NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0257 8.0544 120.3124 62.0498 31.8382 173.3366 2 H 4.3477 8.3331 124.2237 54.0429 31.6139 171.4222 3 L 3.6715 7.5445 130.0404 54.4330 39.3039 174.0681 4 T 3.8577 8.5653 112.7366 60.8899 69.9350 175.8941 5 A 3.8880 8.7509 125.1135 55.8079 18.2017 179.8655 6 E 3.8778 8.0974 116.9157 59.4294 29.7433 178.7417 7 E 3.9136 8.2544 118.7414 59.2982 29.4660 179.4010 8 K 3.8510 7.9316 118.0121 59.6306 32.1459 179.3965 9 S 4.1193 7.9631 114.9767 61.4299 62.5701 176.7370 10 L 3.9837 7.9015 121.7627 57.7090 41.3879 179.6918 11 V 3.2511 7.7926 118.0970 66.1839 31.3235 178.3006 12 S 4.3515 8.3010 115.0855 61.3937 62.4138 176.9520 13 G 3.6978 8.0063 107.6961 47.8263 0.0000 175.2339 14 L 3.9766 7.8316 123.1882 57.4578 42.2230 178.7548 15 W 4.3542 8.6747 128.3279 60.1763 30.3650 177.8527 16 G 3.8096 7.9362 104.4975 46.4482 0.0000 174.1452 17 K 4.4535 7.7851 118.5958 55.9838 32.8498 176.5801 18 V 3.6422 7.1127 120.1209 62.4587 31.8485 176.0714 19 N 4.5544 8.4255 125.9985 52.3048 37.3887 175.5927 20 V 3.6536 7.9779 128.4273 64.1464 31.3458 177.7283 21 D 4.5336 7.8370 119.6215 56.6606 40.9396 177.7592 22 E 4.2588 8.0023 118.2169 58.6800 30.2039 178.3170 23 V 3.5751 7.6245 118.3693 66.1135 31.4364 178.2666 24 G 3.7345 7.6144 102.4378 47.8994 0.0000 175.9910 25 G 3.6478 8.0148 107.9554 47.2464 0.0000 175.3509 26 E 3.8966 8.2975 121.4820 58.9798 29.6507 178.8276 27 A 3.9442 8.1581 120.9904 55.0497 18.4832 179.4279 28 L 3.9775 8.0466 119.1192 58.0352 42.2681 179.2861 29 G 3.5878 8.2045 105.8179 48.0765 0.0000 175.9111 30 R 3.9117 7.9435 120.9294 58.4642 30.0127 178.8910 31 L 4.0446 7.8888 120.2724 58.3493 41.9130 179.1335 32 L 3.9551 7.6108 117.4064 57.5637 41.5071 179.4465 33 I 3.8366 7.1527 118.5732 64.3403 37.3484 178.3054 34 V 3.5380 7.8323 117.9365 64.2866 32.7128 175.5623 35 Y 4.0179 7.2362 116.3918 53.7363 38.0330 173.7171 36 P 4.1732 0.0000 0.0000 65.3908 31.8098 177.5996 37 W 4.3755 8.0324 114.8582 59.3626 28.2449 178.1951 38 T 4.3520 7.4469 110.7027 64.5609 68.0219 176.3609 39 Q 4.2726 8.0819 121.0005 58.6501 28.3967 178.5920 40 R 3.8097 7.6909 116.5770 59.1563 29.3266 178.3749 41 F 4.2567 7.6529 116.0700 58.2637 39.5260 175.6085 42 F 4.6705 8.1487 118.9101 56.4054 39.3463 177.0592 43 D 4.3902 8.3836 122.3758 57.5857 41.2127 177.4861 44 S 4.5653 8.1756 109.8320 59.2620 63.1797 174.3005 45 F 4.4728 8.5321 119.5211 57.8770 39.8994 176.9460 46 G 3.9090 7.5647 106.7099 44.2412 0.0000 173.6022 47 D 4.4322 8.6113 123.8987 54.6461 40.8896 176.2694 48 L 4.7846 8.3603 125.0862 53.7949 43.9176 178.4953 49 S 3.9401 8.2570 113.6841 60.9730 62.9011 175.0415 50 T 4.6935 7.2748 109.4657 58.3555 72.6565 173.0582 51 P 4.2235 0.0000 0.0000 65.8667 31.2698 178.7345 52 D 4.3101 8.0550 116.8929 57.2684 40.6049 178.4531 53 A 3.9862 7.5681 119.5548 55.1554 18.5484 179.5704 54 V 3.6879 7.8125 116.6470 66.4771 31.4956 177.9756 55 M 4.2602 8.1188 116.2704 56.7448 31.9283 176.9936 56 S 4.5546 7.4804 111.6496 57.5996 64.1640 174.1641 57 N 4.3946 7.9729 121.2292 53.5791 39.3416 174.8546 58 A 4.0118 8.6768 130.8396 55.3560 18.4409 179.2053 59 K 3.7617 8.0862 116.5930 59.2471 31.9418 179.8091 60 V 3.8095 8.0071 118.1850 66.0409 31.5113 178.1102 61 K 3.9867 7.9122 117.8689 59.3851 32.0194 179.3056 62 A 3.9961 8.0998 121.0406 55.5044 18.3709 179.2465 63 H 4.4591 8.8265 117.3694 59.2321 29.9216 177.6248 64 G 3.7295 8.4258 107.8042 47.7892 0.0000 175.5384 65 K 4.0117 7.9936 121.6184 59.1600 32.1701 179.1276 66 K 4.0743 7.6784 117.7277 59.2746 31.8583 179.5389 67 V 3.7111 7.9642 118.6654 65.8925 31.4648 177.8922 68 L 4.3494 8.3688 120.3008 58.3289 42.0887 178.6527 69 N 4.5114 8.4426 116.5485 56.5059 38.4917 177.4602 70 S 4.3062 8.1214 116.0673 61.7254 62.9453 176.7959 71 F 4.2063 8.3176 120.3513 60.8220 38.7082 177.9218 72 S 4.2606 8.4637 114.7345 61.6591 62.4432 176.5889 73 D 4.5468 8.1244 121.6455 57.2197 40.3525 178.9987 74 G 3.7631 7.9374 105.3183 47.6363 0.0000 175.5378 75 L 4.0720 7.8586 120.3854 57.2047 41.6256 179.0533 76 K 4.2215 7.5552 116.2105 57.4492 33.0708 176.9724 77 N 5.0793 7.6573 117.0598 52.0463 39.0231 176.3362 78 L 4.0339 7.9741 119.0901 57.9189 42.1192 178.5322 79 D 4.6829 7.9536 115.3247 54.7044 41.7921 175.6773 80 N 5.0840 8.2352 118.4454 51.6137 39.3982 175.6481 81 L 4.1706 8.1011 121.0725 57.8770 41.9183 178.9328 82 K 4.0296 8.2598 117.1726 59.8432 32.4637 178.9931 83 G 3.6907 8.0476 105.5783 48.1297 0.0000 175.6874 84 T 3.7467 7.5970 117.0618 65.6167 68.6078 175.6284 85 F 4.6571 8.0883 116.7706 56.9227 39.3756 177.2370 86 A 3.9789 7.6530 122.8284 55.4481 18.2774 180.5936 87 K 3.9221 7.9163 116.2905 59.6440 32.2196 179.5446 88 L 4.1169 7.8672 118.7185 57.4003 41.5779 179.3227 89 S 4.1182 8.3766 113.9301 61.3204 62.3812 175.7141 90 E 3.8199 8.0668 122.0070 59.1437 29.2433 178.2377 91 L 3.8492 7.7891 119.9875 58.8329 42.1120 178.7880 92 H 4.0963 8.3742 115.8381 58.6681 28.4467 177.5904 93 C 4.2769 7.9036 119.7098 61.7712 28.0540 175.6908 94 D 4.3008 8.1279 119.2294 57.3272 40.7672 178.2706 95 K 4.1568 7.8248 117.2500 58.6469 32.5808 178.3027 96 L 4.2747 8.0832 117.6680 54.9496 42.5368 176.2718 97 H 4.2350 7.4279 114.3031 56.6597 26.5798 175.1991 98 V 3.9331 7.9445 118.2452 61.3953 32.6315 174.9501 99 D 4.2342 8.5405 126.9427 53.4330 41.9162 174.9752 100 P 3.1398 0.0000 0.0000 65.4186 31.2370 178.2650 101 E 3.9015 7.8965 118.1460 59.4380 29.3970 178.6570 102 N 4.4540 7.9943 116.1101 55.6628 38.5225 177.4284 103 F 4.5357 7.9785 120.2588 60.6052 38.9546 177.7751 104 K 4.1207 8.1054 117.6990 59.2875 31.9175 179.3190 105 L 3.8768 7.6899 118.9576 57.6751 41.5285 179.2915 106 L 4.1599 8.1706 120.4547 57.9984 42.0770 179.1594 107 G 3.7788 8.2968 105.7576 48.0654 0.0000 175.4187 108 N 4.4531 8.4396 119.2500 56.1697 38.5150 178.0335 109 V 3.7549 8.0963 113.7570 63.9592 31.6017 178.3814 110 L 3.8680 8.0156 120.5167 58.0801 41.8896 179.1574 111 V 3.5304 7.7536 118.0802 66.2556 31.4901 177.8370 112 C 4.1441 7.9893 116.4501 62.7145 27.9023 176.2935 113 V 3.5389 7.9415 120.1051 65.8064 30.9884 178.1664 114 L 3.8600 7.7578 118.6196 57.4796 41.3493 179.3032 115 A 3.6138 7.2931 120.7397 55.2385 18.0879 179.0948 116 H 4.0919 7.9304 115.6211 59.8092 29.9872 176.8132 117 H 4.0881 7.9633 116.7773 57.7090 29.0809 176.8269 118 F 4.5530 8.4633 118.2920 55.6300 39.9003 177.3526 119 G 3.8725 8.7095 107.8370 46.8733 0.0000 176.9682 120 K 4.3194 8.8670 124.1179 57.4569 32.0613 177.3240 121 E 4.1048 8.1049 119.4378 58.4743 30.1088 177.1187 122 F 4.5868 7.9103 123.1732 57.0004 37.8568 174.9703 123 T 4.1895 7.3306 115.9345 60.4308 71.3882 173.4995 124 P 4.2214 0.0000 0.0000 65.7154 31.1048 179.1135 125 Q 3.9109 7.8652 116.5394 58.8546 28.7497 178.6022 126 V 3.5237 7.4882 118.9506 65.8851 31.5559 177.7883 127 Q 3.5329 7.8654 119.4661 58.9853 28.7676 178.0446 128 A 4.0066 7.8989 121.5275 55.1307 18.4756 179.4879 129 A 3.8621 7.7744 118.8037 55.6552 18.4158 179.5794 130 Y 3.9228 8.0543 115.2342 61.1701 37.9543 178.7017 131 Q 4.0950 8.7981 119.6013 58.7949 28.7688 179.0217 132 K 3.9768 7.9277 119.3433 59.3338 32.0493 179.5461 133 V 3.5296 7.5714 118.0232 66.1113 31.5388 178.2816 134 V 3.7359 8.1842 117.9369 65.9878 31.3387 177.8586 135 A 4.1796 8.1955 120.7072 54.7825 18.2070 179.9011 136 G 3.4822 8.0512 104.5013 47.9274 0.0000 176.2049 137 V 2.9891 7.9091 120.8229 65.3318 31.5530 177.9010 138 A 3.7851 7.7689 120.4203 54.9933 17.9668 179.0763 139 N 4.2359 7.8906 114.2442 56.9657 39.2663 176.6500 140 A 4.1463 7.9040 122.0498 55.2072 18.2021 179.5986 141 L 3.7250 7.6105 116.4200 57.0215 41.8553 178.5118 142 A 4.8133 7.7495 118.8718 52.5649 18.9056 178.2617 143 H 3.8650 7.7500 118.7039 59.3042 29.9809 177.3089 144 K 4.2472 8.1827 113.8174 57.3304 31.1741 176.9313 145 Y 4.7847 8.0483 116.1477 57.8493 39.7696 175.7094 146 H 4.6699 8.5331 122.6437 55.8771 28.9531 174.6430 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 4.03 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 0.88 0.00 0.00 0.96 0.00 0.00 2 H 8.33 4.35 0.00 3.19 3.23 0.00 5.89 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 3 L 7.54 3.67 0.00 1.72 1.60 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.57 3.86 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 5 A 8.75 3.89 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 6 E 8.10 3.88 0.00 2.03 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 2.35 2.38 0.00 7 E 8.25 3.91 0.00 2.22 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 8 K 7.93 3.85 0.00 1.91 1.81 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.60 7.81 9 S 7.96 4.12 0.00 4.02 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 10 L 7.90 3.98 0.00 1.91 1.68 0.91 0.81 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 11 V 7.79 3.25 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 0.56 0.00 0.00 0.46 0.00 0.00 12 S 8.30 4.35 0.00 3.92 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 13 G 8.01 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 14 L 7.83 3.98 0.00 1.96 1.89 0.56 0.07 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 15 W 8.67 4.35 0.00 3.74 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 16 G 7.94 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 17 K 7.79 4.45 0.00 2.07 2.06 0.00 1.95 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.39 7.81 18 V 7.11 3.64 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 0.04 0.00 0.00 0.49 0.00 0.00 19 N 8.43 4.55 0.00 2.80 2.63 0.00 0.00 6.96 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 7.98 3.65 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 0.82 0.00 0.00 0.99 0.00 0.00 21 D 7.84 4.53 0.00 2.77 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 22 E 8.00 4.26 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 23 V 7.62 3.58 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 0.88 0.00 0.00 0.78 0.00 0.00 24 G 7.61 3.73 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 0.00 0.00 0.00 25 G 8.01 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 26 E 8.30 3.90 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 27 A 8.16 3.94 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 28 L 8.05 3.98 0.00 1.94 1.63 0.86 0.70 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 29 G 8.20 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 0.00 0.00 0.00 30 R 7.94 3.91 0.00 1.85 1.93 0.00 3.07 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 31 L 7.89 4.04 0.00 1.92 1.85 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.61 3.96 0.00 1.73 1.64 0.62 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.15 3.84 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.57 0.83 0.00 0.00 34 V 7.83 3.54 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 -0.03 0.00 0.00 0.74 0.00 0.00 35 Y 7.24 4.02 0.00 2.55 1.43 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 36 P 0.00 4.17 0.00 2.25 2.15 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.24 0.00 37 W 8.03 4.38 0.00 3.60 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 38 T 7.45 4.35 4.48 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 1.05 0.00 0.00 39 Q 8.08 4.27 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 40 R 7.69 3.81 0.00 1.81 2.02 0.00 2.81 0.00 0.00 2.73 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.81 0.00 41 F 7.65 4.26 0.00 2.45 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 42 F 8.15 4.67 0.00 2.84 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 0.00 0.00 0.00 0.00 43 D 8.38 4.39 0.00 2.71 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 44 S 8.18 4.57 0.00 4.16 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 45 F 8.53 4.47 0.00 3.27 3.20 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 0.00 0.00 0.00 0.00 46 G 7.56 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 47 D 8.61 4.43 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.36 4.78 0.00 1.72 1.62 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.26 3.94 0.00 3.97 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 50 T 7.27 4.69 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 1.21 0.00 0.00 51 P 0.00 4.22 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 52 D 8.06 4.31 0.00 2.67 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 53 A 7.57 3.99 1.44 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 0.00 0.00 54 V 7.81 3.69 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 1.02 0.00 0.00 1.02 0.00 0.00 55 M 8.12 4.26 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 56 S 7.48 4.55 0.00 3.93 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 57 N 7.97 4.39 0.00 3.00 2.94 0.00 0.00 7.01 7.80 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 58 A 8.68 4.01 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 59 K 8.09 3.76 0.00 1.70 0.91 0.00 0.61 0.00 0.00 1.20 0.00 0.00 2.63 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.12 0.92 7.81 60 V 8.01 3.81 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 1.07 0.00 0.00 1.02 0.00 0.00 61 K 7.91 3.99 0.00 1.96 1.85 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.46 7.81 62 A 8.10 4.00 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 63 H 8.83 4.46 0.00 3.57 3.72 0.00 5.80 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 8.43 3.73 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 0.00 0.00 0.00 65 K 7.99 4.01 0.00 1.88 2.05 0.00 1.57 0.00 0.00 1.83 0.00 0.00 3.21 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.56 7.81 66 K 7.68 4.07 0.00 2.12 1.85 0.00 1.65 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.53 7.81 67 V 7.96 3.71 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 1.26 0.00 0.00 1.05 0.00 0.00 68 L 8.37 4.35 0.00 2.05 1.80 1.02 0.68 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 69 N 8.44 4.51 0.00 3.04 2.93 0.00 0.00 7.02 7.02 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 70 S 8.12 4.31 0.00 4.17 4.02 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 71 F 8.32 4.21 0.00 3.48 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 72 S 8.46 4.26 0.00 4.29 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 73 D 8.12 4.55 0.00 2.76 2.55 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 74 G 7.94 3.76 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 0.00 0.00 0.00 75 L 7.86 4.07 0.00 1.69 1.59 0.68 -0.47 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 76 K 7.56 4.22 0.00 1.76 1.86 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.78 1.64 7.81 77 N 7.66 5.08 0.00 2.63 2.71 0.00 0.00 6.85 7.32 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 78 L 7.97 4.03 0.00 1.59 1.71 0.86 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.95 4.68 0.00 2.65 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 80 N 8.24 5.08 0.00 2.73 2.63 0.00 0.00 7.16 6.28 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 81 L 8.10 4.17 0.00 1.82 1.79 1.14 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.26 4.03 0.00 1.75 1.93 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.59 1.60 7.81 83 G 8.05 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 0.00 0.00 0.00 84 T 7.60 3.75 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 0.61 0.00 0.00 85 F 8.09 4.66 0.00 3.10 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 86 A 7.65 3.98 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 87 K 7.92 3.92 0.00 1.77 1.85 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.49 7.81 88 L 7.87 4.12 0.00 1.78 1.79 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.38 4.12 0.00 4.04 4.02 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 90 E 8.07 3.82 0.00 2.05 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 2.26 2.36 0.00 91 L 7.79 3.85 0.00 1.81 1.84 0.89 0.95 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 92 H 8.37 4.10 0.00 3.44 3.68 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.90 4.28 0.00 2.66 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 0.00 0.00 0.00 94 D 8.13 4.30 0.00 2.82 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 95 K 7.82 4.16 0.00 1.80 1.85 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.38 7.81 96 L 8.08 4.27 0.00 1.78 1.69 0.69 1.39 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 7.43 4.24 0.00 3.40 3.47 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.94 3.93 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 0.27 0.00 0.00 0.22 0.00 0.00 99 D 8.54 4.23 0.00 2.75 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 0.00 100 P 0.00 3.14 0.00 2.00 2.09 0.00 3.26 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 101 E 7.90 3.90 0.00 1.93 1.87 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 2.26 2.38 0.00 102 N 7.99 4.45 0.00 2.73 2.84 0.00 0.00 6.91 7.99 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 0.00 103 F 7.98 4.54 0.00 3.11 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 0.00 104 K 8.11 4.12 0.00 1.97 1.88 0.00 1.68 0.00 0.00 1.84 0.00 0.00 3.18 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.60 7.81 105 L 7.69 3.88 0.00 1.66 1.18 0.62 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.17 4.16 0.00 1.89 1.81 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.30 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 0.00 0.00 0.00 108 N 8.44 4.45 0.00 2.98 2.96 0.00 0.00 7.09 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 0.00 109 V 8.10 3.75 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 0.97 0.00 0.00 1.00 0.00 0.00 110 L 8.02 3.87 0.00 1.91 1.74 0.30 0.65 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 0.00 111 V 7.75 3.53 2.34 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 1.25 0.00 0.00 1.13 0.00 0.00 112 C 7.99 4.14 0.00 3.20 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 0.00 113 V 7.94 3.54 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 0.86 0.00 0.00 0.91 0.00 0.00 114 L 7.76 3.86 0.00 1.13 1.09 0.47 0.54 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 0.00 115 A 7.29 3.61 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 0.00 116 H 7.93 4.09 0.00 3.21 3.45 0.00 5.77 0.00 0.00 0.00 0.00 7.06 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 4.09 0.00 2.71 2.56 0.00 5.71 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.46 4.55 0.00 3.26 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 0.00 119 G 8.71 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 0.00 120 K 8.87 4.32 0.00 1.81 1.92 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.40 7.81 121 E 8.10 4.10 0.00 2.25 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 0.00 2.39 2.33 0.00 122 F 7.91 4.59 0.00 3.10 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.33 4.19 4.31 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 1.32 0.00 0.00 124 P 0.00 4.22 0.00 2.15 2.12 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 125 Q 7.87 3.91 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 126 V 7.49 3.52 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 1.01 0.00 0.00 0.97 0.00 0.00 127 Q 7.87 3.53 0.00 1.56 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 128 A 7.90 4.01 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 0.00 129 A 7.77 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.05 3.92 0.00 3.28 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 0.00 131 Q 8.80 4.09 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 132 K 7.93 3.98 0.00 1.96 1.83 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.59 7.81 133 V 7.57 3.53 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 1.03 0.00 0.00 0.76 0.00 0.00 134 V 8.18 3.74 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 1.03 0.00 0.00 1.14 0.00 0.00 135 A 8.20 4.18 1.42 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 0.00 0.00 136 G 8.05 3.48 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 0.00 137 V 7.91 2.99 1.87 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 -0.05 0.00 0.00 0.80 0.00 0.00 138 A 7.77 3.79 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.89 4.24 0.00 3.04 2.87 0.00 0.00 7.22 8.06 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 0.00 140 A 7.90 4.15 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 0.00 141 L 7.61 3.72 0.00 1.12 0.47 -0.05 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.75 4.81 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 0.00 0.00 0.00 0.00 0.00 143 H 7.75 3.86 0.00 3.29 3.30 0.00 5.59 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.18 4.25 0.00 1.58 1.64 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.58 7.81 145 Y 8.05 4.78 0.00 3.24 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 0.00 146 H 8.53 4.67 0.00 3.16 3.15 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