NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 85 T 4.2712 8.1593 117.3748 63.4693 69.0684 174.3616 86 L 4.8112 7.5132 121.7423 53.4970 43.6158 176.2513 87 F 4.9295 9.7086 123.3512 57.3838 41.2497 175.8168 88 V 5.0183 8.9871 119.4208 59.7584 34.6178 174.6931 89 A 4.4940 8.6409 124.7890 52.3296 18.8913 178.3563 90 L 3.9402 8.5456 122.6914 56.4872 42.5671 176.7317 91 Y 5.0131 7.5145 113.0822 55.9621 42.0125 175.3028 92 D 5.0150 8.9292 120.5557 54.9957 42.4508 175.7729 93 Y 4.5137 8.4009 121.5742 56.7661 42.4491 172.8346 94 E 4.4163 8.1239 128.2255 54.2480 30.6811 175.3998 95 A 3.9614 8.1645 129.3222 51.6630 19.3537 177.0811 96 R 4.6089 8.3186 116.9269 55.6393 32.2964 175.4169 97 T 4.7264 7.5186 107.2070 59.5635 71.7370 174.6769 98 E 4.0229 8.8720 122.5697 59.3262 29.8080 177.7788 99 D 4.5939 8.0258 116.7306 54.8963 41.5142 175.7749 100 D 5.3537 7.7268 119.0711 53.3826 42.6659 175.3186 101 L 4.9471 8.6172 121.6830 53.6661 44.0901 176.0865 102 S 5.0159 8.9576 122.2378 58.2623 64.4561 173.2813 103 F 5.3717 8.1279 115.4989 57.4165 41.6413 172.2561 104 H 5.4827 8.8911 117.2733 54.1949 31.2865 173.1017 105 K 4.5163 8.8038 125.5038 60.1429 30.8571 174.5911 106 G 3.7863 8.2646 115.9178 45.3503 0.0000 172.6823 107 E 3.9410 8.8327 123.6677 56.3764 30.5069 176.5828 108 K 4.3817 8.3974 125.9579 56.3967 34.0462 176.2701 109 F 5.4200 8.5796 120.3759 56.9315 43.0992 173.6820 110 Q 4.4969 8.5371 116.8499 56.2353 31.8568 174.4493 111 I 4.0448 8.6901 128.8578 61.6066 37.0381 176.0820 112 L 4.3321 8.5869 126.9377 56.1554 43.3249 176.5893 113 N 4.5338 7.7409 116.0799 53.3307 40.2986 174.7594 114 S 3.3498 8.1161 121.7251 59.7078 64.3377 175.5067 115 S 4.6347 7.5586 115.8469 56.6254 60.1950 172.8890 116 E 4.6602 7.1485 120.4288 56.5451 33.5233 175.5523 117 G 4.0877 6.8388 103.4397 45.9980 0.0000 172.1722 118 D 4.6049 8.1877 118.7969 53.5885 41.9705 176.2801 119 W 4.6259 8.0862 119.3265 54.7803 30.5200 175.0788 120 W 5.1002 8.7717 125.8916 55.6379 30.7179 175.6683 121 E 4.7618 9.0463 125.2056 55.6805 30.1414 175.0519 122 A 5.2541 8.9527 128.2080 50.0131 23.5007 174.1838 123 R 5.0109 8.7481 118.9240 54.2977 33.0530 174.8288 124 S 4.2464 9.1927 122.5887 58.7948 62.7276 175.0425 125 L 3.9395 8.5158 127.7510 58.1483 41.5992 178.8554 126 T 3.9985 8.0353 115.4771 66.2318 68.9118 175.6359 127 T 4.0861 8.0460 111.7051 62.3624 69.5421 176.1453 128 G 3.9782 8.0770 108.6972 44.4521 0.0000 172.8885 129 E 4.3498 7.8729 120.8596 56.1936 30.7157 175.6770 130 T 5.1039 9.0955 116.0912 59.4595 71.7678 173.5816 131 G 4.0699 7.7139 111.6560 46.1775 0.0000 171.0191 132 Y 5.3763 7.9182 118.8784 57.7962 39.0507 175.3587 133 I 5.0562 9.4068 117.6245 58.1866 41.6786 173.4122 134 P 2.9700 0.0000 0.0000 61.2650 30.9484 176.7722 135 S 3.2164 7.7480 120.8271 60.8480 62.3534 176.3273 136 N 4.4447 7.4694 115.8550 54.4864 37.3876 174.8171 137 Y 4.6335 8.3352 116.9410 58.3622 38.5666 174.7748 138 V 5.0356 7.3352 112.1356 59.8555 36.0215 174.4451 139 A 4.7992 8.7100 120.5208 50.2442 22.6681 174.4829 140 P 3.8639 0.0000 0.0000 62.2499 32.3759 177.1007 141 V 3.7281 7.3320 114.3508 61.8929 31.3712 176.3853 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 85 T 8.16 4.27 4.29 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 1.30 0.00 0.00 86 L 7.51 4.81 0.00 2.11 1.85 0.95 0.50 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 87 F 9.71 4.93 0.00 3.10 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.99 5.02 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 0.80 0.00 0.00 0.97 0.00 0.00 89 A 8.64 4.49 1.55 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 0.00 0.00 90 L 8.55 3.94 0.00 0.46 0.57 0.75 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 7.51 5.01 0.00 2.52 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.93 5.01 0.00 2.65 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 93 Y 8.40 4.51 0.00 2.96 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 94 E 8.12 4.42 0.00 1.83 1.60 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 2.03 2.18 0.00 95 A 8.16 3.96 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 96 R 8.32 4.61 0.00 1.66 1.82 0.00 3.40 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 97 T 7.52 4.73 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 1.15 0.00 0.00 98 E 8.87 4.02 0.00 1.98 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 2.31 2.29 0.00 99 D 8.03 4.59 0.00 2.85 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 7.73 5.35 0.00 2.73 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 0.00 101 L 8.62 4.95 0.00 1.81 1.82 1.14 1.40 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 0.00 102 S 8.96 5.02 0.00 3.85 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 8.13 5.37 0.00 3.40 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 0.00 104 H 8.89 5.48 0.00 3.18 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.80 4.52 0.00 1.96 1.85 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.30 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.50 7.81 106 G 8.26 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.83 3.94 0.00 2.22 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 1.73 2.14 0.00 108 K 8.40 4.38 0.00 1.61 1.66 0.00 1.65 0.00 0.00 1.88 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.37 7.81 109 F 8.58 5.42 0.00 2.89 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 0.00 110 Q 8.54 4.50 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 7.10 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 111 I 8.69 4.04 1.60 0.00 0.00 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 1.05 -0.03 0.55 0.00 0.00 112 L 8.59 4.33 0.00 1.49 1.69 0.91 0.81 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 0.00 113 N 7.74 4.53 0.00 2.79 2.69 0.00 0.00 6.97 7.24 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 0.00 114 S 8.12 3.35 0.00 2.94 2.63 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 0.00 115 S 7.56 4.63 0.00 3.97 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 0.00 116 E 7.15 4.66 0.00 1.91 1.97 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 2.12 2.23 0.00 117 G 6.84 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.19 4.60 0.00 2.46 2.39 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 0.00 119 W 8.09 4.63 0.00 3.02 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 0.00 120 W 8.77 5.10 0.00 3.10 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.05 4.76 0.00 2.27 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 2.15 1.79 0.00 122 A 8.95 5.25 1.05 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 0.00 0.00 123 R 8.75 5.01 0.00 1.90 1.95 0.00 3.13 0.00 0.00 3.12 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 124 S 9.19 4.25 0.00 4.12 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 0.00 125 L 8.52 3.94 0.00 1.58 1.67 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 126 T 8.04 4.00 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 1.21 0.00 0.00 127 T 8.05 4.09 4.28 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 1.25 0.00 0.00 128 G 8.08 3.98 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 0.00 0.00 0.00 129 E 7.87 4.35 0.00 2.19 1.91 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 2.36 2.30 0.00 130 T 9.10 5.10 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 131 G 7.71 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 0.00 132 Y 7.92 5.38 0.00 3.04 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 0.00 133 I 9.41 5.06 1.53 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.64 0.75 0.00 0.00 134 P 0.00 2.97 0.00 1.44 0.49 0.00 3.32 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.44 0.00 135 S 7.75 3.22 0.00 2.72 2.63 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 0.00 136 N 7.47 4.44 0.00 2.80 2.82 0.00 0.00 5.98 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 0.00 137 Y 8.34 4.63 0.00 3.09 3.23 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 0.00 138 V 7.34 5.04 2.30 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 0.43 0.00 0.00 0.85 0.00 0.00 139 A 8.71 4.80 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 0.00 140 P 0.00 3.86 0.00 1.70 1.56 0.00 3.57 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 1.80 1.14 0.00 141 V 7.33 3.73 2.05 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 0.71 0.00 0.00 0.88 0.00 0.00