NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3190 8.3001 120.3106 56.6946 33.3108 174.7518 2 A 4.4860 7.7829 129.0464 51.3796 17.8791 176.5617 3 Y 4.4883 6.8934 121.8770 57.7669 40.4990 175.8920 4 N 4.3279 7.8452 118.1671 56.1927 38.6710 176.5635 5 K 3.7997 8.0738 120.4027 59.6567 32.1149 177.9138 6 E 3.9556 7.5555 116.4714 59.4701 29.4339 178.7574 7 E 4.0762 8.0143 116.0616 59.1262 29.8543 178.5746 8 K 4.1369 8.7240 121.1822 59.2890 31.7319 178.9857 9 I 3.8677 8.3184 120.7646 64.2275 36.9099 178.3677 10 K 4.1054 8.0004 117.8062 58.6974 31.8147 179.3285 11 S 4.2545 7.5576 115.5418 60.5651 63.4401 174.6675 12 L 4.1181 6.8865 118.7632 55.2068 42.1556 178.0334 13 N 4.7379 8.9769 120.1829 51.9901 39.9999 175.9197 14 R 3.8958 8.4749 118.8331 60.2135 30.0174 178.1501 15 M 4.0767 8.1172 117.3365 58.7846 32.3020 178.0231 16 Q 4.0378 8.9998 118.8032 58.8051 28.7689 178.0816 17 Y 3.9260 7.9692 120.3880 60.7566 38.8486 177.0582 18 E 3.9025 8.5732 120.5772 59.8956 29.6833 178.7751 19 V 4.2297 8.3730 119.7509 65.2752 31.7437 178.0480 20 T 4.0058 8.6428 109.6378 64.7002 68.4700 176.0191 21 Q 4.0262 7.7977 119.2132 56.6933 29.4241 176.3009 22 N 4.6102 7.5323 113.5978 52.1514 38.9955 174.2184 23 N 3.9800 7.7642 114.3523 54.0395 36.9307 174.7812 24 G 4.1805 8.0314 106.2382 44.2186 0.0000 173.4495 25 T 4.8031 8.0001 115.3961 61.0464 71.1868 174.4436 26 E 4.2717 8.7554 124.4671 55.1471 30.5082 175.0232 27 P 4.4701 0.0000 0.0000 62.0191 31.7354 174.4259 28 P 2.9700 0.0000 0.0000 63.3613 31.4670 177.1183 29 F 2.0000 6.8612 120.1468 57.4710 37.6163 175.4511 30 Q 4.7710 7.1292 116.8212 54.1964 28.9889 174.1406 31 N 5.0876 7.7235 113.3041 51.2254 40.8506 174.8164 32 E 4.0460 8.6496 120.0481 58.9064 29.8446 177.0499 33 Y 4.9945 7.8952 114.3885 57.5708 38.5630 176.5860 34 W 4.3298 8.3350 117.7136 59.3252 28.1775 176.9863 35 D 3.3700 6.9623 118.3646 55.1671 40.8626 181.5069 36 H 2.9154 8.1978 114.5477 53.3431 32.6984 175.0927 37 K 4.1862 8.3999 118.1045 57.1346 30.2539 174.8608 38 E 4.2353 7.4578 119.6711 54.6448 30.2401 175.5533 39 E 4.2822 8.9565 126.9013 57.2964 30.0598 175.2962 40 G 3.8586 9.0319 117.0745 45.9448 0.0000 169.9779 41 L 4.9994 7.7018 123.4616 53.4323 45.4265 176.7160 42 Y 4.1777 8.8048 124.9117 57.0914 38.6045 175.3951 43 V 4.3469 8.2828 125.1956 61.4283 34.1619 174.3847 44 D 4.8869 8.8677 124.8642 54.0845 41.5772 176.6025 45 I 3.9610 8.5268 125.9291 62.8890 37.9186 175.9252 46 V 4.2240 8.7266 119.6373 65.1210 32.8095 176.6660 47 S 4.3251 8.3047 111.0283 58.0998 63.5723 175.0995 48 G 3.9890 8.2429 108.7476 45.5981 0.0000 173.8787 49 K 4.1796 7.4968 119.1587 55.0833 32.7022 174.5078 50 P 4.3510 0.0000 0.0000 63.3599 31.3447 175.7028 51 L 4.2227 8.6680 124.3973 56.0056 43.9960 176.3817 52 F 4.9597 8.2691 115.2711 56.2478 44.2268 173.7695 53 T 5.3048 8.5504 115.8188 61.7621 71.6877 175.9512 54 S 4.8474 9.0189 118.2579 61.1139 63.5924 177.0302 55 K 4.1164 8.1871 120.3046 59.4694 32.1633 177.3513 56 D 4.7711 8.0463 115.5090 54.2650 40.8272 175.1722 57 K 4.8044 7.8659 121.0492 54.4289 32.4913 175.8600 58 F 5.0770 8.0783 122.2632 54.8524 40.7700 174.9300 59 D 4.5649 8.6896 119.8904 54.4411 41.3830 175.6980 60 S 4.7865 8.5206 115.9364 57.2148 65.9107 173.1208 61 Q 4.8023 8.5508 118.3559 55.6929 29.1199 176.7829 62 C 4.0276 8.0925 115.6031 59.4478 30.0855 174.8446 63 G 2.0000 8.8102 107.6051 43.9465 0.0000 172.3369 64 W 5.3872 7.2751 116.8829 53.4531 33.5203 173.1437 65 P 4.3736 0.0000 0.0000 63.5472 32.1244 175.2109 66 S 5.1279 7.6990 116.3143 56.9815 67.4495 172.8222 67 F 5.4104 9.3431 121.7170 55.9572 42.2141 175.8670 68 T 4.3741 9.7447 115.0694 64.8972 68.8792 174.6078 69 K 4.0852 7.8945 117.1320 54.8147 34.7916 173.1356 70 P 3.8631 0.0000 0.0000 61.8581 32.4548 174.9535 71 I 4.2788 7.3146 110.8844 59.5304 39.7956 176.8404 72 E 3.6471 8.3002 119.7286 57.4904 28.4736 174.6567 73 E 4.6282 8.4201 119.3585 56.8720 30.1838 177.7079 74 E 4.1018 7.6494 119.2995 57.4570 29.9832 176.4970 75 V 4.6751 7.4254 118.5670 61.1668 33.2695 174.8435 76 E 4.8056 9.3535 127.0957 54.5881 33.0077 174.5823 77 E 4.9938 8.8350 123.4010 55.1058 30.9954 175.4282 78 K 4.6134 8.7643 125.5004 54.0349 35.8163 174.7703 79 L 4.2985 8.5853 128.8549 55.2353 42.8230 175.2345 80 D 4.7977 8.6008 127.1429 52.5292 43.1437 176.6516 81 T 5.5515 8.2872 126.0757 63.3189 69.7060 175.6617 82 S 4.1672 8.3372 117.7778 59.2378 63.0545 176.1896 83 H 4.2720 8.9493 117.0416 57.7115 26.3886 175.1741 84 G 4.0132 8.1777 101.6812 46.3085 0.0000 172.0577 85 M 4.7216 7.6003 115.3585 54.1625 36.9730 174.7067 86 I 4.6782 8.1240 120.1236 59.9022 39.3962 175.0250 87 R 4.4926 8.6360 125.6951 55.4276 34.8438 173.9484 88 T 4.6563 7.9835 116.4967 62.6455 72.0743 173.6830 89 E 4.7807 9.2016 128.6713 55.8211 31.6958 175.5280 90 V 5.0649 8.2760 114.4487 59.9505 36.2528 175.0247 91 R 5.1974 8.9709 122.2730 54.5283 34.7542 174.9682 92 S 4.5743 8.6252 116.4621 58.7746 63.0651 175.2220 93 R 4.5964 9.1620 121.5167 58.9807 30.4049 178.6525 94 T 3.8323 8.4183 111.2994 64.9815 67.4379 175.0752 95 A 4.1393 7.9266 121.9982 52.6235 19.1063 176.7110 96 D 4.6472 7.6983 110.4780 55.4920 40.3168 173.1719 97 S 4.9252 7.6179 111.3151 56.1727 65.3273 172.7445 98 H 4.3475 8.7249 123.9737 57.2729 29.7423 174.4687 99 L 4.3001 9.2747 126.5517 53.9736 43.2106 178.0488 100 G 4.0113 7.0039 107.7110 46.2877 0.0000 173.5063 101 H 5.1775 8.7167 122.1586 54.1610 33.4122 171.1477 102 V 4.7379 7.5645 119.3506 61.5026 34.5926 174.2003 103 F 4.7721 8.8137 121.4994 56.1310 44.0624 174.6332 104 N 5.7331 9.1435 114.8230 52.8178 39.1094 174.9990 105 D 4.8436 8.4280 115.5315 52.9641 40.3844 176.2182 106 G 4.0029 7.6196 108.9868 43.2644 0.0000 171.5241 107 P 4.2578 0.0000 0.0000 62.0892 32.0373 179.0081 108 G 3.9643 8.2207 109.8490 45.1464 0.0000 171.2618 109 P 4.4256 0.0000 0.0000 64.3936 31.7117 177.1526 110 N 4.4515 8.1485 115.2497 53.3154 38.1911 176.4620 111 G 4.1026 8.3143 106.4560 44.5369 0.0000 172.9437 112 L 5.3605 7.4844 119.2316 54.3017 43.8666 176.4355 113 R 4.9417 8.3443 120.7354 55.9842 32.7820 173.2849 114 Y 4.7476 9.9055 126.8100 57.5573 39.4363 174.7077 115 C 4.9645 9.8253 127.2552 58.0905 32.2654 172.1782 116 I 4.9165 8.0442 125.8952 59.1419 39.5191 175.8005 117 N 4.8239 8.6343 122.5436 53.1432 39.3901 176.9811 118 S 4.4081 10.7700 118.0309 61.6321 63.2385 176.6092 119 A 3.9404 8.2999 122.3424 55.2653 18.2791 178.1230 120 A 4.3715 7.8447 115.1604 52.8715 18.9755 176.4480 121 L 5.4764 8.1018 115.8179 52.9441 45.4876 176.7225 122 R 4.7580 8.9321 120.6140 54.7190 32.6621 174.2079 123 F 4.2991 9.3075 129.8173 58.4293 40.6217 175.1383 124 V 3.8528 6.2635 123.7132 60.4263 34.4395 172.8173 125 P 4.3333 0.0000 0.0000 62.0908 32.0620 177.3247 126 K 3.4278 8.3261 119.3278 59.5886 31.8355 178.0463 127 H 4.3962 8.1180 116.3956 57.7659 30.0901 175.8681 128 K 4.4746 7.4182 117.6969 56.2144 32.9494 177.6817 129 L 3.9847 7.5694 121.5669 57.4456 41.6013 179.1102 130 K 4.1938 7.9119 119.4102 59.5876 32.1186 178.6275 131 E 3.9757 7.9908 115.6356 59.3730 29.7418 177.4537 132 E 4.1903 8.3220 116.2195 56.4835 29.2176 177.3550 133 G 3.8115 8.0878 106.3464 46.7519 0.0000 174.3288 134 Y 4.7163 8.7808 116.9532 57.5609 38.6780 177.4110 135 E 4.0008 8.3648 122.5654 60.0342 29.3667 179.3351 136 S 4.1600 8.2702 111.7362 61.3342 63.0296 175.1284 137 Y 4.4386 8.6381 119.4543 58.8083 38.0900 177.1061 138 L 4.2231 7.8386 121.1830 58.5125 42.2580 178.3866 139 H 4.4949 8.3807 114.4843 58.3832 28.2224 177.0333 140 L 4.0399 7.9334 117.8846 55.5116 41.1800 177.0479 141 F 4.3620 8.3840 123.9071 57.6803 39.6266 174.7261 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 4.32 0.00 1.94 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 2.47 2.50 0.00 2 A 7.78 4.49 0.56 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 0.00 0.00 3 Y 6.89 4.49 0.00 3.23 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 4 N 7.85 4.33 0.00 2.72 2.93 0.00 0.00 6.77 7.68 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 5 K 8.07 3.80 0.00 1.78 1.98 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.53 7.81 6 E 7.56 3.96 0.00 2.16 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 0.00 2.36 2.41 0.00 7 E 8.01 4.08 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.41 0.00 8 K 8.72 4.14 0.00 1.98 2.05 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.56 7.81 9 I 8.32 3.87 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.21 1.17 0.00 0.00 10 K 8.00 4.11 0.00 1.92 1.88 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.88 7.81 11 S 7.56 4.25 0.00 4.03 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 12 L 6.89 4.12 0.00 1.80 1.75 1.03 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.98 4.74 0.00 3.03 3.02 0.00 0.00 6.55 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.47 3.90 0.00 1.92 2.00 0.00 3.21 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 15 M 8.12 4.08 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.73 0.00 16 Q 9.00 4.04 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.60 0.00 0.00 0.00 0.00 0.00 2.53 2.68 0.00 17 Y 7.97 3.93 0.00 3.08 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 18 E 8.57 3.90 0.00 2.27 2.24 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 2.36 2.42 0.00 19 V 8.37 4.23 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 1.25 0.00 0.00 1.03 0.00 0.00 20 T 8.64 4.01 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 1.28 0.00 0.00 21 Q 7.80 4.03 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 22 N 7.53 4.61 0.00 2.76 2.79 0.00 0.00 6.97 8.00 0.00 0.00 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 N 7.76 3.98 0.00 2.76 2.57 0.00 0.00 6.84 7.31 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 24 G 8.03 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 0.00 0.00 0.00 25 T 8.00 4.80 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 0.97 0.00 0.00 26 E 8.76 4.27 0.00 2.17 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 2.50 2.64 0.00 27 P 0.00 4.47 0.00 2.17 2.12 0.00 3.83 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.01 0.00 28 P 0.00 2.97 0.00 1.64 0.60 0.00 3.57 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.07 0.00 29 F 6.86 2.00 0.00 2.73 2.46 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 30 Q 7.13 4.77 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.67 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 31 N 7.72 5.09 0.00 2.87 2.90 0.00 0.00 6.29 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 32 E 8.65 4.05 0.00 1.77 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 2.37 2.33 0.00 33 Y 7.90 4.99 0.00 3.07 2.94 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 34 W 8.33 4.33 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 35 D 6.96 3.37 0.00 2.11 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 0.00 0.00 0.00 0.00 36 H 8.20 2.92 0.00 3.39 3.40 0.00 5.80 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 37 K 8.40 4.19 0.00 1.87 1.86 0.00 1.65 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.28 1.41 7.81 38 E 7.46 4.24 0.00 1.40 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 2.15 2.39 0.00 39 E 8.96 4.28 0.00 2.10 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 2.73 2.53 0.00 40 G 9.03 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.70 5.00 0.00 1.53 1.00 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 42 Y 8.80 4.18 0.00 3.16 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 43 V 8.28 4.35 2.06 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 0.98 0.00 0.00 0.62 0.00 0.00 44 D 8.87 4.89 0.00 2.92 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 45 I 8.53 3.96 2.06 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 1.18 1.02 0.99 0.00 0.00 46 V 8.73 4.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.97 0.00 0.00 47 S 8.30 4.33 0.00 4.02 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.24 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.50 4.18 0.00 1.98 1.76 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.56 7.81 50 P 0.00 4.35 0.00 1.69 1.60 0.00 3.61 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 0.49 1.76 0.00 51 L 8.67 4.22 0.00 1.72 1.49 1.04 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.27 4.96 0.00 2.17 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 0.00 0.00 0.00 53 T 8.55 5.30 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 54 S 9.02 4.85 0.00 4.39 4.57 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 55 K 8.19 4.12 0.00 1.74 1.89 0.00 1.38 0.00 0.00 1.40 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.24 7.81 56 D 8.05 4.77 0.00 3.09 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 57 K 7.87 4.80 0.00 1.40 1.86 0.00 0.61 0.00 0.00 1.49 0.00 0.00 2.56 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.04 0.42 7.81 58 F 8.08 5.08 0.00 3.05 2.97 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 59 D 8.69 4.56 0.00 2.65 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 60 S 8.52 4.79 0.00 3.67 3.56 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 61 Q 8.55 4.80 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 62 C 8.09 4.03 0.00 3.23 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 63 G 8.81 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 0.00 0.00 0.00 0.00 0.00 0.00 64 W 7.28 5.39 0.00 3.31 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 65 P 0.00 4.37 0.00 2.07 2.30 0.00 3.97 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.21 0.00 66 S 7.70 5.13 0.00 2.86 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 9.34 5.41 0.00 3.05 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 68 T 9.74 4.37 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 69 K 7.89 4.09 0.00 1.78 1.86 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.48 7.81 70 P 0.00 3.86 0.00 1.55 1.07 0.00 3.22 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 71 I 7.31 4.28 1.86 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 1.20 0.87 0.83 0.00 0.00 72 E 8.30 3.65 0.00 2.09 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 0.00 2.25 2.38 0.00 73 E 8.42 4.63 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.34 0.00 74 E 7.65 4.10 0.00 2.00 1.90 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 2.33 2.40 0.00 75 V 7.43 4.68 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 0.97 0.00 0.00 0.42 0.00 0.00 76 E 9.35 4.81 0.00 1.87 1.79 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 2.20 2.24 0.00 77 E 8.84 4.99 0.00 1.84 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 78 K 8.76 4.61 0.00 1.78 1.58 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.75 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.32 7.81 79 L 8.59 4.30 0.00 1.67 1.55 0.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.60 4.80 0.00 2.68 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 T 8.29 5.55 4.21 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 1.23 0.00 0.00 82 S 8.34 4.17 0.00 3.65 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 83 H 8.95 4.27 0.00 3.28 3.37 0.00 5.82 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 84 G 8.18 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 M 7.60 4.72 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.52 0.00 86 I 8.12 4.68 1.85 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 1.39 0.60 0.88 0.00 0.00 87 R 8.64 4.49 0.00 1.55 1.57 0.00 2.88 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 88 T 7.98 4.66 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 89 E 9.20 4.78 0.00 2.23 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 2.29 2.41 0.00 90 V 8.28 5.06 2.23 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 0.78 0.00 0.00 0.96 0.00 0.00 91 R 8.97 5.20 0.00 1.72 1.88 0.00 3.40 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 92 S 8.63 4.57 0.00 3.95 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 93 R 9.16 4.60 0.00 2.04 2.07 0.00 3.14 0.00 0.00 3.18 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 94 T 8.42 3.83 4.30 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 1.31 0.00 0.00 95 A 7.93 4.14 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 96 D 7.70 4.65 0.00 2.77 2.78 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 97 S 7.62 4.93 0.00 3.96 3.96 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 98 H 8.72 4.35 0.00 3.39 3.43 0.00 5.93 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 9.27 4.30 0.00 1.80 1.70 1.04 0.96 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 0.00 100 G 7.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 H 8.72 5.18 0.00 3.03 2.70 0.00 5.76 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.56 4.74 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.24 0.00 0.00 103 F 8.81 4.77 0.00 3.20 2.94 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 0.00 104 N 9.14 5.73 0.00 2.71 2.80 0.00 0.00 7.13 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 0.00 105 D 8.43 4.84 0.00 2.78 2.78 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 0.00 106 G 7.62 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 0.00 107 P 0.00 4.26 0.00 1.64 1.80 0.00 2.31 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.83 0.00 108 G 8.22 3.96 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 0.00 0.00 0.00 109 P 0.00 4.43 0.00 2.06 2.12 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 110 N 8.15 4.45 0.00 2.89 2.99 0.00 0.00 6.23 7.00 0.00 0.00 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 G 8.31 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 0.00 0.00 0.00 112 L 7.48 5.36 0.00 1.98 1.75 1.10 1.03 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 0.00 113 R 8.34 4.94 0.00 2.20 2.12 0.00 3.63 0.00 0.00 3.77 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.11 0.00 114 Y 9.91 4.75 0.00 3.42 3.08 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 0.00 115 C 9.83 4.96 0.00 3.15 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.04 4.92 1.65 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.59 0.87 0.00 0.00 117 N 8.63 4.82 0.00 2.82 2.76 0.00 0.00 7.13 7.11 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 0.00 118 S 10.77 4.41 0.00 4.08 3.61 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 0.00 119 A 8.30 3.94 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 0.00 120 A 7.84 4.37 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 0.00 121 L 8.10 5.48 0.00 2.14 1.92 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.93 4.76 0.00 1.97 1.82 0.00 3.16 0.00 0.00 3.16 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 123 F 9.31 4.30 0.00 2.17 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 0.00 124 V 6.26 3.85 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.49 0.00 0.00 125 P 0.00 4.33 0.00 2.22 2.26 0.00 3.46 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 126 K 8.33 3.43 0.00 1.49 1.67 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.26 0.83 7.81 127 H 8.12 4.40 0.00 3.10 3.27 0.00 5.74 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 0.00 128 K 7.42 4.47 0.00 1.69 1.78 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.25 1.36 7.81 129 L 7.57 3.98 0.00 1.49 1.71 0.47 0.62 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 0.00 130 K 7.91 4.19 0.00 1.80 1.77 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.77 7.81 131 E 7.99 3.98 0.00 2.09 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 2.36 2.32 0.00 132 E 8.32 4.19 0.00 2.45 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 0.00 2.40 2.27 0.00 133 G 8.09 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 0.00 134 Y 8.78 4.72 0.00 3.07 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 0.00 135 E 8.36 4.00 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 136 S 8.27 4.16 0.00 3.79 3.96 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 0.00 137 Y 8.64 4.44 0.00 3.22 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 0.00 138 L 7.84 4.22 0.00 1.75 1.96 0.74 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.38 4.49 0.00 3.49 3.61 0.00 5.71 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 0.00 140 L 7.93 4.04 0.00 1.69 1.44 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 141 F 8.38 4.36 0.00 3.03 2.95 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