NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 86 R 4.2669 8.2549 120.8601 55.5454 31.1362 175.2012 87 K 3.8683 8.6535 124.8598 56.6790 32.7414 174.5540 88 L 5.0234 8.7674 120.9941 53.3287 46.8067 178.0704 89 C 4.5135 9.2080 118.8291 59.2108 40.3181 175.5907 90 S 4.2258 7.9604 112.3975 58.4548 63.4607 173.6983 91 L 4.5022 7.5989 122.0813 53.8637 42.9238 175.5750 92 D 4.5070 9.4680 123.3510 55.0088 38.7422 173.9694 93 N 4.5742 8.2838 112.7786 53.8807 37.2262 174.5392 94 G 3.7498 8.7104 101.7795 45.6306 0.0000 175.0753 95 D 4.5428 8.0310 115.9762 54.4109 39.0875 173.5176 96 C 4.6147 7.8246 117.1822 56.1215 41.1023 173.8436 97 D 4.4613 8.4327 123.9102 56.8117 42.2477 177.2973 98 Q 4.2936 7.7236 111.7093 55.8994 30.5921 179.2299 99 F 4.7138 5.7819 125.8181 58.4297 40.5618 173.3466 100 C 5.4371 8.6111 121.3743 55.3182 44.7418 172.5732 101 H 5.1278 9.3054 121.4239 54.3699 33.6317 171.7901 102 E 5.2505 8.7976 119.3930 54.8353 31.2401 175.5465 103 E 4.6505 8.9646 123.9710 55.8848 32.5225 176.1282 104 Q 3.3760 9.4660 120.0231 58.3071 26.9904 173.5765 105 N 4.1960 8.2945 108.6941 54.3295 36.5729 174.1302 106 S 4.7865 8.1261 112.4452 56.4975 68.4667 175.3833 107 V 4.1660 8.4259 122.4223 63.0779 32.1093 175.2786 108 V 4.4712 9.4138 128.7482 61.3617 34.0235 173.9611 109 C 5.3637 8.9007 125.1862 56.4779 36.1819 172.5117 110 S 4.8321 8.8056 115.1289 57.4946 66.8557 171.6477 111 C 5.0487 8.6202 115.4405 54.6142 38.9064 174.4302 112 A 4.5333 8.6378 123.9274 51.6002 18.6990 177.1738 113 R 3.8698 8.5722 119.1389 58.4503 30.4527 176.8969 114 G 3.9438 9.4193 111.8340 45.1725 0.0000 171.9112 115 Y 5.3343 7.7288 115.9509 56.1213 41.8597 174.9249 116 T 4.7473 9.1011 112.4307 59.3667 72.0193 173.1387 117 L 4.4497 8.6306 126.3053 55.0953 42.6621 176.5431 118 A 4.1865 9.1644 128.5606 52.1006 19.1346 178.0131 119 D 4.3337 8.9214 119.3663 57.4705 40.9769 178.1735 120 N 4.3917 8.0844 114.3242 53.5429 37.6993 176.0342 121 G 3.9487 8.4163 107.5263 45.7016 0.0000 173.3365 122 K 4.4796 8.9688 117.7094 57.8248 34.5199 176.7730 123 A 4.6391 8.2159 121.0557 52.1836 19.9489 176.3628 124 C 5.1926 8.8832 117.2545 55.2708 40.8675 173.6795 125 I 4.6007 8.5956 125.4668 58.7130 38.9486 173.6799 126 P 4.3677 0.0000 0.0000 62.9549 30.9142 176.8103 127 T 4.1024 8.9924 114.6576 63.4060 70.2136 174.2766 128 G 4.1199 7.4316 109.3895 43.2600 0.0000 170.4036 129 P 4.0555 0.0000 0.0000 64.8494 31.8556 176.3014 130 Y 4.7500 7.2744 115.1204 55.4163 37.7691 173.2214 131 P 4.2046 0.0000 0.0000 61.9685 32.6785 176.8251 132 C 4.0342 8.5501 116.3295 60.0280 29.7420 174.1449 133 G 3.9785 8.9453 108.6731 45.7563 0.0000 173.1325 134 K 4.6450 7.4286 117.6593 53.9668 34.1987 176.4708 135 Q 4.1894 8.6692 122.5804 56.2556 29.3440 175.6850 136 T 4.6205 8.3112 110.9262 60.0740 70.5582 174.0414 137 L 4.9869 8.1383 124.2164 52.6705 46.4159 177.5702 138 E 4.1127 8.9503 127.0905 57.9469 27.8909 178.1415 *139 R 4.1415 9.1363 126.5400 57.2163 30.1652 176.7983 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 86 R 8.25 4.27 0.00 1.79 1.92 0.00 3.36 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 87 K 8.65 3.87 0.00 1.86 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.52 7.81 88 L 8.77 5.02 0.00 1.64 1.48 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 89 C 9.21 4.51 0.00 3.00 3.12 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 0.00 0.00 0.00 90 S 7.96 4.23 0.00 3.97 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 91 L 7.60 4.50 0.00 1.73 1.61 0.92 1.13 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 92 D 9.47 4.51 0.00 2.82 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 93 N 8.28 4.57 0.00 2.95 2.82 0.00 0.00 7.59 7.93 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 94 G 8.71 3.75 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 0.00 0.00 0.00 95 D 8.03 4.54 0.00 2.89 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 96 C 7.82 4.61 0.00 3.03 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 97 D 8.43 4.46 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.72 4.29 0.00 1.47 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.98 0.00 0.00 0.00 0.00 0.00 1.82 1.94 0.00 99 F 5.78 4.71 0.00 3.04 2.81 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 0.00 100 C 8.61 5.44 0.00 3.06 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 0.00 101 H 9.31 5.13 0.00 3.07 3.11 0.00 5.63 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.80 5.25 0.00 1.84 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 2.32 2.32 0.00 103 E 8.96 4.65 0.00 1.99 1.80 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 2.21 2.25 0.00 104 Q 9.47 3.38 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 105 N 8.29 4.20 0.00 2.80 2.82 0.00 0.00 6.93 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 0.00 106 S 8.13 4.79 0.00 3.82 3.68 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 0.00 107 V 8.43 4.17 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 0.79 0.00 0.00 0.95 0.00 0.00 108 V 9.41 4.47 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 1.04 0.00 0.00 1.05 0.00 0.00 109 C 8.90 5.36 0.00 3.02 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 0.00 110 S 8.81 4.83 0.00 4.09 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 0.00 111 C 8.62 5.05 0.00 2.84 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 0.00 112 A 8.64 4.53 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 0.00 113 R 8.57 3.87 0.00 1.86 2.00 0.00 3.31 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 114 G 9.42 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 0.00 0.00 0.00 115 Y 7.73 5.33 0.00 2.82 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 0.00 116 T 9.10 4.75 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 1.23 0.00 0.00 117 L 8.63 4.45 0.00 1.68 1.65 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 118 A 9.16 4.19 1.31 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 0.00 0.00 0.00 119 D 8.92 4.33 0.00 2.68 2.77 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 0.00 120 N 8.08 4.39 0.00 2.81 2.94 0.00 0.00 6.08 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 0.00 121 G 8.42 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 0.00 122 K 8.97 4.48 0.00 1.73 1.99 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.52 7.81 123 A 8.22 4.64 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 0.00 124 C 8.88 5.19 0.00 2.63 2.80 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 0.00 125 I 8.60 4.60 1.99 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 1.25 0.98 0.92 0.00 0.00 126 P 0.00 4.37 0.00 1.87 1.68 0.00 3.67 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 127 T 8.99 4.10 4.20 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 1.19 0.00 0.00 128 G 7.43 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.06 0.00 1.47 1.97 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 130 Y 7.27 4.75 0.00 2.96 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 0.00 131 P 0.00 4.20 0.00 1.75 1.57 0.00 3.68 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 2.00 1.76 0.00 132 C 8.55 4.03 0.00 3.19 3.09 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 0.00 133 G 8.95 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 0.00 134 K 7.43 4.65 0.00 1.82 1.76 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.61 7.81 135 Q 8.67 4.19 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 136 T 8.31 4.62 4.44 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 1.41 0.00 0.00 137 L 8.14 4.99 0.00 1.62 1.59 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.95 4.11 0.00 1.97 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 2.34 2.34 0.00 *139 R 9.14 4.14 0.00 1.57 1.74 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.