NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4087 8.3044 120.3244 54.7362 33.4260 174.4904 2 K 3.9845 8.3238 122.3633 55.7903 33.0145 175.5701 3 K 4.0361 9.4979 127.2954 59.0200 33.2869 176.1764 4 H 4.8709 7.9519 112.6191 54.2878 31.7354 173.7181 5 G 4.0418 8.5822 107.1687 45.2507 0.0000 172.9459 6 I 3.7916 7.8434 118.1004 60.9704 38.4123 175.5979 7 L 4.0661 8.4152 127.8825 57.6329 42.5144 177.4935 8 N 4.4222 8.0618 118.0570 53.1464 39.7970 175.1949 9 S 4.0832 8.6609 123.7002 61.9960 62.9566 176.1781 10 H 4.2185 7.9754 119.3818 58.6076 28.4975 177.6747 11 L 4.0204 8.5747 120.6679 57.5806 41.3647 179.2544 12 A 4.0188 8.2105 120.8943 55.3132 18.0762 179.8674 13 K 3.9436 7.7011 115.2412 59.5471 32.0899 179.4689 14 I 3.8874 7.5113 120.1907 64.4225 37.0901 178.4904 15 L 3.9955 8.3683 120.0481 57.7357 41.2071 179.2428 16 A 4.0483 8.0181 119.8939 55.0998 18.3581 178.5695 17 D 4.6174 7.5896 114.1680 53.6982 41.6316 177.1043 18 L 4.1720 7.4321 121.0734 54.8796 42.2379 176.6282 19 G 4.1904 9.6687 112.1129 43.0181 0.0000 171.6300 20 H 4.2548 8.5436 119.1119 57.9505 29.8572 175.3537 21 T 3.4044 8.6235 116.2991 61.3711 68.3588 171.8203 22 D 4.5984 7.8526 122.6430 54.5570 42.2926 175.3820 23 K 5.2451 8.5683 120.0198 54.5995 35.9916 175.1138 24 I 4.9860 8.4235 115.9374 59.1171 41.3908 174.1668 25 V 4.8947 8.7102 123.2860 61.2900 34.6472 174.1207 26 I 4.9851 8.9148 127.7254 59.6393 39.6052 174.6051 27 A 5.3065 9.3668 128.3761 49.9839 22.7656 175.3835 28 D 4.8075 8.0037 115.8308 52.1433 41.0654 177.1556 29 A 3.8094 8.4621 121.3828 54.0162 18.2535 178.4867 30 G 3.8059 8.1163 103.5668 45.1190 0.0000 174.1681 31 L 4.0116 7.3441 122.7625 54.3950 42.4757 174.8763 32 P 4.4310 0.0000 0.0000 62.4529 32.2291 175.5034 33 V 4.2381 8.0082 120.3312 60.3872 33.0944 173.9760 34 P 4.4125 0.0000 0.0000 62.2895 31.9277 175.5531 35 D 4.5609 8.3737 121.5054 55.9867 41.2101 176.9415 36 G 3.9502 9.0611 111.8683 44.7947 0.0000 173.1913 37 V 4.1901 7.0496 119.4507 61.0044 32.7214 175.6100 38 L 4.0992 8.5865 130.1444 55.2338 43.2454 175.0658 39 K 4.9342 8.6458 126.9800 54.6947 34.4938 175.0118 40 I 4.3308 8.7045 128.4649 59.6462 39.4892 174.1878 41 D 4.9243 8.6766 128.0415 53.3941 41.2515 175.8208 42 L 4.7217 8.8007 126.3069 54.6410 42.9180 177.6604 43 S 4.4313 8.1193 113.8625 58.6724 63.4554 173.4227 44 L 4.5289 8.8838 123.8703 56.1700 43.7882 176.2618 45 K 4.3927 7.5711 114.5459 54.8407 34.8719 172.5029 46 P 3.9601 0.0000 0.0000 64.5892 31.1500 177.1480 47 G 3.9296 9.7080 112.3569 44.8715 0.0000 172.8675 48 L 4.7086 8.1309 119.8024 52.4594 44.9709 174.6103 49 P 4.9244 0.0000 0.0000 61.5591 33.5256 175.6160 50 A 4.5204 8.3463 122.7920 51.4504 19.7795 178.4659 51 F 4.1086 9.3240 121.9046 61.6204 39.4256 177.9543 52 Q 3.2135 7.9087 116.9808 58.8037 28.5274 178.3232 53 D 4.3344 7.8462 119.3227 57.6305 40.8898 178.9299 54 T 3.8425 7.9054 115.9588 66.5979 68.4888 176.7455 55 A 3.9612 8.0225 122.7618 54.9578 18.0881 179.5717 56 A 3.9099 7.9569 118.5603 55.2644 18.6551 179.7249 57 V 3.6893 7.6397 116.2568 66.2399 31.6331 178.2866 58 L 4.0298 8.0178 118.5214 57.7488 41.2059 179.3912 59 A 4.1942 7.9501 119.9892 54.7703 18.3440 178.6597 60 E 4.1654 7.8047 116.5022 57.5708 30.0517 176.6633 61 E 4.5870 7.9955 116.1429 56.1785 31.2487 174.8543 62 M 4.6647 7.9399 117.9762 53.2211 35.2624 174.6580 63 A 4.2915 8.4926 127.2016 51.6119 19.3719 176.0605 64 V 4.3453 8.3137 122.0650 62.7821 32.0242 175.1580 65 E 4.4311 8.9738 129.2212 57.5922 30.9159 175.8141 66 K 4.6806 7.5762 118.2833 55.0644 35.9690 174.5272 67 V 4.6782 8.8854 125.7729 61.0416 34.8606 174.2178 68 I 5.0897 8.6600 126.8806 59.5951 40.7961 174.4166 69 A 4.9185 8.6327 126.8451 50.0083 23.5354 174.6345 70 A 4.7077 7.9547 121.2647 51.2451 19.9129 178.4773 71 A 3.9930 9.3930 125.4499 55.6383 18.4202 180.0827 72 E 3.4770 8.0526 116.1444 59.4287 29.1296 179.3410 73 I 3.7144 7.6341 118.5552 63.7148 37.7246 177.9968 74 K 3.9805 8.0465 118.9919 58.7255 31.8441 178.9373 75 A 4.1211 7.5385 119.9659 54.8525 18.9838 178.9315 76 S 4.5870 7.6835 109.7748 58.4066 64.7195 174.7017 77 N 4.9769 7.9906 120.1738 51.1308 39.7840 175.1091 78 Q 4.0394 8.1516 121.1407 59.1733 29.3782 178.3799 79 E 3.9654 8.2067 119.6842 59.7725 29.6767 178.7248 80 N 4.5984 8.2014 115.4695 55.9919 38.6685 177.2498 81 A 4.1488 8.1496 122.5804 55.1358 18.4837 179.8580 82 K 3.9942 8.5068 117.3330 59.4070 32.0689 179.1082 83 F 4.1267 8.2365 120.6546 61.4379 39.3439 176.8435 84 L 4.0800 8.4929 119.7379 58.4051 41.6948 178.7279 85 E 4.0780 8.0466 117.1326 59.6375 29.4882 178.9105 86 N 4.4364 8.0266 115.3677 56.0855 38.7318 176.9789 87 L 3.6208 7.5859 121.0754 56.7709 42.7757 178.2355 88 F 4.9070 7.5914 117.7221 56.2564 36.9505 177.0761 89 S 4.1754 7.7670 117.1732 61.9786 63.2749 176.7633 90 E 4.1469 8.1106 116.8082 58.2703 29.6321 176.8956 91 Q 4.5356 7.4018 116.7608 54.4835 30.7569 175.1482 92 E 4.1946 8.5544 122.0615 56.1551 31.1420 175.3092 93 I 4.8126 8.3559 127.0777 59.6581 39.7077 174.1644 94 E 4.5626 9.0523 129.5389 54.7008 31.5492 174.0247 95 Y 5.2132 8.6184 124.1617 56.4693 39.9488 174.8053 96 L 5.1183 8.6602 123.1751 52.3201 46.6113 176.2181 97 S 4.5563 8.5290 114.0700 58.2812 63.9598 174.6611 98 H 4.1664 9.0897 121.5832 59.8401 29.2319 177.5810 99 E 4.0202 8.2378 119.7512 59.5179 29.4451 179.0477 100 E 4.0098 8.1552 118.4441 59.0608 29.2950 178.9264 101 F 4.0474 8.3360 120.2589 61.4634 39.7384 177.0634 102 K 4.0795 8.3288 117.9004 59.4461 31.6659 179.3339 103 L 3.9957 7.6784 119.1864 57.7523 41.6626 179.4810 104 L 4.0022 7.8137 118.6454 57.2649 41.5335 179.2549 105 T 3.8540 7.3770 109.2569 63.9302 68.4463 176.4784 106 K 4.0847 7.5906 120.8195 58.5010 32.1207 177.7019 107 D 4.6229 7.5878 116.7012 53.3362 41.6269 176.6677 108 A 4.2974 6.9615 122.9649 52.0696 18.9477 177.9216 109 K 4.2879 8.9895 120.2831 58.9839 32.8353 177.1187 110 A 4.6417 7.4447 118.7640 51.1199 22.7069 175.1807 111 V 4.6435 8.5131 119.5445 61.2051 34.6200 174.4370 112 I 4.7343 9.1227 129.8413 59.9647 38.8232 174.6649 113 R 4.7667 8.9207 129.1547 55.6315 31.5279 175.8109 114 T 4.9647 8.4816 117.1742 60.1008 71.8260 174.3132 115 G 4.1337 8.7764 107.2831 46.1728 0.0000 173.2847 116 E 4.4145 8.2301 122.9522 56.0157 30.5565 177.8662 117 F 5.0998 8.8038 128.5020 57.2946 39.6852 175.6603 118 T 4.6798 7.4809 108.6899 58.7533 71.8163 171.9854 119 P 3.8376 0.0000 0.0000 64.4924 31.7482 175.4319 120 Y 3.5494 7.6803 117.3406 59.0368 35.3206 171.6320 121 A 3.8814 7.2166 121.8988 50.9544 17.1277 176.9483 122 N 5.7501 7.0034 118.0506 51.3195 43.4593 174.9843 123 C 5.2268 9.2888 113.9168 57.7219 33.7392 172.5311 124 I 4.8429 9.2027 122.1343 59.7479 39.4713 174.4461 125 L 4.7947 8.7318 127.5124 53.1392 43.7024 175.1570 126 Q 4.8287 8.7305 126.1963 54.1803 30.7120 174.7133 127 A 4.3739 9.3004 129.5446 52.5968 19.5579 176.9377 128 G 4.6374 8.8017 110.2435 45.0285 0.0000 173.2211 129 V 4.4974 8.0689 112.3833 59.7275 35.2165 175.1631 130 L 4.5550 8.2621 121.3435 54.4398 41.7521 177.0413 131 F 4.4514 7.1576 119.8890 57.4556 37.2417 173.7836 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 M 8.30 4.41 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.32 3.98 0.00 1.78 1.69 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.51 7.81 3 K 9.50 4.04 0.00 1.45 1.48 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.38 7.81 4 H 7.95 4.87 0.00 3.12 3.17 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.58 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 7.84 3.79 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.97 0.00 0.00 7 L 8.42 4.07 0.00 1.63 1.67 0.92 0.96 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 8 N 8.06 4.42 0.00 2.80 2.70 0.00 0.00 6.96 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 9 S 8.66 4.08 0.00 4.03 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 10 H 7.98 4.22 0.00 3.35 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.57 4.02 0.00 1.84 1.74 0.94 1.14 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 12 A 8.21 4.02 1.39 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 13 K 7.70 3.94 0.00 1.93 1.90 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.70 7.81 14 I 7.51 3.89 2.04 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 1.76 1.07 0.92 0.00 0.00 15 L 8.37 4.00 0.00 1.81 1.73 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.02 4.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.59 4.62 0.00 2.66 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 18 L 7.43 4.17 0.00 1.76 1.62 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.67 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 0.00 0.00 0.00 0.00 20 H 8.54 4.25 0.00 3.02 3.21 0.00 5.79 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 21 T 8.62 3.40 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 0.87 0.00 0.00 22 D 7.85 4.60 0.00 2.72 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 23 K 8.57 5.25 0.00 1.60 1.59 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.50 7.81 24 I 8.42 4.99 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.75 0.91 0.00 0.00 25 V 8.71 4.89 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 1.14 0.00 0.00 0.86 0.00 0.00 26 I 8.91 4.99 2.09 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.93 0.99 0.00 0.00 27 A 9.37 5.31 1.27 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 0.00 0.00 0.00 28 D 8.00 4.81 0.00 3.02 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 29 A 8.46 3.81 1.19 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 0.00 0.00 30 G 8.12 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 31 L 7.34 4.01 0.00 1.50 1.64 1.08 1.12 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 32 P 0.00 4.43 0.00 2.22 2.03 0.00 3.84 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 2.00 1.96 0.00 33 V 8.01 4.24 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 0.87 0.00 0.00 0.94 0.00 0.00 34 P 0.00 4.41 0.00 2.19 1.93 0.00 3.64 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 35 D 8.37 4.56 0.00 2.66 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 9.06 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 37 V 7.05 4.19 2.19 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 0.74 0.00 0.00 0.91 0.00 0.00 38 L 8.59 4.10 0.00 1.81 1.68 0.91 0.59 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 39 K 8.65 4.93 0.00 1.78 1.65 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.44 7.81 40 I 8.70 4.33 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.56 0.94 0.00 0.00 41 D 8.68 4.92 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.80 4.72 0.00 1.68 1.71 0.95 1.17 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 43 S 8.12 4.43 0.00 4.09 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.88 4.53 0.00 1.54 1.67 0.92 0.55 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 45 K 7.57 4.39 0.00 1.85 1.81 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.35 1.37 7.81 46 P 0.00 3.96 0.00 1.57 0.62 0.00 3.47 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.24 0.00 47 G 9.71 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 0.00 0.00 0.00 48 L 8.13 4.71 0.00 1.67 1.55 0.91 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.92 0.00 2.09 1.96 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 50 A 8.35 4.52 1.22 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 0.00 0.00 51 F 9.32 4.11 0.00 3.17 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.91 3.21 0.00 1.71 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 1.16 2.24 0.00 53 D 7.85 4.33 0.00 2.82 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 54 T 7.91 3.84 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 1.21 0.00 0.00 55 A 8.02 3.96 1.19 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 0.00 0.00 56 A 7.96 3.91 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 57 V 7.64 3.69 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 1.03 0.00 0.00 1.04 0.00 0.00 58 L 8.02 4.03 0.00 1.77 1.77 0.95 1.02 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 59 A 7.95 4.19 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 60 E 7.80 4.17 0.00 1.89 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 61 E 8.00 4.59 0.00 2.03 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 2.21 0.00 62 M 7.94 4.66 0.00 2.13 1.90 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 2.51 2.47 0.00 63 A 8.49 4.29 1.27 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 0.00 0.00 0.00 64 V 8.31 4.35 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 0.54 0.00 0.00 1.05 0.00 0.00 65 E 8.97 4.43 0.00 2.00 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 0.00 2.23 2.23 0.00 66 K 7.58 4.68 0.00 1.78 1.49 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.49 7.81 67 V 8.89 4.68 1.81 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 0.72 0.00 0.00 -0.11 0.00 0.00 68 I 8.66 5.09 1.92 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 1.12 0.44 1.08 0.00 0.00 69 A 8.63 4.92 1.09 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 70 A 7.95 4.71 1.20 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 0.00 0.00 71 A 9.39 3.99 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 72 E 8.05 3.48 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.07 0.00 73 I 7.63 3.71 1.90 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.39 1.06 0.00 0.00 74 K 8.05 3.98 0.00 1.68 1.71 0.00 1.30 0.00 0.00 1.38 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.07 7.81 75 A 7.54 4.12 1.23 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 0.00 0.00 76 S 7.68 4.59 0.00 4.04 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 77 N 7.99 4.98 0.00 2.82 2.76 0.00 0.00 7.13 8.22 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 78 Q 8.15 4.04 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.65 0.00 0.00 0.00 0.00 0.00 2.64 2.42 0.00 79 E 8.21 3.97 0.00 2.06 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 2.42 2.45 0.00 80 N 8.20 4.60 0.00 2.74 2.87 0.00 0.00 6.89 7.12 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 81 A 8.15 4.15 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.51 3.99 0.00 2.05 1.94 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.66 7.81 83 F 8.24 4.13 0.00 3.26 3.47 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 84 L 8.49 4.08 0.00 2.33 2.02 1.45 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.05 4.08 0.00 2.24 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 0.00 2.69 2.61 0.00 86 N 8.03 4.44 0.00 2.68 2.76 0.00 0.00 7.02 7.47 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 87 L 7.59 3.62 0.00 0.51 0.79 0.51 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 88 F 7.59 4.91 0.00 3.19 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 89 S 7.77 4.18 0.00 3.84 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 90 E 8.11 4.15 0.00 1.99 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 2.32 2.33 0.00 91 Q 7.40 4.54 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 92 E 8.55 4.19 0.00 2.04 1.78 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 2.35 2.33 0.00 93 I 8.36 4.81 1.87 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 1.18 0.97 0.55 0.00 0.00 94 E 9.05 4.56 0.00 1.95 1.75 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 2.25 2.27 0.00 95 Y 8.62 5.21 0.00 2.89 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 96 L 8.66 5.12 0.00 1.70 1.61 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 97 S 8.53 4.56 0.00 4.03 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 98 H 9.09 4.17 0.00 3.51 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.24 4.02 0.00 2.06 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 2.47 2.39 0.00 100 E 8.16 4.01 0.00 2.15 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 2.36 2.48 0.00 101 F 8.34 4.05 0.00 3.09 3.32 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 0.00 102 K 8.33 4.08 0.00 2.00 1.84 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.57 7.81 103 L 7.68 4.00 0.00 1.82 1.69 0.92 0.54 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 0.00 104 L 7.81 4.00 0.00 1.58 1.54 0.86 0.53 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 0.00 105 T 7.38 3.85 4.14 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 0.93 0.00 0.00 106 K 7.59 4.08 0.00 1.74 1.88 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.58 7.81 107 D 7.59 4.62 0.00 2.73 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 6.96 4.30 1.22 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 0.00 0.00 109 K 8.99 4.29 0.00 1.59 1.87 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.53 7.81 110 A 7.44 4.64 1.19 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 0.00 0.00 111 V 8.51 4.64 2.10 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 1.09 0.00 0.00 0.93 0.00 0.00 112 I 9.12 4.73 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.54 0.95 0.00 0.00 113 R 8.92 4.77 0.00 1.92 1.82 0.00 3.08 0.00 0.00 3.62 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 114 T 8.48 4.96 4.53 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 1.34 0.00 0.00 115 G 8.78 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 0.00 0.00 0.00 116 E 8.23 4.41 0.00 2.24 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 2.31 2.46 0.00 117 F 8.80 5.10 0.00 2.91 3.04 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 0.00 118 T 7.48 4.68 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 1.27 0.00 0.00 119 P 0.00 3.84 0.00 2.11 1.76 0.00 3.81 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 120 Y 7.68 3.55 0.00 3.00 2.87 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 0.00 121 A 7.22 3.88 0.91 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 0.00 122 N 7.00 5.75 0.00 2.31 2.90 0.00 0.00 7.05 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 0.00 123 C 9.29 5.23 0.00 3.23 3.27 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 0.00 124 I 9.20 4.84 1.85 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.41 0.83 0.00 0.00 125 L 8.73 4.79 0.00 1.55 1.50 0.98 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.73 4.83 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.21 2.37 0.00 127 A 9.30 4.37 1.27 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 0.00 0.00 0.00 128 G 8.80 4.64 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 0.00 0.00 0.00 129 V 8.07 4.50 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 0.42 0.00 0.00 0.59 0.00 0.00 130 L 8.26 4.55 0.00 1.82 1.78 0.98 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 131 F 7.16 4.45 0.00 3.11 2.96 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 0.00 0.00 0.00