 27.7611 177.1895 22 G 3.8153 8.1545 103.0131 45.8377 0.0000 173.9751 23 I 4.0936 7.6016 121.9639 59.1112 38.3355 175.9378 24 S 4.6405 8.3077 120.1603 57.6163 64.0025 174.8197 25 L 4.2456 8.7573 123.0689 58.6109 41.6479 179.3798 26 A 4.1525 8.1421 120.1509 55.2847 18.3755 179.2346 27 N 4.4746 8.2209 114.6382 56.3352 38.5787 177.7151 28 W 4.3238 8.0915 119.9103 59.9836 29.1115 178.3647 29 M 4.1710 8.5977 118.9827 58.5682 31.4704 177.8794 30 C 3.2153 8.2477 118.7418 59.1654 44.8218 175.3260 31 L 4.0196 8.1636 121.5697 58.2842 41.7468 178.7223 32 A 4.1829 8.3849 120.7333 55.0609 18.3232 179.2200 33 K 2.6000 8.1165 118.1148 59.4278 31.9612 179.0238 34 W 4.4031 7.5229 117.0980 59.0750 29.0872 178.3709 35 E 4.3547 8.3205 118.7827 58.6619 29.1741 177.7101 36 S 4.5158 7.8908 109.3413 56.6287 64.7846 174.5784 37 G 3.2556 8.2047 108.9499 46.8633 0.0000 173.3358 38 Y 3.6533 7.6531 113.6464 58.6326 34.8744 168.4888 39 N 5.3086 7.6217 118.0590 51.9500 40.2216 175.7218 40 T 4.0355 8.8178 117.0036 64.1945 69.1631 176.1319 41 R 4.3194 8.0195 119.1029 56.3528 30.7380 176.4611 42 A 4.3002 7.6173 121.2999 52.6090 19.2256 176.8435 43 T 5.0080 8.3288 111.0518 60.2945 72.5752 173.5212 44 N 4.8548 8.6628 120.6341 52.3131 42.6147 173.0385 45 Y 4.6719 8.7877 126.0136 57.3604 40.7798 174.0083 46 N 4.5729 8.5466 124.6091 51.0753 38.6731 175.2170 47 A 3.6861 8.3122 127.4035 54.7393 19.0361 179.3517 48 G 3.7455 8.1642 104.3253 48.3522 0.0000 174.0229 49 D 4.7333 7.6803 115.5501 51.9247 39.9461 175.9047 50 R 3.8419 8.1456 116.6671 57.1109 28.1500 175.8456 51 S 4.9552 7.5970 111.6307 57.0456 66.5190 172.6906 52 T 5.1103 8.8310 115.7890 61.9827 72.7014 172.9111 53 D 5.4392 9.0540 125.6520 53.3980 43.2033 175.0439 54 Y 4.8322 9.1339 120.9703 57.4225 41.4499 177.3961 55 G 4.4956 9.0316 112.3342 46.0329 0.0000 173.4264 56 I 3.9331 8.2481 116.8819 62.8291 37.8889 177.4476 57 F 4.8518 7.9690 115.4933 56.3902 40.0024 175.0616 58 Q 3.6004 7.9189 119.2384 57.0924 26.6411 174.3259 59 I 4.2878 7.9551 118.5053 61.2544 39.0483 176.9413 60 N 5.3995 9.2794 126.0179 53.4932 39.9012 175.5538 61 S 4.9197 9.0768 119.8842 59.7430 63.4330 175.2040 62 R 3.8108 8.7759 122.4296 58.4905 30.4473 177.5390 63 Y 4.1544 7.7558 114.9852 57.7584 40.4446 176.8203 64 W 4.8864 8.2973 118.6720 57.8100 31.3247 174.0482 65 C 5.6301 8.2643 112.6282 53.5179 46.3021 171.9074 66 N 5.2237 9.0590 119.5662 52.0797 40.0876 174.8154 67 D 4.8296 8.7889 123.8558 52.3105 40.3372 177.5312 68 G 4.0093 8.6126 107.9158 46.0772 0.0000 174.6530 69 K 4.4706 8.1767 116.8697 56.6492 33.0490 175.7062 70 T 4.6233 7.7423 116.7561 61.3763 68.2371 172.8442 71 P 4.2270 0.0000 0.0000 63.8376 31.8844 176.5772 72 G 3.9698 8.7629 109.2971 46.1973 0.0000 173.6989 73 A 4.1967 7.1903 119.6835 51.9454 19.0012 178.4676 74 V 3.9604 8.0442 119.5773 62.1635 33.9666 175.5363 75 N 4.1984 8.0559 116.5221 54.3159 36.9305 174.9758 76 A 3.9675 8.0683 121.4158 55.2956 18.9869 178.5244 77 C 4.5556 8.6672 111.5605 57.2727 41.1317 173.0358 78 H 4.0242 7.8751 116.3561 56.6541 26.3602 174.4979 79 L 4.8281 8.1790 117.4504 52.8085 46.3344 176.7436 80 S 4.6432 8.4006 116.1270 58.0390 63.2861 175.9747 81 C 4.1393 8.7251 124.5419 59.5670 39.4913 176.3461 82 S 3.9531 7.8250 114.7194 61.2984 61.6753 175.9378 83 A 4.0983 7.8583 122.4592 54.6125 17.9288 178.5736 84 L 4.4396 7.8327 115.9394 55.1501 41.6304 177.6841 85 L 5.0052 7.6236 117.9231 54.5365 42.2858 176.6255 86 Q 4.4025 7.7670 117.7365 55.2516 29.6394 175.9332 87 D 4.4313 8.5231 119.7716 57.0891 41.1494 176.7629 88 N 4.5726 8.0554 118.2476 53.2191 39.2128 174.6269 89 I 4.2328 8.4119 118.8396 61.0233 38.0437 176.9744 90 A 3.9325 8.1392 124.9844 56.0012 18.1614 180.1199 91 D 4.2944 8.0640 116.4791 57.2814 40.9131 178.6593 92 A 4.0705 7.9394 120.9329 55.1611 18.4085 179.7053 93 V 3.3926 8.1993 116.9374 66.0214 31.7248 178.0900 94 A 3.8202 8.0071 120.5530 55.2714 18.1248 178.8457 95 C 4.2322 8.3723 116.8016 59.6403 39.0834 175.6151 96 A 3.7693 8.2667 122.8619 54.9806 17.5903 179.7931 97 K 3.8085 7.7111 116.4595 59.3810 32.2860 179.2205 98 R 4.0625 7.7047 118.6709 59.3198 29.9522 178.6013 99 V 2.5279 7.5164 118.0704 65.7671 31.2635 177.7441 100 V 3.9994 7.6462 109.3333 62.1614 31.2872 177.5938 101 R 4.3193 7.6797 117.7167 56.2851 30.7049 176.3395 102 D 4.7159 7.3375 119.3125 52.9172 41.8819 175.4232 103 P 4.2180 0.0000 0.0000 66.1283 31.4098 178.2177 104 Q 4.0303 8.2102 116.3879 56.9475 29.9255 177.6853 105 G 3.8081 7.9022 106.7506 46.8740 0.0000 176.4552 106 I 3.3924 7.7878 120.8675 63.4745 37.9014 178.0070 107 R 4.1610 7.2341 118.2778 58.3595 29.9861 177.7044 108 A 3.8939 7.7330 120.6282 54.3492 18.6173 177.3614 109 F 4.5707 8.1901 115.6677 56.2381 39.1054 176.6650 110 V 3.6884 8.6992 126.4149 66.0718 31.2179 177.3810 111 A 4.0781 8.3368 119.9691 55.1253 18.0532 179.2686 112 W 4.0280 8.5074 126.8022 60.5900 30.5360 178.5044 113 R 3.7481 8.0669 116.7157 59.3583 29.6897 178.3524 114 N 4.3824 8.1034 115.0908 55.5110 38.6658 176.8135 115 R 4.1415 7.8285 116.5800 55.8733 31.8590 175.9996 116 C 4.5707 7.2535 114.5759 57.9012 42.5545 174.1697 117 Q 3.2441 6.4704 119.4073 57.3786 28.6673 175.7207 118 N 4.2312 8.7155 120.1435 54.1612 36.1169 173.8042 119 R 4.5710 7.3514 115.1431 53.9088 33.4796 175.1289 120 D 4.5166 8.5556 119.1843 54.4448 41.0303 176.1480 121 V 4.6300 8.2883 119.0469 61.2862 32.7339 177.9726 122 R 4.0414 7.9628 121.4075 59.3444 29.3392 178.4644 123 Q 3.9503 8.1991 116.9602 59.9300 27.8530 178.8029 124 Y 4.0065 7.7809 117.2396 59.8990 38.3396 176.9170 125 V 4.3598 7.8616 111.0989 60.8450 33.1206 175.6803 126 Q 4.2113 7.4346 120.2614 57.2810 28.7807 177.0344 127 G 3.9931 8.9761 110.9346 45.7435 0.0000 174.6030 128 C 4.4065 7.9200 115.4479 57.0305 40.5560 173.8512 129 G 3.8595 8.1266 107.2113 46.8694 0.0000 174.1548 130 V 4.0129 7.8965 117.9897 61.0900 32.1183 175.8744 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 K 8.17 4.20 0.00 1.83 1.68 0.00 1.31 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.93 1.14 7.81 2 V 8.16 4.62 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 0.92 0.00 0.00 0.95 0.00 0.00 3 F 9.98 4.33 0.00 2.85 2.84 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 4 E 9.03 4.28 0.00 1.90 1.85 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 2.27 2.37 0.00 5 R 8.94 3.38 0.00 1.91 1.94 0.00 3.46 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 6 C 8.05 4.37 0.00 3.00 3.11 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 7 E 8.10 3.90 0.00 2.04 2.22 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 2.58 2.40 0.00 8 L 8.05 3.67 0.00 1.46 1.41 -0.06 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.81 3.96 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 10 R 8.14 3.91 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.96 3.85 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 1.20 0.00 0.00 12 L 8.17 3.86 0.00 1.57 1.56 0.93 0.46 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 13 K 7.99 3.90 0.00 2.04 2.01 0.00 1.55 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.53 7.81 14 R 7.81 3.98 0.00 1.98 1.96 0.00 3.20 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 15 L 7.58 4.34 0.00 1.62 1.56 0.83 0.91 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 16 G 7.83 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 0.00 0.00 0.00 17 M 7.95 3.92 0.00 1.22 1.94 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.21 0.00 18 D 8.03 4.56 0.00 2.68 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 19 G 9.48 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.32 4.27 0.00 3.35 3.22 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 21 R 8.94 3.61 0.00 1.85 1.84 0.00 3.35 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.27 0.00 22 G 8.15 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 23 I 7.60 4.09 1.72 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.67 -0.21 0.00 0.00 24 S 8.31 4.64 0.00 4.07 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 25 L 8.76 4.25 0.00 2.05 1.82 0.98 1.62 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 26 A 8.14 4.15 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 0.00 0.00 27 N 8.22 4.47 0.00 2.86 2.75 0.00 0.00 6.99 7.01 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 28 W 8.09 4.32 0.00 3.57 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.60 4.17 0.00 2.16 2.39 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 30 C 8.25 3.22 0.00 2.70 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 31 L 8.16 4.02 0.00 1.88 1.99 0.90 -0.17 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 32 A 8.38 4.18 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.12 2.60 0.00 1.52 1.50 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.66 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.83 0.21 7.81 34 W 7.52 4.40 0.00 3.38 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 35 E 8.32 4.35 0.00 2.18 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 0.00 2.66 2.60 0.00 36 S 7.89 4.52 0.00 4.07 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 37 G 8.20 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 0.00 0.00 0.00 38 Y 7.65 3.65 0.00 3.23 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 39 N 7.62 5.31 0.00 2.85 2.82 0.00 0.00 7.01 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 40 T 8.82 4.04 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 1.45 0.00 0.00 41 R 8.02 4.32 0.00 2.00 2.04 0.00 3.19 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 42 A 7.62 4.30 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 43 T 8.33 5.01 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 1.24 0.00 0.00 44 N 8.66 4.85 0.00 2.85 2.74 0.00 0.00 6.77 7.63 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 45 Y 8.79 4.67 0.00 3.03 2.84 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 46 N 8.55 4.57 0.00 2.61 2.59 0.00 0.00 6.64 7.15 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 47 A 8.31 3.69 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 48 G 8.16 3.75 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 0.00 0.00 0.00 49 D 7.68 4.73 0.00 2.71 2.70 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 50 R 8.15 3.84 0.00 2.02 2.18 0.00 3.14 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.53 0.00 51 S 7.60 4.96 0.00 3.85 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 52 T 8.83 5.11 4.32 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 0.69 0.00 0.00 53 D 9.05 5.44 0.00 2.73 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.13 4.83 0.00 2.99 2.89 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 55 G 9.03 4.50 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 56 I 8.25 3.93 1.66 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.82 0.11 0.00 0.00 57 F 7.97 4.85 0.00 3.16 2.93 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 58 Q 7.92 3.60 0.00 2.52 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.70 0.00 59 I 7.96 4.29 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.02 1.14 0.00 0.00 60 N 9.28 5.40 0.00 3.13 3.09 0.00 0.00 6.98 7.63 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 61 S 9.08 4.92 0.00 4.04 4.32 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 62 R 8.78 3.81 0.00 1.58 1.48 0.00 2.67 0.00 0.00 2.80 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.98 0.00 63 Y 7.76 4.15 0.00 1.80 1.72 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 64 W 8.30 4.89 0.00 3.52 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 65 C 8.26 5.63 0.00 3.05 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 66 N 9.06 5.22 0.00 2.82 2.69 0.00 0.00 7.04 8.35 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 67 D 8.79 4.83 0.00 2.82 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 68 G 8.61 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 69 K 8.18 4.47 0.00 1.90 1.91 0.00 1.62 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.46 7.81 70 T 7.74 4.62 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 1.19 0.00 0.00 71 P 0.00 4.23 0.00 2.14 1.95 0.00 3.74 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 72 G 8.76 3.97 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 0.00 0.00 0.00 73 A 7.19 4.20 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 74 V 8.04 3.96 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 0.68 0.00 0.00 0.84 0.00 0.00 75 N 8.06 4.20 0.00 2.93 2.72 0.00 0.00 7.11 7.82 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 76 A 8.07 3.97 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 77 C 8.67 4.56 0.00 3.27 3.23 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 78 H 7.88 4.02 0.00 3.31 3.37 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.18 4.83 0.00 1.69 1.50 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.40 4.64 0.00 3.83 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 81 C 8.73 4.14 0.00 2.29 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 82 S 7.83 3.95 0.00 3.90 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 83 A 7.86 4.10 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 84 L 7.83 4.44 0.00 1.93 1.82 1.04 0.41 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 85 L 7.62 5.01 0.00 1.80 1.72 1.14 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.77 4.40 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 87 D 8.52 4.43 0.00 2.64 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 88 N 8.06 4.57 0.00 2.70 2.75 0.00 0.00 6.94 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 89 I 8.41 4.23 1.73 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.96 0.89 0.00 0.00 90 A 8.14 3.93 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 91 D 8.06 4.29 0.00 2.71 2.74 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 92 A 7.94 4.07 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 93 V 8.20 3.39 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 0.78 0.00 0.00 0.86 0.00 0.00 94 A 8.01 3.82 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 95 C 8.37 4.23 0.00 3.13 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 96 A 8.27 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.71 3.81 0.00 1.61 1.42 0.00 1.28 0.00 0.00 0.83 0.00 0.00 2.28 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.70 4.06 0.00 2.00 2.13 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 99 V 7.52 2.53 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 0.04 0.00 0.00 -0.50 0.00 0.00 100 V 7.65 4.00 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 0.90 0.00 0.00 1.41 0.00 0.00 101 R 7.68 4.32 0.00 2.06 2.03 0.00 3.23 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 1.74 2.13 0.00 102 D 7.34 4.72 0.00 2.90 2.63 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 0.00 103 P 0.00 4.22 0.00 2.02 2.13 0.00 3.70 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 2.03 2.14 0.00 104 Q 8.21 4.03 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.76 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 105 G 7.90 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 0.00 0.00 0.00 0.00 106 I 7.79 3.39 0.95 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.21 -0.69 0.00 0.00 107 R 7.23 4.16 0.00 1.99 2.00 0.00 3.27 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.87 0.00 108 A 7.73 3.89 1.04 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 0.00 0.00 109 F 8.19 4.57 0.00 3.15 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 0.00 110 V 8.70 3.69 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 1.09 0.00 0.00 0.99 0.00 0.00 111 A 8.34 4.08 1.54 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 0.00 112 W 8.51 4.03 0.00 3.43 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 0.00 113 R 8.07 3.75 0.00 2.06 1.99 0.00 3.62 0.00 0.00 3.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.08 0.00 114 N 8.10 4.38 0.00 2.59 2.75 0.00 0.00 6.95 7.01 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 0.00 115 R 7.83 4.14 0.00 1.34 0.98 0.00 2.82 0.00 0.00 2.78 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.07 0.00 116 C 7.25 4.57 0.00 1.75 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 6.47 3.24 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.68 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 118 N 8.72 4.23 0.00 2.80 2.83 0.00 0.00 6.83 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 0.00 119 R 7.35 4.57 0.00 1.85 1.78 0.00 3.26 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 0.00 120 D 8.56 4.52 0.00 2.64 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 0.00 121 V 8.29 4.63 2.43 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 1.01 0.00 0.00 1.08 0.00 0.00 122 R 7.96 4.04 0.00 2.06 2.01 0.00 3.24 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 123 Q 8.20 3.95 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.12 1.54 0.00 124 Y 7.78 4.01 0.00 3.23 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 0.00 125 V 7.86 4.36 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 1.00 0.00 0.00 1.07 0.00 0.00 126 Q 7.43 4.21 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 127 G 8.98 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 0.00 128 C 7.92 4.41 0.00 3.11 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 0.00 129 G 8.13 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.90 4.01 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 0.82 0.00 0.00 0.96 0.00 0.00