NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7214 8.4249 118.1259 52.7421 38.8270 173.2767 3 T 3.4599 8.2113 119.1585 62.8738 68.9597 172.0891 4 K 4.3913 9.0191 128.1465 55.1411 34.3213 174.9244 5 Y 4.6737 9.1087 124.4819 56.2593 39.6726 175.7067 6 N 4.3626 8.8288 121.0000 54.0313 40.2444 175.6031 7 K 3.8441 8.8621 128.1949 59.9580 32.3423 178.7077 8 E 3.9081 8.2331 118.2225 59.1052 29.4425 178.8704 9 F 4.2161 8.9213 121.1347 61.3762 39.4257 177.2247 10 L 3.7291 8.1475 118.6245 57.4677 41.2315 179.3243 11 L 3.5604 7.6780 119.2331 57.8641 41.5301 178.8965 12 Y 3.9145 7.8074 119.0686 60.7063 38.7087 177.9234 13 L 3.8976 8.2659 121.3634 58.0418 42.0257 178.6434 14 A 4.0028 8.3128 121.2569 55.0768 18.2687 179.9089 15 G 3.3903 7.7085 104.2164 47.8353 0.0000 175.6282 16 F 3.8352 7.9721 123.7563 60.7835 39.3793 177.2926 17 V 3.5961 8.6500 118.3602 66.3052 31.1854 177.6655 18 D 4.4835 8.3033 117.6986 57.7586 40.6121 178.3625 19 G 3.5782 7.7508 106.1318 45.6955 0.0000 174.3006 20 D 4.7233 8.1937 118.8790 52.2542 41.4616 176.5295 21 G 4.3309 7.3745 107.7833 45.1505 0.0000 173.5011 22 S 4.6682 8.8018 114.1081 56.8189 66.1550 172.5854 23 I 4.9654 8.5387 127.8704 59.8879 38.7149 174.8876 24 I 4.6897 9.0245 128.4480 59.2586 40.2950 174.7080 25 A 5.2140 8.6590 127.2418 50.3019 21.9565 175.1875 26 Q 4.6044 9.3328 120.0299 54.1667 33.5005 174.1543 27 I 4.8244 8.3551 122.8588 59.6414 39.1968 174.5052 28 E 4.6926 9.0757 128.3829 53.4308 32.1137 173.3799 29 P 4.6751 0.0000 0.0000 63.0840 32.5136 175.5566 30 N 4.6334 8.8696 119.9874 53.1030 42.3374 175.5050 31 Q 4.1346 9.1369 125.8056 58.6644 29.0836 177.4350 32 S 4.2796 8.5043 112.6869 59.6554 63.3934 173.8350 33 Y 4.3976 7.7561 118.9131 56.0176 39.3380 176.2640 34 K 3.5099 8.6790 123.8759 59.4602 32.1530 178.4864 35 F 4.7721 7.4222 115.6735 57.1666 39.4340 176.7163 36 K 4.1140 8.7413 117.6841 57.3015 30.0484 174.8027 37 H 5.3503 7.7145 113.4720 54.6952 33.2102 172.8859 38 R 4.4232 8.8056 120.9586 54.4269 33.2453 174.1892 39 L 5.0594 8.4734 123.9253 53.4038 43.5074 175.8126 40 K 4.6810 9.2810 124.3378 54.5416 35.3310 174.6068 41 L 5.3761 8.6483 126.1449 53.3623 44.9352 176.0810 42 T 4.8553 9.0443 119.3986 62.0595 73.1985 172.4007 43 F 5.3034 9.3530 129.2309 56.6653 41.4353 174.3857 44 K 4.8340 8.1606 126.2088 54.5617 36.2812 174.8304 45 V 4.5299 8.5493 125.4650 61.4617 34.4331 174.2211 46 T 5.0454 8.2374 124.3619 62.6033 70.1879 174.1613 47 Q 4.6030 9.0672 125.2982 54.1845 33.2994 173.3588 48 K 4.1392 8.9354 125.9691 57.4697 32.6525 177.5309 49 T 4.0036 8.8969 123.4442 66.5447 68.7483 176.1066 50 Q 4.0215 8.2930 121.5138 58.6812 29.1109 177.2995 51 R 4.6524 8.2433 116.1229 55.7321 30.7651 177.9250 52 R 3.9191 8.2075 121.9734 59.2736 29.7226 178.0571 53 W 4.4856 8.2294 116.1456 59.4459 28.1194 177.9491 54 F 3.4970 7.2886 121.7066 60.6726 38.6238 177.2639 55 L 3.9127 7.6264 118.3231 57.7739 41.3172 178.9330 56 D 4.4465 8.6594 119.3227 57.3170 40.6638 178.9627 57 K 3.9606 8.3580 119.2176 59.2838 31.9246 179.1415 58 L 3.7249 7.3722 119.0502 57.7940 41.4398 179.5587 59 V 3.7529 7.6225 117.9265 66.3451 31.1784 177.6335 60 D 4.3276 7.5697 116.1329 57.3241 41.1587 177.7765 61 E 3.9331 8.1190 118.4814 59.4595 29.5558 179.1023 62 I 3.9436 8.2474 119.9179 62.4014 37.2400 177.5997 63 G 4.0802 10.0440 107.5640 45.1555 0.0000 172.9012 64 V 4.3761 7.3871 116.8854 61.0091 34.2057 174.0759 65 G 3.6982 10.6495 106.6529 46.4201 0.0000 171.2700 66 Y 4.8858 7.1390 115.0279 56.0606 41.8225 173.6467 67 V 4.7866 8.5181 119.4073 61.1051 34.0871 174.3416 68 S 4.8376 9.0715 122.4059 56.5194 65.2127 171.8214 69 D 5.0387 8.8009 126.7772 52.9030 41.9643 175.7815 70 S 4.6294 9.1194 122.2470 58.2550 64.3055 174.1506 71 G 4.0925 9.2668 113.9097 44.7122 0.0000 175.4793 72 S 4.2385 9.3925 115.2239 60.5611 63.7802 173.2165 73 V 5.1001 7.5434 111.2401 59.6129 35.8183 174.8821 74 S 5.3063 9.2823 118.1214 56.9744 66.8155 172.9855 75 N 5.3752 9.1677 118.7713 51.5730 42.3261 173.3499 76 Y 4.4835 8.8863 125.8646 57.5808 40.3670 174.3266 77 I 4.3578 7.2575 126.7415 59.0905 41.1632 174.1150 78 L 4.7138 8.8563 128.3349 53.5388 44.3493 176.6494 79 S 4.6147 8.8552 119.0218 58.3272 64.9768 174.6957 80 E 4.0898 8.2496 120.2366 56.3951 30.2552 177.3803 81 I 3.7522 8.4992 125.2073 64.4401 37.4067 178.4276 82 K 3.9801 8.0191 119.6347 59.2800 32.1656 176.9374 83 P 4.4184 0.0000 0.0000 65.3626 31.1328 178.4307 84 L 4.0806 8.1527 119.4212 58.3580 42.0779 178.3621 85 H 4.0678 8.5545 118.4219 59.3858 29.5889 176.6958 86 N 4.4169 8.4144 118.7722 56.5826 38.7718 176.6092 87 F 4.4151 8.6440 122.1708 61.5848 39.5285 177.2548 88 L 3.5506 8.3093 118.8735 57.6258 41.0703 179.5635 89 T 3.7422 7.5544 115.2305 66.9213 68.4997 176.2438 90 Q 4.1465 7.5154 118.2626 58.4946 29.0403 178.0763 91 L 3.9801 7.6014 121.6639 57.8700 42.1704 178.3201 92 Q 3.8028 8.0452 119.9341 59.1225 28.6308 177.2296 93 P 4.0381 0.0000 0.0000 64.5146 31.3067 176.8987 94 F 4.7770 7.4578 114.2254 57.2984 39.8619 176.1812 95 L 4.3132 7.4503 121.1385 54.4422 42.0733 176.7926 96 K 4.4579 9.5931 121.0060 56.9067 34.4578 177.4093 97 L 4.4097 8.3695 116.6494 55.3730 42.8767 177.3046 98 K 5.2469 8.0179 115.5479 55.2334 32.8924 177.6785 99 Q 3.9088 8.1109 122.8332 59.3198 28.7772 178.5155 100 K 3.9307 7.9189 118.9848 59.4102 32.2210 179.2048 101 Q 3.9659 8.0359 117.6556 58.8463 28.7366 178.4340 102 A 3.9898 8.1092 121.7610 55.4782 18.3855 179.5425 103 N 4.2716 8.3583 115.0372 56.2161 38.4720 177.7218 104 L 3.8331 8.2552 120.9955 57.5840 41.6019 179.5574 105 V 3.6240 8.0403 118.3912 66.0778 31.4361 177.8443 106 L 3.9724 7.9098 118.5511 57.9019 41.6233 179.5479 107 K 4.0440 8.1660 119.3598 59.5052 31.8308 178.8989 108 I 4.1272 7.9120 119.2358 64.5417 37.3780 178.0237 109 I 3.9490 8.1362 120.8883 64.7427 36.8013 178.2918 110 E 4.0868 8.2888 117.7915 59.1863 29.6001 178.5459 111 Q 4.5039 8.0178 115.5895 55.9571 28.8380 177.5658 112 L 4.0773 7.7134 121.5603 57.3872 41.8906 177.0229 113 P 4.4849 0.0000 0.0000 65.9059 31.2489 178.8615 114 S 4.2169 8.1668 111.7227 61.1004 62.7835 176.0280 115 A 4.1051 7.9202 124.0117 54.7014 18.2127 178.8682 116 K 4.4259 7.8694 114.8225 57.5708 32.4766 177.3393 117 E 4.6152 7.8127 118.0291 56.4690 30.8372 176.5521 118 S 4.6959 7.7664 112.7817 55.5765 66.2560 173.0219 119 P 2.9822 0.0000 0.0000 65.3577 31.3384 178.5518 120 D 4.2018 7.8237 118.6077 56.9963 40.8224 178.3601 121 K 3.8296 8.0360 120.2162 59.2673 32.1342 178.6003 122 F 4.0016 8.1149 121.0276 61.2407 39.2489 176.9202 123 L 3.6944 7.9233 118.6955 57.7705 41.2906 179.2106 124 E 3.6123 7.6496 118.6334 59.1466 29.3965 179.0204 125 V 2.0885 7.0350 118.1034 65.6362 31.4614 177.6461 126 C 3.8052 7.5644 116.8986 62.9082 27.8191 176.2727 127 T 4.0677 7.4791 111.3704 64.5105 68.3602 176.7925 128 W 4.4272 7.5619 121.9850 59.3870 28.9827 178.6931 129 V 3.6098 7.5348 118.5136 66.0637 31.0260 177.5491 130 D 4.3933 8.0430 118.6484 57.7295 40.7148 178.9240 131 Q 4.0441 8.1132 118.1822 59.1273 28.6423 179.2257 132 I 3.6872 7.9101 120.3438 64.3478 36.9592 178.1992 133 A 3.9638 7.8401 119.9812 55.2915 18.2557 179.1999 134 A 4.0833 8.2952 118.4092 55.2721 18.4886 179.5867 135 L 4.0965 7.7996 116.6895 57.0473 41.9329 177.7690 136 N 4.5456 7.7197 114.9227 53.4155 39.4633 175.5122 137 D 4.6340 8.1140 120.7973 53.2004 39.4130 176.4168 138 S 4.3284 7.6363 114.7177 58.1931 63.4843 173.7807 139 K 4.6853 8.4796 123.1684 56.0528 34.6241 176.7235 140 T 4.6601 7.7117 107.6263 60.9800 69.4617 173.7683 141 R 4.1302 8.0881 121.5712 57.0268 30.8570 174.8162 142 K 4.3804 8.6188 121.7473 58.1309 34.3451 176.4426 143 T 4.3417 7.7652 114.5840 62.7307 69.4747 174.7245 144 T 4.7201 8.4832 116.8029 59.0728 73.3193 174.9162 145 S 4.0720 8.7495 115.3115 61.4207 62.4633 176.3675 146 E 4.1179 7.8653 121.4658 59.1635 28.9627 178.6514 147 T 4.0306 7.9202 115.5833 66.7348 68.5562 176.3456 148 V 3.4989 7.6193 119.2715 66.2386 31.6479 178.0368 149 R 4.0619 8.4299 118.4938 58.8058 30.1021 176.5057 150 A 4.6321 7.5310 121.5934 52.2831 17.8915 178.3324 151 V 4.0153 8.3846 114.8037 63.1368 32.6715 178.5378 152 L 4.4803 7.5609 122.3483 54.4801 40.2136 176.8717 153 D 4.3863 8.6188 123.5292 54.6787 41.8542 176.0550 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 N 8.42 4.72 0.00 2.73 3.02 0.00 0.00 6.94 6.65 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 3 T 8.21 3.46 3.58 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 0.79 0.00 0.00 4 K 9.02 4.39 0.00 1.63 1.63 0.00 1.86 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.52 7.81 5 Y 9.11 4.67 0.00 3.17 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 6 N 8.83 4.36 0.00 2.80 2.83 0.00 0.00 6.73 6.83 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 7 K 8.86 3.84 0.00 1.91 1.81 0.00 1.86 0.00 0.00 1.84 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.31 7.81 8 E 8.23 3.91 0.00 2.25 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 2.38 2.36 0.00 9 F 8.92 4.22 0.00 3.12 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 10 L 8.15 3.73 0.00 1.66 1.71 1.24 0.46 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 11 L 7.68 3.56 0.00 1.60 1.56 0.73 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.81 3.91 0.00 3.14 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 13 L 8.27 3.90 0.00 1.25 1.27 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.31 4.00 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 15 G 7.71 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 0.00 0.00 0.00 16 F 7.97 3.84 0.00 2.79 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 17 V 8.65 3.60 2.27 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 1.21 0.00 0.00 1.41 0.00 0.00 18 D 8.30 4.48 0.00 2.83 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 19 G 7.75 3.58 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 0.00 0.00 0.00 20 D 8.19 4.72 0.00 1.85 2.57 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 21 G 7.37 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 0.00 0.00 0.00 22 S 8.80 4.67 0.00 3.76 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 23 I 8.54 4.97 1.94 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 1.70 0.98 1.00 0.00 0.00 24 I 9.02 4.69 1.88 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 1.15 0.77 0.91 0.00 0.00 25 A 8.66 5.21 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 26 Q 9.33 4.60 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 I 8.36 4.82 1.84 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.48 0.90 0.00 0.00 28 E 9.08 4.69 0.00 1.96 1.71 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 2.18 2.25 0.00 29 P 0.00 4.68 0.00 1.98 1.93 0.00 3.79 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 2.05 2.15 0.00 30 N 8.87 4.63 0.00 2.80 2.95 0.00 0.00 7.04 6.58 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 31 Q 9.14 4.13 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 32 S 8.50 4.28 0.00 3.75 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 33 Y 7.76 4.40 0.00 3.09 2.86 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 34 K 8.68 3.51 0.00 1.36 1.15 0.00 1.43 0.00 0.00 1.24 0.00 0.00 2.57 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 1.00 7.81 35 F 7.42 4.77 0.00 2.35 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 36 K 8.74 4.11 0.00 1.95 1.87 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.57 7.81 37 H 7.71 5.35 0.00 3.41 3.29 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.81 4.42 0.00 0.67 0.99 0.00 3.11 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.42 0.00 39 L 8.47 5.06 0.00 1.61 1.57 0.79 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 40 K 9.28 4.68 0.00 1.74 1.61 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.41 7.81 41 L 8.65 5.38 0.00 1.59 1.59 1.00 0.88 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 42 T 9.04 4.86 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 1.17 0.00 0.00 43 F 9.35 5.30 0.00 3.29 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 44 K 8.16 4.83 0.00 1.65 1.38 0.00 1.54 0.00 0.00 1.50 0.00 0.00 2.68 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.17 1.23 7.81 45 V 8.55 4.53 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 1.19 0.00 0.00 0.80 0.00 0.00 46 T 8.24 5.05 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 1.19 0.00 0.00 47 Q 9.07 4.60 0.00 2.23 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.87 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 48 K 8.94 4.14 0.00 1.88 1.71 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.53 7.81 49 T 8.90 4.00 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 1.34 0.00 0.00 50 Q 8.29 4.02 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.48 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 51 R 8.24 4.65 0.00 1.76 1.53 0.00 3.04 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 52 R 8.21 3.92 0.00 2.10 2.04 0.00 3.16 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 53 W 8.23 4.49 0.00 3.65 3.36 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 54 F 7.29 3.50 0.00 1.51 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 55 L 7.63 3.91 0.00 1.91 1.78 1.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.66 4.45 0.00 2.90 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.36 3.96 0.00 1.78 1.78 0.00 1.91 0.00 0.00 2.20 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.91 7.81 58 L 7.37 3.72 0.00 1.66 0.99 0.44 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.62 3.75 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 1.21 0.00 0.00 1.17 0.00 0.00 60 D 7.57 4.33 0.00 2.68 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 61 E 8.12 3.93 0.00 1.84 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 2.10 2.31 0.00 62 I 8.25 3.94 1.80 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.46 0.62 0.00 0.00 63 G 10.04 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 64 V 7.39 4.38 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.01 0.00 0.00 65 G 10.65 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 0.00 0.00 0.00 66 Y 7.14 4.89 0.00 3.04 3.03 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 67 V 8.52 4.79 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 0.90 0.00 0.00 1.12 0.00 0.00 68 S 9.07 4.84 0.00 4.10 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 69 D 8.80 5.04 0.00 2.74 2.59 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 70 S 9.12 4.63 0.00 3.99 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 71 G 9.27 4.09 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 72 S 9.39 4.24 0.00 3.87 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 73 V 7.54 5.10 2.20 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 0.70 0.00 0.00 0.93 0.00 0.00 74 S 9.28 5.31 0.00 3.71 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 75 N 9.17 5.38 0.00 2.55 2.56 0.00 0.00 6.95 7.49 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 76 Y 8.89 4.48 0.00 3.08 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 77 I 7.26 4.36 0.64 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.53 0.66 0.00 0.00 78 L 8.86 4.71 0.00 1.70 1.69 0.97 0.57 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 79 S 8.86 4.61 0.00 3.88 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 80 E 8.25 4.09 0.00 2.12 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 2.47 2.49 0.00 81 I 8.50 3.75 1.94 0.00 0.00 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 1.59 0.96 0.99 0.00 0.00 82 K 8.02 3.98 0.00 1.86 1.85 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.57 7.81 83 P 0.00 4.42 0.00 2.30 2.20 0.00 3.79 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 2.19 2.22 0.00 84 L 8.15 4.08 0.00 2.01 2.01 1.17 0.93 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 85 H 8.55 4.07 0.00 3.38 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.41 4.42 0.00 3.01 3.11 0.00 0.00 6.91 7.13 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 87 F 8.64 4.42 0.00 3.24 3.24 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 88 L 8.31 3.55 0.00 1.62 1.57 0.97 0.44 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 89 T 7.55 3.74 4.44 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 1.19 0.00 0.00 90 Q 7.52 4.15 0.00 2.25 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 91 L 7.60 3.98 0.00 0.88 1.10 0.75 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.05 3.80 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.73 0.00 93 P 0.00 4.04 0.00 0.73 1.60 0.00 3.56 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 94 F 7.46 4.78 0.00 3.13 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 95 L 7.45 4.31 0.00 1.75 1.62 0.89 0.78 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 96 K 9.59 4.46 0.00 1.73 1.79 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.37 7.81 97 L 8.37 4.41 0.00 1.76 1.68 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.02 5.25 0.00 1.82 1.78 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.34 1.28 7.81 99 Q 8.11 3.91 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.12 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 100 K 7.92 3.93 0.00 1.81 1.80 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.49 7.81 101 Q 8.04 3.97 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 102 A 8.11 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 0.00 103 N 8.36 4.27 0.00 2.66 2.78 0.00 0.00 7.08 7.16 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 0.00 104 L 8.26 3.83 0.00 1.79 1.73 0.94 0.54 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 0.00 105 V 8.04 3.62 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 1.19 0.00 0.00 1.04 0.00 0.00 106 L 7.91 3.97 0.00 1.86 1.66 0.86 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.17 4.04 0.00 1.71 1.74 0.00 0.98 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.67 1.07 7.81 108 I 7.91 4.13 2.16 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.15 1.00 0.00 0.00 109 I 8.14 3.95 2.15 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 1.62 0.73 1.00 0.00 0.00 110 E 8.29 4.09 0.00 2.16 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 2.39 2.43 0.00 111 Q 8.02 4.50 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.86 3.06 0.00 112 L 7.71 4.08 0.00 1.78 1.82 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.48 0.00 2.20 2.15 0.00 3.74 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 2.16 2.21 0.00 114 S 8.17 4.22 0.00 4.09 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.92 4.11 1.52 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 0.00 0.00 116 K 7.87 4.43 0.00 1.77 1.92 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.23 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.83 1.70 7.81 117 E 7.81 4.62 0.00 1.96 2.03 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 2.30 2.47 0.00 118 S 7.77 4.70 0.00 3.88 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 0.00 119 P 0.00 2.98 0.00 2.07 1.85 0.00 3.76 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 120 D 7.82 4.20 0.00 2.66 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 0.00 121 K 8.04 3.83 0.00 1.85 1.92 0.00 1.36 0.00 0.00 1.39 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.60 7.81 122 F 8.11 4.00 0.00 3.13 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 0.00 123 L 7.92 3.69 0.00 1.87 1.55 0.85 0.95 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 0.00 124 E 7.65 3.61 0.00 1.96 1.68 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 1.77 2.22 0.00 125 V 7.03 2.09 1.73 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 0.77 0.00 0.00 0.39 0.00 0.00 126 C 7.56 3.81 0.00 2.86 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 0.00 127 T 7.48 4.07 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 1.12 0.00 0.00 128 W 7.56 4.43 0.00 3.46 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 0.00 129 V 7.53 3.61 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 1.02 0.00 0.00 0.93 0.00 0.00 130 D 8.04 4.39 0.00 2.96 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 0.00 131 Q 8.11 4.04 0.00 2.38 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.67 0.00 132 I 7.91 3.69 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.88 0.93 0.00 0.00 133 A 7.84 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 0.00 134 A 8.30 4.08 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 0.00 135 L 7.80 4.10 0.00 1.80 1.73 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 136 N 7.72 4.55 0.00 2.83 2.76 0.00 0.00 7.08 8.68 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 0.00 137 D 8.11 4.63 0.00 2.64 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 0.00 138 S 7.64 4.33 0.00 3.91 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 0.00 139 K 8.48 4.69 0.00 1.70 1.74 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.58 7.81 140 T 7.71 4.66 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 0.00 141 R 8.09 4.13 0.00 1.79 1.86 0.00 3.17 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 1.60 1.64 0.00 142 K 8.62 4.38 0.00 1.75 1.80 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.41 7.81 143 T 7.77 4.34 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 1.25 0.00 0.00 144 T 8.48 4.72 4.22 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 1.26 0.00 0.00 145 S 8.75 4.07 0.00 3.95 4.15 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 0.00 146 E 7.87 4.12 0.00 1.99 2.03 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 2.32 2.47 0.00 147 T 7.92 4.03 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 1.27 0.00 0.00 148 V 7.62 3.50 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 1.02 0.00 0.00 0.75 0.00 0.00 149 R 8.43 4.06 0.00 1.97 2.07 0.00 3.11 0.00 0.00 3.33 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 150 A 7.53 4.63 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 0.00 151 V 8.38 4.02 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 0.80 0.00 0.00 1.00 0.00 0.00 152 L 7.56 4.48 0.00 1.78 1.68 0.95 0.79 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 0.00 153 D 8.62 4.39 0.00 2.57 2.50 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