NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 47 K 4.1823 8.3149 120.1339 56.0433 34.1849 174.3647 48 Q 3.8757 8.0758 118.7027 53.9877 28.2200 171.8596 49 T 4.2651 8.9509 113.2944 61.1803 70.8551 174.6615 50 L 4.1343 8.4104 123.8076 57.3836 42.0784 178.0003 51 L 4.4085 7.5910 117.2228 55.6457 42.1206 176.5091 52 S 4.3400 9.6600 115.0620 57.8195 64.2244 174.0722 53 D 4.6662 8.7436 116.0521 54.8660 40.2341 178.1777 54 E 3.8795 8.2097 119.5964 59.8417 29.6568 178.5153 55 D 4.4171 7.7959 118.6446 56.9584 40.5930 178.6806 56 A 4.0094 7.4380 120.1129 54.6152 18.4923 178.6429 57 E 4.1813 8.4437 118.1348 58.8071 30.0457 178.4138 58 L 4.0590 7.8190 118.4751 57.7640 41.6302 179.7388 59 V 3.6715 8.0242 112.9175 64.1042 30.9073 178.2116 60 E 4.1111 8.1095 116.8639 58.8781 29.8165 179.1212 61 I 3.7810 7.5945 121.0053 64.0886 37.1822 178.5832 62 V 3.6234 7.8981 120.3268 64.8079 30.7608 178.6106 63 K 3.9697 7.9328 119.3682 59.0206 32.1534 178.8453 64 E 3.7724 7.5865 119.2266 59.5248 29.9029 178.7739 65 R 4.0899 7.9434 117.8659 58.8343 29.9257 178.5603 66 L 3.9348 8.0380 120.2136 58.1593 42.0540 178.9758 67 R 4.1653 7.4809 114.4289 57.9240 30.8241 176.4756 68 N 4.6722 7.7393 113.3497 52.7432 41.2567 171.3839 69 P 4.4115 0.0000 0.0000 62.5227 32.9094 175.1329 70 K 3.7318 7.9515 120.1449 55.5104 28.1054 172.2410 71 P 4.3507 0.0000 0.0000 62.1228 32.3232 176.8120 72 V 4.1928 8.1111 121.5820 60.6906 33.0254 174.8121 73 R 4.0802 8.5518 128.1617 56.2062 30.0890 175.4161 74 V 4.6331 8.0259 118.1362 60.1850 35.6812 173.6259 75 T 4.7688 8.1069 109.4322 60.1818 71.7212 173.8498 76 L 4.2188 8.2563 120.1820 56.9874 42.1229 179.1729 77 D 4.3389 8.0797 117.6510 56.6372 41.3090 176.5649 78 E 4.2681 7.4869 115.2217 57.1400 30.3900 176.3504 79 L 4.1641 7.3893 124.7798 55.1098 41.6249 176.5482 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 47 K 8.31 4.18 0.00 1.76 1.94 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.47 7.81 48 Q 8.08 3.88 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.98 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 49 T 8.95 4.27 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 1.21 0.00 0.00 50 L 8.41 4.13 0.00 1.66 1.77 0.92 0.99 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 51 L 7.59 4.41 0.00 1.96 1.67 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 52 S 9.66 4.34 0.00 3.76 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 53 D 8.74 4.67 0.00 2.86 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 54 E 8.21 3.88 0.00 2.21 2.25 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 2.36 2.40 0.00 55 D 7.80 4.42 0.00 3.04 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 56 A 7.44 4.01 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 57 E 8.44 4.18 0.00 2.01 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 0.00 2.26 2.33 0.00 58 L 7.82 4.06 0.00 1.69 1.70 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 59 V 8.02 3.67 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 1.05 0.00 0.00 0.99 0.00 0.00 60 E 8.11 4.11 0.00 2.19 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 2.60 2.44 0.00 61 I 7.59 3.78 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.24 0.91 0.00 0.00 62 V 7.90 3.62 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 0.94 0.00 0.00 0.93 0.00 0.00 63 K 7.93 3.97 0.00 1.99 2.11 0.00 1.40 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.44 7.81 64 E 7.59 3.77 0.00 2.11 2.29 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 2.32 2.35 0.00 65 R 7.94 4.09 0.00 1.93 1.95 0.00 3.19 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 66 L 8.04 3.93 0.00 1.84 1.86 0.92 1.21 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 67 R 7.48 4.17 0.00 1.88 2.05 0.00 3.15 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.63 0.00 68 N 7.74 4.67 0.00 2.63 2.70 0.00 0.00 7.14 7.90 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 69 P 0.00 4.41 0.00 2.21 2.20 0.00 3.92 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 70 K 7.95 3.73 0.00 1.92 1.94 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.47 7.81 71 P 0.00 4.35 0.00 2.17 2.05 0.00 3.72 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 1.98 1.95 0.00 72 V 8.11 4.19 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 0.91 0.00 0.00 0.98 0.00 0.00 73 R 8.55 4.08 0.00 1.79 1.84 0.00 3.28 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 74 V 8.03 4.63 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 0.96 0.00 0.00 0.99 0.00 0.00 75 T 8.11 4.77 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 1.21 0.00 0.00 76 L 8.26 4.22 0.00 1.73 1.75 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.08 4.34 0.00 2.63 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 78 E 7.49 4.27 0.00 2.00 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 2.27 0.00 79 L 7.39 4.16 0.00 1.72 1.62 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00