NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8068 8.3544 109.7411 44.5269 0.0000 173.8332 2 S 4.2887 8.2538 123.1925 56.7596 62.7984 171.5786 3 S 4.4964 8.7944 121.4230 58.5959 67.5909 177.8333 4 G 3.6258 8.5091 110.6151 46.4951 0.0000 173.4985 5 S 4.4340 8.2812 116.6121 57.6272 61.7918 174.1662 6 S 4.6559 7.8789 119.0738 57.3581 65.6245 178.7228 7 G 4.2256 8.4111 115.4345 45.0313 0.0000 174.4168 8 D 4.9567 8.3814 119.2527 53.5080 41.0526 175.9417 9 V 4.0075 7.9186 117.9415 62.6418 32.5587 174.9354 10 I 4.4698 8.2932 128.1571 59.9046 39.1297 174.3129 11 E 4.8913 8.8445 128.3394 55.2756 30.2415 175.0996 12 L 4.9422 8.1894 125.9833 53.3023 45.1442 176.5070 13 T 4.4908 7.9948 112.0803 60.0768 71.0303 174.7154 14 D 4.8680 8.4524 118.5847 54.1186 40.0184 175.7988 15 D 4.7513 7.9569 118.4713 56.0940 43.0968 178.1420 16 S 4.0812 8.1843 114.3467 61.1301 62.8216 175.7894 17 F 3.7476 7.9290 124.1170 61.5932 38.4686 176.9983 18 D 4.4407 8.1509 117.6785 56.5218 40.6307 178.2129 19 K 4.1808 8.2173 117.2743 57.5070 32.3067 177.7258 20 N 4.3985 7.4212 115.6095 54.7884 40.0901 176.4299 21 V 2.8821 6.7418 119.4781 64.9469 31.4298 177.9688 22 L 4.1017 7.2617 118.2481 57.7927 41.7547 177.9259 23 D 4.6469 7.7968 115.1067 54.2341 41.1779 175.3313 24 S 4.7710 8.2256 111.8868 57.1603 65.3443 173.1302 25 E 4.6655 8.7876 125.5756 57.1531 30.2092 175.5368 26 D 5.1555 7.5275 117.6323 52.0514 45.4106 175.7820 27 V 4.3021 8.0699 120.2076 62.9423 32.8979 174.8071 28 W 4.8662 8.8206 126.8989 55.2495 31.8182 175.1652 29 M 4.8678 9.3922 127.1843 54.5992 32.1127 175.5089 30 V 4.3787 9.0338 125.4295 61.7761 33.3318 174.1571 31 E 4.8399 8.4838 129.3444 54.2958 32.0859 174.3046 32 F 5.0748 9.1874 126.5839 56.3106 40.6417 174.6892 33 Y 5.1096 8.1212 120.6791 54.9632 42.3184 174.0932 34 A 4.0033 8.0817 121.8799 49.2078 21.0238 175.3802 35 P 4.5780 0.0000 0.0000 63.7210 31.5472 176.6666 36 W 5.0164 6.7576 115.2187 55.8369 28.8181 174.7011 37 C 5.1734 7.9865 118.1122 57.7957 34.5935 174.3706 38 G 3.4989 8.6873 114.7400 48.4830 0.0000 175.7055 39 H 4.1969 8.0708 117.8218 58.4154 28.9236 176.7679 40 C 4.3596 8.0192 117.9839 62.1571 28.1895 175.6376 41 K 3.8906 7.6643 120.1413 60.4411 31.5599 178.5758 42 N 4.1643 8.1157 116.2363 55.2576 38.8036 176.4108 43 L 4.3037 8.5025 121.7367 56.7475 42.4738 177.9638 44 E 3.6532 7.5415 119.5774 58.9799 29.6049 177.3684 45 P 4.2860 0.0000 0.0000 65.8891 31.4135 178.0002 46 E 3.9853 8.1652 117.9420 58.9251 29.2714 179.0749 47 W 4.0193 8.9546 128.4440 60.1256 30.8307 177.7354 48 A 3.9683 7.9800 120.1434 55.2891 17.8117 179.3601 49 A 3.9148 8.0236 118.4186 55.2485 18.5323 179.3189 50 A 3.7156 7.5556 118.5681 55.4336 18.3358 179.3452 51 A 3.5424 7.6767 119.1875 55.5828 18.2130 180.1812 52 S 3.8840 7.7170 112.5928 61.7852 62.7504 176.4462 53 E 3.8078 8.1439 121.7313 58.7038 29.2208 178.8589 54 V 3.5870 7.9663 118.6182 65.2622 31.7695 177.8665 55 K 3.8568 8.2592 120.0218 59.2573 31.7484 178.5981 56 E 3.9286 8.1442 117.6302 59.2747 29.7347 178.7291 57 Q 3.9571 7.4199 117.1059 57.8108 29.1972 177.3902 58 T 2.4800 7.9895 108.9614 59.8879 68.9930 175.3118 59 K 3.7866 8.4312 119.3284 57.5741 29.5587 176.3311 60 G 3.8823 8.4192 109.7499 45.2838 0.0000 175.5983 61 K 4.2772 7.9212 120.5780 58.6702 32.1421 176.4260 62 V 4.1585 7.6413 124.1498 61.6509 31.4954 174.8930 63 K 4.2495 8.4287 128.2597 54.9094 34.1538 175.7780 64 L 5.3411 8.0356 120.9455 53.0826 45.0232 175.5544 65 A 5.2991 9.9917 124.2951 50.2529 22.9557 174.2501 66 A 4.9714 9.2510 119.9269 50.2875 22.8915 175.6063 67 V 4.1407 8.6140 119.2037 61.2264 36.0173 174.4869 68 D 4.5875 8.2231 125.1442 52.2103 40.9249 177.0127 69 A 4.2433 7.5156 128.3050 54.5837 18.5716 178.9534 70 T 4.1765 7.5173 105.1241 63.5598 69.3346 175.5988 71 V 4.0291 7.9964 120.6049 63.0776 33.2046 175.0178 72 N 4.7213 7.9322 117.7357 52.4813 38.7545 174.8868 73 Q 4.3316 8.4865 122.6575 57.1765 30.1878 177.8878 74 V 3.5325 7.7461 117.8630 66.1424 31.7606 177.7585 75 L 4.0014 7.7799 117.5297 57.7509 41.7522 178.7448 76 A 3.7587 8.0737 120.1556 55.6457 17.7227 179.5292 77 S 4.0181 8.4512 111.5585 61.1098 62.2545 175.9129 78 R 3.5450 7.2842 121.1041 59.2767 29.6216 176.5288 79 Y 4.4203 7.9216 111.7197 57.4051 39.4759 174.7850 80 G 3.5708 7.5085 107.9387 45.7082 0.0000 171.0227 81 I 4.2382 8.5643 122.2898 60.2608 37.4352 175.7378 82 R 4.2052 8.3722 123.4468 55.1270 32.3350 176.3013 83 G 3.6669 7.5832 106.0774 43.6288 0.0000 172.3626 84 F 5.2359 7.2341 124.4627 54.9619 40.9033 174.2024 85 P 4.9049 0.0000 0.0000 63.5040 32.5599 176.3138 86 T 4.6151 8.9927 117.0934 62.1270 71.9300 172.7565 87 I 4.6458 8.4075 128.0796 60.2186 39.0190 175.3005 88 K 5.0953 9.4897 126.3411 54.7175 36.2889 175.3233 89 I 5.0268 8.3726 124.5450 59.7385 39.8234 174.6793 90 F 5.0983 8.7976 122.8349 55.8630 42.9286 173.8437 91 Q 4.7031 8.7734 122.0763 53.5310 31.7028 174.6646 92 K 3.8313 9.0501 126.0486 59.2513 32.4185 174.6842 93 G 4.0679 8.8448 118.3692 45.8563 0.0000 173.1463 94 E 4.8136 7.7488 118.2650 53.3084 32.4325 176.1572 95 S 4.3475 8.4459 115.4018 57.7878 63.5714 172.4885 96 P 4.4816 0.0000 0.0000 63.1082 32.1616 175.4771 97 V 4.4373 8.1503 113.5486 59.6848 35.4337 174.2235 98 D 5.0046 8.4188 121.7300 52.7386 42.3955 174.9353 99 Y 4.2505 8.6308 128.9046 57.2148 39.5451 174.5404 100 D 4.6203 8.3106 125.8063 53.6682 43.7525 174.5987 101 G 3.9577 8.4399 117.6383 45.6328 0.0000 171.3241 102 G 4.3934 8.7408 110.7654 46.0074 0.0000 173.2696 103 R 4.8211 8.6014 122.7406 56.1926 31.1524 176.0350 104 T 4.8807 7.8282 106.9713 58.4542 71.4614 174.9814 105 R 3.7873 8.6156 122.0649 59.6162 29.2430 178.6231 106 S 4.0838 8.1460 115.2745 61.6099 62.8896 176.4003 107 D 4.3667 8.6360 121.3295 57.4662 40.7730 178.5867 108 I 3.5586 7.9312 119.8441 64.6706 37.0696 178.4164 109 V 3.4024 8.1305 118.9853 65.9684 31.1807 177.6423 110 S 4.0719 7.5387 111.6397 61.7077 62.2798 176.1550 111 R 4.0463 8.2673 120.6762 59.5557 29.9329 178.1093 112 A 3.9545 7.7992 120.1524 55.5019 17.9600 179.6992 113 L 3.9786 7.9480 117.0790 58.1019 41.5647 179.0215 114 D 4.3964 8.0705 116.7495 57.0316 41.1263 177.9443 115 L 4.4714 7.7529 119.7563 56.3963 42.4265 178.4453 116 F 4.1177 8.3967 121.2004 61.4455 39.1668 177.4154 117 S 3.8646 7.4445 112.1615 60.7807 62.1639 175.2070 118 D 4.5119 8.1658 121.8366 58.5301 40.4270 178.1942 119 N 4.5399 8.0414 115.2128 54.3143 38.9325 175.1067 120 A 3.9606 7.7856 123.3992 51.2739 19.4351 175.5710 121 P 4.2370 0.0000 0.0000 61.5887 32.1085 174.5507 122 P 4.4568 0.0000 0.0000 61.6254 32.0105 175.6083 123 P 4.4780 0.0000 0.0000 61.9250 28.9666 173.7356 124 E 4.5195 8.4211 120.5170 56.0708 32.2949 174.9643 125 L 3.8168 8.1095 126.3291 55.4642 41.2719 176.4053 126 L 4.2268 8.1478 118.5917 53.9579 44.8286 173.6526 127 E 4.0238 8.9870 126.8028 56.8372 30.1932 177.0208 128 S 4.2311 8.7489 118.6586 62.2612 63.8239 173.5071 129 G 3.8009 8.1258 106.7837 42.0522 0.0000 171.8604 130 P 4.2584 0.0000 0.0000 63.1673 30.6427 176.5232 131 S 3.5015 8.8517 123.8191 61.7402 60.4799 172.7163 132 S 3.7003 8.1446 107.1918 57.6444 62.2462 172.2726 133 G 3.7165 7.6160 114.0742 47.6668 0.0000 172.7085 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 G 8.35 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 2 S 8.25 4.29 0.00 3.92 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 3 S 8.79 4.50 0.00 3.84 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 4 G 8.51 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.28 4.43 0.00 3.83 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 6 S 7.88 4.66 0.00 3.80 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 7 G 8.41 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 0.00 0.00 0.00 0.00 8 D 8.38 4.96 0.00 2.59 2.53 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 9 V 7.92 4.01 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 0.97 0.00 0.00 1.08 0.00 0.00 10 I 8.29 4.47 2.15 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.77 1.09 0.00 0.00 11 E 8.84 4.89 0.00 2.01 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 2.25 2.33 0.00 12 L 8.19 4.94 0.00 1.57 1.50 0.61 0.60 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 13 T 7.99 4.49 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 1.20 0.00 0.00 14 D 8.45 4.87 0.00 2.77 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 15 D 7.96 4.75 0.00 2.74 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 16 S 8.18 4.08 0.00 4.04 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 17 F 7.93 3.75 0.00 3.11 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 18 D 8.15 4.44 0.00 2.77 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 19 K 8.22 4.18 0.00 1.66 1.79 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.59 7.81 20 N 7.42 4.40 0.00 2.03 1.82 0.00 0.00 6.86 7.55 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 21 V 6.74 2.88 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 0.71 0.00 0.00 -0.16 0.00 0.00 22 L 7.26 4.10 0.00 1.82 1.73 1.02 1.09 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 23 D 7.80 4.65 0.00 2.52 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 24 S 8.23 4.77 0.00 3.98 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 25 E 8.79 4.67 0.00 2.04 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 0.00 2.31 2.29 0.00 26 D 7.53 5.16 0.00 2.88 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.07 4.30 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 1.10 0.00 0.00 0.99 0.00 0.00 28 W 8.82 4.87 0.00 3.30 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 29 M 9.39 4.87 0.00 2.37 2.29 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 30 V 9.03 4.38 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.96 0.00 0.00 31 E 8.48 4.84 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 1.72 1.47 0.00 32 F 9.19 5.07 0.00 3.05 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 33 Y 8.12 5.11 0.00 2.87 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 34 A 8.08 4.00 -0.25 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 0.00 0.00 0.00 35 P 0.00 4.58 0.00 2.21 2.18 0.00 2.77 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.84 0.00 36 W 6.76 5.02 0.00 3.48 3.21 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 37 C 7.99 5.17 0.00 3.02 2.74 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 38 G 8.69 3.50 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 0.00 39 H 8.07 4.20 0.00 3.21 3.46 0.00 5.70 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.02 4.36 0.00 3.14 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 41 K 7.66 3.89 0.00 1.91 2.23 0.00 1.32 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.50 7.81 42 N 8.12 4.16 0.00 2.75 2.95 0.00 0.00 6.97 7.73 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 43 L 8.50 4.30 0.00 1.75 1.82 1.14 0.69 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 44 E 7.54 3.65 0.00 1.88 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 2.22 2.36 0.00 45 P 0.00 4.29 0.00 2.30 2.28 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 46 E 8.17 3.99 0.00 2.23 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 0.00 2.60 2.47 0.00 47 W 8.95 4.02 0.00 3.32 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 48 A 7.98 3.97 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 0.00 0.00 49 A 8.02 3.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.56 3.72 1.06 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 0.00 0.00 51 A 7.68 3.54 1.16 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 0.00 0.00 52 S 7.72 3.88 0.00 3.95 3.83 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 53 E 8.14 3.81 0.00 1.98 1.94 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 2.21 2.25 0.00 54 V 7.97 3.59 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 0.72 0.00 0.00 0.70 0.00 0.00 55 K 8.26 3.86 0.00 1.63 1.79 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.31 7.81 56 E 8.14 3.93 0.00 2.03 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 0.00 2.20 2.43 0.00 57 Q 7.42 3.96 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 58 T 7.99 2.48 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 0.98 0.00 0.00 59 K 8.43 3.79 0.00 1.95 1.94 0.00 1.53 0.00 0.00 1.74 0.00 0.00 3.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.42 7.81 60 G 8.42 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 0.00 0.00 0.00 61 K 7.92 4.28 0.00 2.05 2.33 0.00 1.60 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.66 1.59 7.81 62 V 7.64 4.16 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 0.83 0.00 0.00 1.10 0.00 0.00 63 K 8.43 4.25 0.00 0.79 0.91 0.00 1.12 0.00 0.00 0.61 0.00 0.00 2.56 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.00 0.77 7.81 64 L 8.04 5.34 0.00 1.26 1.22 0.59 -0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 65 A 9.99 5.30 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 9.25 4.97 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 67 V 8.61 4.14 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 0.93 0.00 0.00 0.68 0.00 0.00 68 D 8.22 4.59 0.00 2.48 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 0.00 0.00 0.00 69 A 7.52 4.24 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.52 4.18 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 71 V 8.00 4.03 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 0.79 0.00 0.00 0.90 0.00 0.00 72 N 7.93 4.72 0.00 2.96 2.80 0.00 0.00 7.11 7.26 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 73 Q 8.49 4.33 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 74 V 7.75 3.53 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 0.76 0.00 0.00 0.96 0.00 0.00 75 L 7.78 4.00 0.00 1.78 1.65 0.41 0.33 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 76 A 8.07 3.76 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 77 S 8.45 4.02 0.00 4.01 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 78 R 7.28 3.54 0.00 1.69 1.48 0.00 3.04 0.00 0.00 2.67 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.24 0.00 79 Y 7.92 4.42 0.00 2.92 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.51 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 0.00 0.00 0.00 81 I 8.56 4.24 1.75 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 -0.36 0.96 0.00 0.00 82 R 8.37 4.21 0.00 1.63 1.78 0.00 3.13 0.00 0.00 3.20 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 83 G 7.58 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 7.23 5.24 0.00 2.96 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 85 P 0.00 4.90 0.00 2.11 2.10 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 86 T 8.99 4.62 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 87 I 8.41 4.65 2.05 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.52 0.93 0.00 0.00 88 K 9.49 5.10 0.00 1.91 1.43 0.00 1.49 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.61 7.81 89 I 8.37 5.03 1.90 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.80 1.00 0.00 0.00 90 F 8.80 5.10 0.00 3.21 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 91 Q 8.77 4.70 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.03 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 92 K 9.05 3.83 0.00 1.79 1.92 0.00 1.83 0.00 0.00 1.90 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.69 1.52 7.81 93 G 8.84 4.07 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 0.00 0.00 0.00 94 E 7.75 4.81 0.00 2.00 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 2.23 0.00 95 S 8.45 4.35 0.00 4.03 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.48 0.00 1.35 1.42 0.00 3.81 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 2.01 2.22 0.00 97 V 8.15 4.44 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 0.65 0.00 0.00 0.95 0.00 0.00 98 D 8.42 5.00 0.00 2.64 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 99 Y 8.63 4.25 0.00 3.16 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.31 4.62 0.00 2.58 2.43 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 0.00 101 G 8.44 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 0.00 102 G 8.74 4.39 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 0.00 103 R 8.60 4.82 0.00 1.88 2.03 0.00 3.22 0.00 0.00 3.36 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 104 T 7.83 4.88 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 1.31 0.00 0.00 105 R 8.62 3.79 0.00 2.03 2.41 0.00 2.94 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 106 S 8.15 4.08 0.00 3.90 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 0.00 107 D 8.64 4.37 0.00 3.05 2.85 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 0.00 0.00 0.00 108 I 7.93 3.56 1.72 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.27 0.40 0.00 0.00 109 V 8.13 3.40 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 0.89 0.00 0.00 0.82 0.00 0.00 110 S 7.54 4.07 0.00 3.98 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 0.00 111 R 8.27 4.05 0.00 2.25 2.33 0.00 3.33 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.84 0.00 112 A 7.80 3.95 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 0.00 113 L 7.95 3.98 0.00 1.96 1.77 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 114 D 8.07 4.40 0.00 2.68 2.88 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 0.00 115 L 7.75 4.47 0.00 1.92 1.73 1.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 116 F 8.40 4.12 0.00 3.10 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.44 3.86 0.00 3.90 3.84 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 0.00 118 D 8.17 4.51 0.00 2.88 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 0.00 119 N 8.04 4.54 0.00 2.67 2.74 0.00 0.00 6.88 7.57 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 0.00 120 A 7.79 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.24 0.00 2.13 1.99 0.00 3.66 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 1.93 1.91 0.00 122 P 0.00 4.46 0.00 2.18 2.07 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.91 0.00 123 P 0.00 4.48 0.00 2.22 2.19 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 124 E 8.42 4.52 0.00 1.88 1.82 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 2.10 2.19 0.00 125 L 8.11 3.82 0.00 1.79 1.67 0.92 0.65 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 L 8.15 4.23 0.00 1.74 1.51 0.90 0.90 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 0.00 127 E 8.99 4.02 0.00 1.96 1.86 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 2.30 2.33 0.00 128 S 8.75 4.23 0.00 4.02 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 0.00 129 G 8.13 3.80 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 0.00 0.00 0.00 130 P 0.00 4.26 0.00 2.23 2.25 0.00 3.85 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 131 S 8.85 3.50 0.00 4.01 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 0.00 132 S 8.14 3.70 0.00 4.05 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 0.00 133 G 7.62 3.72 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 0.00 0.00 0.00