NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8333 8.0544 120.3684 62.5906 32.6530 174.1215 2 Q 4.3979 8.1320 126.0695 53.4094 31.1482 173.0558 3 W 4.8304 8.3485 124.6541 54.7730 32.0993 175.7703 4 S 4.3766 12.0000 117.7145 57.3221 63.1258 174.2709 5 A 4.0262 8.2586 122.1368 55.4095 17.8543 179.5059 6 E 3.9165 8.1791 114.7937 59.1938 29.2387 179.1533 7 E 3.9965 8.0789 119.8712 59.2000 29.3329 179.0202 8 K 3.8251 8.2614 118.4523 58.7082 32.4630 178.9675 9 Q 3.9782 7.9196 119.2242 58.3503 29.0304 177.9485 10 L 4.0003 7.5667 120.4862 57.8843 41.6894 178.6196 11 I 3.1701 6.9271 118.0093 64.8985 37.2621 178.0820 12 S 4.4444 8.1857 114.7444 61.7302 62.8185 177.1155 13 G 3.9839 8.2547 109.1877 46.8094 0.0000 175.4641 14 L 4.0579 8.3544 123.9246 57.1163 41.3387 178.7174 15 W 4.7877 9.2168 128.6338 60.0457 30.3345 177.9996 16 G 3.7081 7.8606 104.4482 47.3252 0.0000 174.7664 17 K 4.1307 8.1678 119.7211 57.9637 32.8156 176.8157 18 V 3.3956 6.9500 114.8696 62.9620 31.1951 176.0416 19 N 4.4518 8.4954 126.5890 52.3895 38.5038 174.9765 20 V 3.5443 8.0627 127.1959 65.9732 31.5144 177.1440 21 A 4.0090 8.0447 119.7629 55.0539 18.0069 178.9197 22 D 4.3562 7.8065 116.2084 57.1943 41.6192 178.7812 23 C 4.0973 7.8731 116.7426 62.3386 27.9930 176.4388 24 G 3.6695 8.4197 108.6803 47.2367 0.0000 175.6303 25 A 4.0097 7.3900 123.9433 54.5990 18.3534 179.4511 26 E 3.8570 8.8668 117.3205 59.5648 29.3514 179.4966 27 A 3.9404 7.7772 119.2492 55.1030 18.7692 179.1934 28 L 4.0636 8.1171 118.6058 58.0892 41.8401 178.5194 29 A 3.9634 8.3211 121.1461 55.6909 18.3469 179.6678 30 R 3.7991 8.3532 116.2648 59.2791 30.2092 179.2055 31 L 3.9136 7.8405 120.0078 58.2766 42.2201 179.1160 32 L 4.5636 7.8600 119.3600 56.6471 41.3098 179.0761 33 I 3.8905 6.9578 118.6170 63.4683 37.7757 177.7864 34 V 3.8076 7.8782 117.4294 63.5667 32.5980 175.5206 35 Y 4.3218 7.1423 115.4931 54.2457 38.7327 173.8936 36 P 5.2520 0.0000 0.0000 64.6754 31.6675 177.7550 37 W 4.6485 8.3984 115.1641 59.6805 27.7839 177.5615 38 T 4.3283 7.5259 109.5080 63.5874 68.1181 175.4391 39 Q 4.4352 8.6193 121.1466 57.0433 28.8115 177.4046 40 R 3.7303 7.5637 120.3694 58.2675 30.2113 176.8235 41 F 4.4976 7.5589 113.7972 57.4665 39.5406 175.8228 42 F 4.8702 7.5366 119.5791 56.9314 39.4052 176.9752 43 A 4.0838 8.3772 126.5125 55.1835 18.2523 180.0669 44 S 4.3930 8.3377 110.2650 61.5865 63.1489 175.7639 45 F 4.6434 8.9185 117.8529 57.6427 39.2901 176.6168 46 G 4.0030 7.8315 107.6382 45.0910 0.0000 173.8865 47 N 4.5876 8.6260 122.8596 53.3825 39.7791 175.4316 48 L 4.9621 8.2322 126.8818 54.1259 42.6503 177.2971 49 S 4.4737 10.5046 114.3140 59.9526 64.1673 175.4583 50 S 4.7043 7.5759 114.4080 54.9516 66.9929 172.7352 51 P 4.2160 0.0000 0.0000 66.2881 31.4090 178.8625 52 T 4.0610 7.8168 113.5617 66.3487 68.6792 176.4044 53 A 4.0072 9.0146 123.4781 55.5747 18.3271 179.6510 54 I 3.6797 9.3437 117.8949 64.5823 37.0300 178.2383 55 L 4.2248 7.7397 116.8840 56.1505 41.5235 178.3482 56 G 3.9172 7.8570 104.9678 44.4345 0.0000 173.8929 57 N 4.4221 7.2583 119.4596 53.4542 39.7878 173.7456 58 P 4.4777 0.0000 0.0000 66.0786 31.9019 178.1015 59 M 3.7583 8.1305 117.9518 58.1022 31.6927 178.8311 60 V 3.6966 7.7111 117.4997 66.2829 32.0579 178.0169 61 R 4.0018 7.5976 118.0804 58.7793 28.4417 178.1395 62 A 3.9840 8.4436 121.1954 55.0760 18.0457 178.9780 63 H 4.6068 9.0189 117.1949 58.9289 29.5399 177.7383 64 G 3.6530 7.9211 108.1690 47.3025 0.0000 175.6548 65 K 4.0161 7.6580 121.6853 59.3550 32.2503 179.1120 66 K 4.5395 7.4989 119.9044 59.5191 32.1634 179.0732 67 V 3.5272 7.2806 117.5062 65.6750 31.6159 177.6121 68 L 4.3427 8.1334 119.4949 59.2374 42.2101 178.4978 69 T 3.9840 8.3747 115.0076 66.9292 68.1066 175.8147 70 S 3.9512 9.2509 115.7553 61.8768 62.5871 176.9439 71 F 4.2447 8.8145 120.3799 60.1310 38.5158 177.6732 72 G 3.5344 9.4890 106.0110 47.9959 0.0000 175.3486 73 D 4.4395 7.6324 119.3050 56.1408 40.8535 178.6376 74 A 4.0925 7.7274 121.5911 54.6856 18.6018 179.3213 75 V 3.0121 7.1348 115.8558 65.9564 31.5096 177.7750 76 K 4.4500 7.6288 115.1522 55.9737 32.2872 176.6445 77 N 4.2024 9.2537 113.7338 53.3056 40.4379 173.8459 78 L 3.9735 8.2114 125.2783 55.2730 42.1741 177.4399 79 D 4.9042 8.0727 116.7354 54.2881 42.8794 175.8600 80 N 5.0290 7.8416 116.3703 51.4595 39.0377 173.8386 81 I 4.1740 7.6223 123.6090 63.3927 38.4734 177.7566 82 K 3.9560 7.9650 119.1925 60.2944 31.5013 178.7553 83 N 4.4088 8.1246 117.0540 56.2872 38.3185 177.3484 84 T 3.9898 7.6886 116.0233 66.1848 68.5434 175.9069 85 F 4.1565 8.3744 115.6231 60.0979 39.5386 179.6041 86 A 3.7716 7.9779 120.1022 54.8329 18.6211 178.8173 87 Q 3.8555 8.1696 117.7846 59.4096 29.0092 178.4836 88 L 4.1842 10.2360 115.1558 55.7382 42.5306 178.9500 89 S 4.0613 8.2775 114.5314 61.3346 62.1607 175.4040 90 E 3.8561 8.0947 120.6605 59.5749 29.1965 178.5774 91 L 3.9255 7.3353 119.9561 59.1131 42.0502 178.9108 92 H 4.2079 8.2393 115.2789 58.0871 28.3736 176.9426 93 C 4.5267 7.4873 118.1118 60.1465 29.3102 174.3479 94 D 4.7390 10.6100 117.4768 54.5260 42.0971 177.4863 95 K 4.2146 8.0073 118.7890 57.8448 32.9068 176.9838 96 L 4.3677 8.0429 116.5978 54.3918 43.1159 175.9529 97 H 4.1441 7.9729 114.4048 56.4647 25.2983 173.6950 98 V 3.8740 8.2962 118.5753 60.6785 32.2526 175.1024 99 D 4.2081 8.0756 126.3707 53.1777 42.3461 174.8166 100 P 3.4754 0.0000 0.0000 65.8559 31.4366 178.7172 101 E 3.8311 7.7613 117.9603 59.3004 29.3006 179.0806 102 N 4.2842 7.9210 116.2228 56.5789 38.7251 177.4152 103 F 4.4305 6.8149 116.4652 60.8074 39.0247 177.6667 104 R 3.9913 8.2731 117.6886 59.8220 29.6243 178.0650 105 L 4.0162 7.7093 117.6313 57.7796 41.6990 179.0634 106 L 4.1825 8.4152 120.7047 58.3889 41.7277 179.1195 107 G 3.7350 8.2506 104.0293 48.1687 0.0000 174.7353 108 D 4.6304 8.3259 122.0772 57.0666 41.0314 179.3141 109 I 3.6967 8.6821 121.0411 64.3131 37.1285 177.9381 110 L 3.8412 8.3684 121.4701 58.3943 41.5901 179.4152 111 I 3.6155 7.6375 119.5190 64.2728 37.2910 178.3217 112 I 3.5489 7.5682 120.1300 64.2516 36.7499 178.4476 113 V 3.5205 7.2734 117.3844 65.9840 31.3725 177.6069 114 L 4.0904 7.6192 118.3819 57.9138 41.3008 179.5377 115 A 3.4169 7.5120 120.1997 54.3394 17.9953 178.5761 116 A 4.3256 7.4304 116.4097 53.2727 18.8450 177.9217 117 H 4.5740 7.9551 113.3880 55.1824 31.0618 175.1032 118 F 4.7102 8.1891 117.3810 55.0467 40.3854 177.2312 119 T 3.4506 8.3782 110.4744 62.6190 70.0137 175.6929 120 K 4.2895 8.9240 118.8741 57.9011 31.9697 177.1721 121 E 4.0899 8.4259 120.3193 58.8634 30.2620 177.3698 122 F 4.2732 8.0310 122.3206 56.9975 37.9738 174.2789 123 T 4.0103 7.5461 113.3934 61.1894 68.9731 172.2036 124 P 4.1802 0.0000 0.0000 65.8682 32.1010 178.3253 125 E 3.9196 8.2204 117.6487 60.1667 29.4655 179.0047 126 C 3.8815 7.7745 118.0381 62.5890 31.5347 175.1386 127 Q 4.1661 8.0900 120.5717 59.6360 28.5840 179.0378 128 A 4.0585 7.9150 120.7995 54.9107 18.4863 179.2062 129 A 4.0306 8.1372 119.3371 55.2715 17.7450 180.0093 130 W 4.0237 8.1545 117.5713 59.6678 29.1223 178.3609 131 Q 4.2338 8.3477 119.7193 59.4362 28.4287 178.1644 132 K 3.7091 8.1238 120.1870 59.7848 32.1130 177.6455 133 L 4.3987 8.3222 120.1171 58.9315 41.9354 179.6842 134 V 4.0996 9.6067 111.5230 63.6025 31.4244 178.7693 135 R 3.9133 8.2181 119.5132 59.3706 29.9451 178.5970 136 V 3.4907 7.9059 118.1075 66.0170 31.4109 178.0674 137 V 3.1025 7.6980 115.9511 65.0905 30.9823 177.0645 138 A 4.2786 7.6708 120.0062 54.7052 18.9187 178.9306 139 H 3.9837 8.3224 116.7339 59.2790 29.9362 177.2330 140 A 4.1273 8.0873 121.6987 53.9455 18.2239 177.5650 141 L 4.1621 7.0875 115.7443 55.1013 42.7307 176.5564 142 A 5.0695 8.5487 120.7782 52.6348 19.2832 178.1158 143 R 4.2390 7.8783 117.2127 59.2880 30.0707 177.8764 144 K 4.2262 7.3256 117.4138 57.2497 32.4207 176.7401 145 Y 4.5374 7.5987 114.4103 60.3174 38.3363 175.4108 146 H 4.5682 7.8463 121.5509 55.8298 29.2529 173.5509 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 V 8.05 3.83 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 0.19 0.00 0.00 0.70 0.00 0.00 2 Q 8.13 4.40 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.56 0.00 0.00 0.00 0.00 0.00 2.22 2.42 0.00 3 W 8.35 4.83 0.00 3.20 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 4 S 12.00 4.38 0.00 4.00 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 0.00 5 A 8.26 4.03 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 6 E 8.18 3.92 0.00 2.17 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 0.00 2.38 2.37 0.00 7 E 8.08 4.00 0.00 2.47 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 2.41 2.41 0.00 8 K 8.26 3.83 0.00 1.70 1.67 0.00 1.60 0.00 0.00 1.43 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.30 1.70 7.81 9 Q 7.92 3.98 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.93 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 10 L 7.57 4.00 0.00 1.73 1.66 0.90 0.75 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 11 I 6.93 3.17 1.39 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.32 -0.12 0.00 0.00 12 S 8.19 4.44 0.00 4.08 4.06 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 13 G 8.25 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 0.00 0.00 0.00 14 L 8.35 4.06 0.00 1.97 1.98 0.65 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.22 4.79 0.00 3.81 3.34 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 16 G 7.86 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 17 K 8.17 4.13 0.00 2.25 2.02 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.47 7.81 18 V 6.95 3.40 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 0.69 0.00 0.00 1.21 0.00 0.00 19 N 8.50 4.45 0.00 2.72 2.59 0.00 0.00 6.77 7.71 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 20 V 8.06 3.54 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 1.13 0.00 0.00 0.84 0.00 0.00 21 A 8.04 4.01 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 D 7.81 4.36 0.00 2.62 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 23 C 7.87 4.10 0.00 2.94 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 24 G 8.42 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 0.00 0.00 0.00 25 A 7.39 4.01 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 26 E 8.87 3.86 0.00 2.09 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 2.31 2.32 0.00 27 A 7.78 3.94 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 28 L 8.12 4.06 0.00 1.80 1.79 0.88 0.92 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 29 A 8.32 3.96 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 30 R 8.35 3.80 0.00 1.96 1.93 0.00 3.15 0.00 0.00 3.03 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 31 L 7.84 3.91 0.00 1.94 1.90 1.07 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.86 4.56 0.00 1.74 1.95 0.96 1.34 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 33 I 6.96 3.89 1.98 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 1.38 0.54 0.84 0.00 0.00 34 V 7.88 3.81 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 0.02 0.00 0.00 0.74 0.00 0.00 35 Y 7.14 4.32 0.00 2.78 1.46 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 36 P 0.00 5.25 0.00 2.26 2.13 0.00 3.91 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 2.21 2.01 0.00 37 W 8.40 4.65 0.00 3.51 3.52 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 38 T 7.53 4.33 4.35 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 1.04 0.00 0.00 39 Q 8.62 4.44 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 40 R 7.56 3.73 0.00 1.49 1.48 0.00 3.03 0.00 0.00 2.80 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.25 0.00 41 F 7.56 4.50 0.00 2.28 2.79 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 42 F 7.54 4.87 0.00 2.76 1.97 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 43 A 8.38 4.08 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 44 S 8.34 4.39 0.00 4.22 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 0.00 45 F 8.92 4.64 0.00 3.02 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 46 G 7.83 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 47 N 8.63 4.59 0.00 2.71 2.77 0.00 0.00 6.58 7.78 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 48 L 8.23 4.96 0.00 1.66 1.62 1.03 1.02 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 49 S 10.50 4.47 0.00 3.99 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 50 S 7.58 4.70 0.00 4.00 3.94 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 51 P 0.00 4.22 0.00 2.02 2.18 0.00 3.67 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 2.03 2.20 0.00 52 T 7.82 4.06 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 53 A 9.01 4.01 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 54 I 9.34 3.68 1.92 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 1.55 0.98 0.93 0.00 0.00 55 L 7.74 4.22 0.00 1.92 1.71 0.91 0.61 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 56 G 7.86 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 0.00 0.00 0.00 57 N 7.26 4.42 0.00 2.95 2.77 0.00 0.00 6.80 7.59 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 58 P 0.00 4.48 0.00 2.26 2.26 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 M 8.13 3.76 0.00 0.88 1.92 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.42 0.00 60 V 7.71 3.70 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 1.05 0.00 0.00 1.06 0.00 0.00 61 R 7.60 4.00 0.00 1.95 2.04 0.00 3.13 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 62 A 8.44 3.98 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 63 H 9.02 4.61 0.00 3.31 3.63 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 7.92 3.65 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 0.00 0.00 0.00 65 K 7.66 4.02 0.00 1.97 1.98 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.48 7.81 66 K 7.50 4.54 0.00 2.12 2.08 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.61 1.33 7.81 67 V 7.28 3.53 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 1.12 0.00 0.00 0.92 0.00 0.00 68 L 8.13 4.34 0.00 1.90 1.97 1.07 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.37 3.98 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 1.29 0.00 0.00 70 S 9.25 3.95 0.00 3.73 4.13 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 71 F 8.81 4.24 0.00 3.30 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 72 G 9.49 3.53 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 0.00 73 D 7.63 4.44 0.00 2.63 2.72 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 74 A 7.73 4.09 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 75 V 7.13 3.01 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 0.51 0.00 0.00 0.03 0.00 0.00 76 K 7.63 4.45 0.00 1.83 1.82 0.00 1.89 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.56 7.81 77 N 9.25 4.20 0.00 2.54 2.63 0.00 0.00 7.12 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 78 L 8.21 3.97 0.00 1.12 0.54 -0.33 -1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.07 4.90 0.00 2.64 2.72 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 80 N 7.84 5.03 0.00 2.55 2.67 0.00 0.00 7.14 8.49 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 81 I 7.62 4.17 1.84 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 1.84 0.91 0.71 0.00 0.00 82 K 7.96 3.96 0.00 1.97 2.05 0.00 1.49 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.54 7.81 83 N 8.12 4.41 0.00 2.77 2.91 0.00 0.00 7.15 7.05 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 84 T 7.69 3.99 4.66 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 1.11 0.00 0.00 85 F 8.37 4.16 0.00 2.92 3.01 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 86 A 7.98 3.77 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 87 Q 8.17 3.86 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 88 L 10.24 4.18 0.00 1.74 1.67 0.64 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.28 4.06 0.00 3.87 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 90 E 8.09 3.86 0.00 2.03 1.97 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 2.37 2.36 0.00 91 L 7.34 3.93 0.00 1.78 1.69 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.24 4.21 0.00 3.43 3.57 0.00 5.83 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 93 C 7.49 4.53 0.00 2.96 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 94 D 10.61 4.74 0.00 2.72 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 95 K 8.01 4.21 0.00 1.68 1.91 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.52 7.81 96 L 8.04 4.37 0.00 1.64 1.70 0.89 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.97 4.14 0.00 3.43 3.40 0.00 5.68 0.00 0.00 0.00 0.00 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.30 3.87 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 0.54 0.00 0.00 0.74 0.00 0.00 99 D 8.08 4.21 0.00 2.56 2.33 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 0.00 100 P 0.00 3.48 0.00 2.09 2.13 0.00 3.38 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.84 0.00 101 E 7.76 3.83 0.00 1.96 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 0.00 2.29 2.44 0.00 102 N 7.92 4.28 0.00 2.69 2.83 0.00 0.00 6.83 7.65 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 0.00 103 F 6.81 4.43 0.00 3.19 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 0.00 104 R 8.27 3.99 0.00 1.81 2.34 0.00 3.51 0.00 0.00 3.37 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 105 L 7.71 4.02 0.00 1.80 1.72 -0.07 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.42 4.18 0.00 1.91 2.06 1.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.25 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 0.00 0.00 0.00 108 D 8.33 4.63 0.00 2.96 2.83 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 0.00 109 I 8.68 3.70 2.06 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 0.97 0.00 0.00 110 L 8.37 3.84 0.00 1.60 1.87 0.69 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.64 3.62 2.08 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.80 0.94 0.00 0.00 112 I 7.57 3.55 1.81 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 1.48 1.11 0.85 0.00 0.00 113 V 7.27 3.52 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 0.82 0.00 0.00 0.99 0.00 0.00 114 L 7.62 4.09 0.00 1.51 1.28 0.20 0.67 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 0.00 115 A 7.51 3.42 0.94 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 0.00 0.00 116 A 7.43 4.33 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 0.00 117 H 7.96 4.57 0.00 2.94 2.81 0.00 5.81 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.19 4.71 0.00 3.13 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 0.00 119 T 8.38 3.45 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 1.21 0.00 0.00 120 K 8.92 4.29 0.00 1.82 1.95 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.46 7.81 121 E 8.43 4.09 0.00 2.08 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 2.40 2.32 0.00 122 F 8.03 4.27 0.00 3.10 3.05 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 0.00 0.00 0.00 0.00 123 T 7.55 4.01 4.25 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 1.29 0.00 0.00 124 P 0.00 4.18 0.00 2.21 2.08 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 125 E 8.22 3.92 0.00 2.03 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 0.00 2.42 2.48 0.00 126 C 7.77 3.88 0.00 2.76 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 0.00 127 Q 8.09 4.17 0.00 2.50 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 128 A 7.91 4.06 1.41 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 0.00 0.00 0.00 129 A 8.14 4.03 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 0.00 130 W 8.15 4.02 0.00 3.51 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.35 4.23 0.00 2.41 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 132 K 8.12 3.71 0.00 1.81 2.13 0.00 1.48 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.68 1.00 7.81 133 L 8.32 4.40 0.00 1.80 1.98 0.80 -0.05 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 0.00 134 V 9.61 4.10 2.32 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 1.24 0.00 0.00 1.22 0.00 0.00 135 R 8.22 3.91 0.00 2.05 2.10 0.00 3.10 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 136 V 7.91 3.49 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 1.00 0.00 0.00 0.70 0.00 0.00 137 V 7.70 3.10 2.13 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 0.08 0.00 0.00 0.87 0.00 0.00 138 A 7.67 4.28 1.50 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 0.00 139 H 8.32 3.98 0.00 3.20 3.23 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.09 4.13 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 0.00 141 L 7.09 4.16 0.00 1.24 1.37 0.98 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.55 5.07 1.55 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 0.00 0.00 143 R 7.88 4.24 0.00 2.05 2.27 0.00 3.02 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.61 0.00 144 K 7.33 4.23 0.00 1.65 1.65 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.39 7.81 145 Y 7.60 4.54 0.00 3.30 2.75 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 0.00 146 H 7.85 4.57 0.00 3.15 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00