NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 84 M 4.3066 8.3049 120.3300 55.0514 33.0303 175.1007 85 R 3.7111 8.0664 125.8766 53.2713 31.0530 174.3273 86 P 4.6017 0.0000 0.0000 62.0447 33.4663 176.6042 87 E 4.0418 8.9011 118.3791 59.8219 29.0801 179.5573 88 I 3.7022 7.8241 118.0789 63.7572 38.0466 177.6322 89 W 4.0385 8.2730 128.9585 60.4583 30.5128 177.8028 90 I 3.6895 8.2820 119.1283 64.6082 36.5389 178.0873 91 A 3.9377 8.3552 121.6560 55.2865 18.1504 179.7003 92 Q 3.8473 8.2070 116.7037 59.0164 28.7020 178.9653 93 E 3.6006 7.8466 119.7111 58.9726 29.2981 179.0049 94 L 3.8077 7.8492 120.5561 58.1961 42.0963 179.0246 95 R 3.8242 8.1120 118.7900 59.2242 29.9842 178.2077 96 R 3.8470 8.0523 118.8889 59.6510 30.0210 178.5992 97 I 3.9298 7.7949 112.8583 63.7092 37.5838 178.1597 98 G 3.6928 8.3872 107.8987 47.8977 0.0000 175.4054 99 D 4.4180 8.5720 121.5500 57.1752 40.8541 178.6753 100 E 4.0001 8.3054 119.1925 59.3143 28.9118 179.2775 101 F 4.2277 8.6078 120.9062 61.2469 39.5244 176.6106 102 N 4.3489 8.7144 116.8204 56.9058 38.5530 176.6847 103 A 4.1258 8.1103 120.8888 55.0924 18.4629 178.6741 104 Y 3.8718 7.6401 117.0278 60.8759 38.9666 177.2974 105 Y 4.2911 7.4673 114.2528 57.5772 38.9284 175.6587 106 A 4.7541 7.8118 122.4064 49.7157 21.4619 175.8384 107 R 4.0175 8.3996 122.8129 55.7060 30.9651 176.3631 108 R 4.0633 8.5151 123.6911 56.7241 30.0429 175.9647 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 84 M 8.30 4.31 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 85 R 8.07 3.71 0.00 1.55 1.16 0.00 2.63 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.50 0.00 86 P 0.00 4.60 0.00 2.27 2.20 0.00 3.71 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 2.17 2.02 0.00 87 E 8.90 4.04 0.00 2.11 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 0.00 2.44 2.49 0.00 88 I 7.82 3.70 1.92 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 1.57 1.50 1.00 0.00 0.00 89 W 8.27 4.04 0.00 3.47 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.28 3.69 2.12 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 1.92 0.96 0.96 0.00 0.00 91 A 8.36 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 92 Q 8.21 3.85 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 93 E 7.85 3.60 0.00 1.39 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 94 L 7.85 3.81 0.00 1.76 1.77 0.86 1.05 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 95 R 8.11 3.82 0.00 1.94 1.99 0.00 3.15 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 96 R 8.05 3.85 0.00 1.92 1.99 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 97 I 7.79 3.93 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.45 0.86 0.00 0.00 98 G 8.39 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 0.00 0.00 0.00 99 D 8.57 4.42 0.00 2.94 2.75 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 0.00 100 E 8.31 4.00 0.00 2.23 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 0.00 2.35 2.51 0.00 101 F 8.61 4.23 0.00 3.21 3.31 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 0.00 102 N 8.71 4.35 0.00 3.08 3.04 0.00 0.00 7.15 9.01 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 0.00 103 A 8.11 4.13 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 0.00 0.00 0.00 0.00 0.00 104 Y 7.64 3.87 0.00 2.82 2.84 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 0.00 105 Y 7.47 4.29 0.00 2.91 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 0.00 106 A 7.81 4.75 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 0.00 107 R 8.40 4.02 0.00 1.76 1.83 0.00 3.23 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 108 R 8.52 4.06 0.00 1.80 1.79 0.00 3.32 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 1.61 1.62 0.00