Assignment w1 w2 D3H-N 120.1 8.4 I4H-N 122.7 8.67 Q5H-N 125.6 8.526 V6H-N 126.0 9.036 Q7H-N 126.3 9.088 V8H-N 125.5 9.199 N9H-N 126.1 9.258 N9HD21-ND2 112.8 6.86 N9HD22-ND2 112.8 8.04 I10H-N 125.1 8.921 D11H-N 125.7 8.426 D12H-N 123.1 8.397 K15H-N 121.4 7.701 N16H-N 122.1 8.503 Q17H-N 121.4 8.562 D18H-N 123.4 8.304 L19H-N 123.0 8.719 T20H-N 116.0 7.898 Y21H-N 123.2 9.047 T22H-N 118.3 8.601 V23H-N 120.0 9.026 T24H-N 110.7 8.785 T25H-N 109.8 7.294 E26H-N 121.8 9.08 S27H-N 115.5 8.321 E28H-N 123.2 7.699 L29H-N 120.0 7.86 Q30H-N 117.0 7.941 K31H-N 119.3 7.323 V32H-N 119.6 7.683 L33H-N 118.8 8.316 N34H-N 118.2 7.951 E35H-N 120.8 7.688 L36H-N 121.7 8.504 K37H-N 120.2 8.13 D38H-N 117.2 7.135 Y39H-N 121.5 7.769 I40H-N 119.3 8.922 E41H-N 120.9 8.244 E42H-N 118.4 7.752 Q43H-N 114.8 7.834 Q43HE21-NE2 114.3 6.61 Q43HE22-NE2 114.3 6.77 G44H-N 107.5 7.684 A45H-N 119.0 7.189 K46H-N 122.4 9.002 R47H-N 116.9 7.709 V48H-N 123.7 8.209 R49H-N 126.5 8.805 I50H-N 125.2 9.189 S51H-N 122.6 9.236 I52H-N 122.8 9.054 T53H-N 122.8 7.896 A54H-N 127.0 8.665 R55H-N 122.5 9.133 T56H-N 106.1 7.211 E57H-N 124.0 9.053 K58H-N 117.6 7.887 E59H-N 119.8 7.341 A60H-N 121.0 7.699 E61H-N 116.5 7.749 K62H-N 120.6 7.395 F63H-N 117.4 8.302 A64H-N 121.6 8.628 A65H-N 117.3 7.409 I66H-N 117.6 7.207 L67H-N 119.8 7.848 I68H-N 120.2 9.037 K69H-N 118.5 7.069 V70H-N 119.7 7.383 F71H-N 116.8 8.193 A72H-N 122.4 8.694 E73H-N 120.0 8.192 L74H-N 117.3 7.534 G75H-N 105.8 7.636 Y76H-N 120.3 8.06 N77H-N 119.1 8.53 D78H-N 120.1 8.162 I79H-N 120.4 7.95 N80H-N 125.1 8.661 N80HD21-ND2 114.2 6.73 N80HD22-ND2 114.2 7.43 V81H-N 125.5 8.56 T82H-N 120.8 9.077 W83H-N 125.1 8.873 W83HE1-NE1 129.9 10.28 D84H-N 126.9 7.806 D86H-N 119.0 8.225 T87H-N 115.1 9.105 V88H-N 127.4 9.394 T89H-N 124.8 9.183 V90H-N 127.3 9.189 E91H-N 127.2 8.477 G92H-N 110.3 8.43 Q93H-N 118.2 8.609 L94H-N 124.9 8.558 E95H-N 123.9 8.433 G96H-N 110.6 8.45 G97H-N 109.0 8.284 S98H-N 115.3 8.13 L99H-N 123.6 8.201 E100H-N 120.3 8.085 H101H-N 118.9 8.156 H102H-N 119.4 8.349 H103H-N 125.3 8.151