NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
630199 |
6e4j   |
30494 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
assign (resid 3 and name HN ) (resid 4 and name HN ) 2.85 1.05 1.05 !peak 2 #SUP 1.00 assign (resid 3 and name HN ) (resid 5 and name HN ) 3.51 1.71 1.71 !peak 3 #SUP 0.73 #QF 0.73 assign (resid 3 and name HN ) (resid 38 and name HA ) 4.02 2.22 2.22 !peak 4 #SUP 0.74 #QF 0.74 assign (resid 2 and name HB1 ) (resid 3 and name HN ) 3.48 1.68 1.68 !peak 7 #SUP 1.00 assign (resid 3 and name HN ) (resid 3 and name HB ) 2.73 0.93 0.93 !peak 8 #SUP 0.99 #QF 0.99 assign (resid 3 and name HN ) (resid 4 and name HB ) 3.80 2.00 2.00 !peak 9 #SUP 0.90 #QF 0.90 assign (resid 3 and name HN ) (resid 3 and name HG1* ) 2.66 0.86 0.86 !peak 10 #SUP 0.97 #QF 0.97 assign (resid 62 and name HN ) (resid 65 and name HN ) 3.77 1.97 1.97 !peak 12 #SUP 0.97 #QF 0.97 assign (resid 4 and name HN ) (resid 5 and name HN ) 2.67 0.87 0.87 !peak 16 #SUP 0.96 #QF 0.96 assign (resid 61 and name HN ) (resid 62 and name HN ) 2.76 0.96 0.96 !peak 17 #SUP 1.00 assign (resid 4 and name HN ) (resid 38 and name HA ) 3.59 1.79 1.79 !peak 19 #SUP 0.56 #QF 0.56 assign (resid 60 and name HA ) (resid 62 and name HN ) 3.85 2.05 2.05 !peak 21 #SUP 1.00 assign (resid 62 and name HN ) (resid 62 and name HB1 ) 2.54 0.74 0.74 !peak 27 #SUP 0.81 #QF 0.81 assign (resid 4 and name HN ) (resid 4 and name HB ) 2.58 0.78 0.78 !peak 28 #SUP 0.88 #QF 0.88 assign (resid 50 and name HB2 ) (resid 62 and name HN ) 3.94 2.14 2.14 !peak 29 #SUP 1.00 #QF 0.95 assign (resid 62 and name HN ) (resid 62 and name HG2 ) 2.97 1.17 1.17 !peak 30 #SUP 1.00 #QF 0.98 assign (resid 61 and name HB ) (resid 62 and name HN ) 2.80 1.00 1.00 !peak 31 #SUP 0.99 #QF 0.99 assign (resid 3 and name HG1* ) (resid 4 and name HN ) 2.93 1.13 1.13 !peak 33 #SUP 0.71 #QF 0.59 assign (resid 4 and name HN ) (resid 4 and name HG1* ) 3.08 1.28 1.28 !peak 35 #SUP 0.95 #QF 0.95 assign (resid 61 and name HG2* ) (resid 62 and name HN ) 2.96 1.16 1.16 !peak 36 #SUP 1.00 assign (resid 61 and name HD1* ) (resid 62 and name HN ) 3.53 1.73 1.73 !peak 37 #SUP 1.00 assign (resid 61 and name HG12 ) (resid 62 and name HN ) 3.80 2.00 2.00 !peak 38 #SUP 0.97 #QF 0.97 assign (resid 48 and name HN ) (resid 49 and name HN ) 2.76 0.96 0.96 !peak 40 #SUP 0.99 #QF 0.99 assign (resid 5 and name HN ) (resid 8 and name HN ) 3.96 2.16 2.16 !peak 41 #SUP 0.98 #QF 0.98 assign (resid 5 and name HN ) (resid 7 and name HN ) 3.49 1.69 1.69 !peak 42 #SUP 0.99 #QF 0.99 assign (resid 45 and name HN ) (resid 48 and name HN ) 3.78 1.98 1.97 !peak 43 #SUP 0.97 #QF 0.97 assign (resid 2 and name HA ) (resid 5 and name HN ) 3.75 1.95 1.95 !peak 46 #SUP 0.99 #QF 0.99 assign (resid 2 and name HB2 ) (resid 5 and name HN ) 3.51 1.71 1.71 !peak 48 #SUP 0.98 #QF 0.86 assign (resid 3 and name HA ) (resid 5 and name HN ) 3.80 2.00 2.00 !peak 48 #SUP 0.98 #QF 0.86 assign (resid 46 and name HA ) (resid 48 and name HN ) 3.61 1.81 1.81 !peak 50 #SUP 0.96 #QF 0.96 assign (resid 45 and name HA ) (resid 48 and name HN ) 3.07 1.27 1.27 !peak 52 #SUP 0.99 #QF 0.99 assign (resid 48 and name HN ) (resid 48 and name HG2 ) 2.64 0.84 0.84 !peak 54 #SUP 0.92 #QF 0.92 assign (resid 48 and name HN ) (resid 48 and name HB1 ) 2.81 1.01 1.01 !peak 55 #SUP 0.96 #QF 0.96 assign (resid 5 and name HN ) (resid 6 and name HB1 ) 3.82 2.02 2.02 !peak 56 #SUP 0.88 #QF 0.88 assign (resid 4 and name HB ) (resid 5 and name HN ) 3.30 1.50 1.50 !peak 57 #SUP 1.00 assign (resid 47 and name HG1 ) (resid 48 and name HN ) 3.55 1.75 1.74 !peak 58 #SUP 0.98 #QF 0.98 assign (resid 5 and name HN ) (resid 5 and name HB1 ) 2.72 0.92 0.92 !peak 59 #SUP 0.86 #QF 0.69 assign (resid 47 and name HB1 ) (resid 48 and name HN ) 3.20 1.40 1.40 !peak 60 #SUP 0.98 #QF 0.98 assign (resid 5 and name HN ) (resid 5 and name HD* ) 3.45 1.65 1.65 !peak 61 #SUP 0.98 #QF 0.98 assign (resid 44 and name HG1* ) (resid 48 and name HN ) 4.29 2.49 2.49 !peak 63 #SUP 0.99 #QF 0.41 assign (resid 45 and name HG1* ) (resid 48 and name HN ) 4.35 2.55 2.55 !peak 63 #SUP 0.99 #QF 0.41 assign (resid 3 and name HG2* ) (resid 5 and name HN ) 3.84 2.04 2.04 !peak 64 #SUP 0.88 #QF 0.88 assign (resid 44 and name HG2* ) (resid 48 and name HN ) 4.29 2.49 2.49 !peak 65 #SUP 0.97 #QF 0.96 assign (resid 45 and name HG2* ) (resid 48 and name HN ) 4.35 2.55 2.55 !peak 65 #SUP 0.97 #QF 0.96 assign (resid 4 and name HG1* ) (resid 5 and name HN ) 3.15 1.35 1.35 !peak 66 #SUP 0.89 #QF 0.89 assign (resid 6 and name HN ) (resid 8 and name HN ) 3.80 2.00 2.00 !peak 67 #SUP 1.00 #QF 0.99 assign (resid 4 and name HA ) (resid 6 and name HN ) 3.64 1.84 1.84 !peak 72 #SUP 0.97 #QF 0.97 assign (resid 6 and name HN ) (resid 6 and name HG2 ) 3.32 1.52 1.52 !peak 74 #SUP 0.99 #QF 0.99 assign (resid 6 and name HN ) (resid 6 and name HB1 ) 2.60 0.80 0.80 !peak 75 #SUP 0.86 #QF 0.86 assign (resid 5 and name HB1 ) (resid 6 and name HN ) 2.71 0.91 0.91 !peak 76 #SUP 0.65 #QF 0.65 assign (resid 5 and name HD* ) (resid 6 and name HN ) 3.72 1.92 1.92 !peak 77 #SUP 0.82 #QF 0.59 assign (resid 3 and name HG2* ) (resid 6 and name HN ) 3.44 1.64 1.64 !peak 80 #SUP 0.83 #QF 0.83 assign (resid 4 and name HG1* ) (resid 6 and name HN ) 4.33 2.53 2.53 !peak 81 #SUP 0.90 #QF 0.69 assign (resid 4 and name HG2* ) (resid 6 and name HN ) 4.33 2.53 2.53 !peak 81 #SUP 0.90 #QF 0.69 assign (resid 7 and name HN ) (resid 8 and name HN ) 2.67 0.87 0.87 !peak 82 #SUP 0.98 #QF 0.98 assign (resid 6 and name HN ) (resid 7 and name HN ) 2.72 0.92 0.92 !peak 84 #SUP 1.00 assign (resid 5 and name HA ) (resid 7 and name HN ) 3.70 1.90 1.90 !peak 86 #SUP 0.93 #QF 0.93 assign (resid 4 and name HA ) (resid 7 and name HN ) 3.11 1.31 1.31 !peak 87 #SUP 0.99 #QF 0.99 assign (resid 7 and name HN ) (resid 7 and name HE* ) 3.82 2.02 2.02 !peak 88 #SUP 0.99 #QF 0.99 assign (resid 6 and name HG1 ) (resid 7 and name HN ) 3.62 1.82 1.82 !peak 89 #SUP 0.97 #QF 0.97 assign (resid 6 and name HG2 ) (resid 7 and name HN ) 3.62 1.82 1.82 !peak 90 #SUP 0.99 #QF 0.99 assign (resid 6 and name HB1 ) (resid 7 and name HN ) 3.13 1.33 1.33 !peak 91 #SUP 0.61 #QF 0.61 assign (resid 7 and name HN ) (resid 7 and name HB2 ) 2.62 0.82 0.82 !peak 92 #SUP 0.98 #QF 0.98 assign (resid 7 and name HN ) (resid 7 and name HB1 ) 3.02 1.22 1.22 !peak 93 #SUP 0.96 #QF 0.96 assign (resid 7 and name HN ) (resid 7 and name HG1 ) 3.06 1.26 1.26 !peak 94 #SUP 0.92 #QF 0.92 assign (resid 7 and name HN ) (resid 68 and name HD2* ) 3.91 2.11 2.11 !peak 96 #SUP 0.90 #QF 0.90 assign (resid 7 and name HN ) (resid 8 and name HD1* ) 3.93 2.13 2.13 !peak 97 #SUP 0.94 #QF 0.87 assign (resid 7 and name HN ) (resid 8 and name HD2* ) 3.93 2.13 2.13 !peak 97 #SUP 0.94 #QF 0.87 assign (resid 9 and name HN ) (resid 10 and name HN ) 2.73 0.93 0.93 !peak 99 #SUP 0.99 #QF 0.99 assign (resid 6 and name HN ) (resid 9 and name HN ) 3.92 2.12 2.12 !peak 100 #SUP 0.96 #QF 0.96 assign (resid 6 and name HA ) (resid 9 and name HN ) 3.21 1.41 1.41 !peak 102 #SUP 0.97 #QF 0.53 assign (resid 5 and name HA ) (resid 9 and name HN ) 3.42 1.62 1.62 !peak 104 #SUP 0.99 #QF 0.99 assign (resid 9 and name HN ) (resid 9 and name HB1 ) 3.04 1.24 1.24 !peak 106 #SUP 0.99 #QF 0.87 assign (resid 9 and name HN ) (resid 9 and name HG1 ) 2.90 1.10 1.10 !peak 106 #SUP 0.99 #QF 0.87 assign (resid 9 and name HN ) (resid 9 and name HB2 ) 3.04 1.24 1.24 !peak 107 #SUP 0.89 #QF 0.89 assign (resid 8 and name HG ) (resid 9 and name HN ) 3.93 2.13 2.13 !peak 108 #SUP 0.99 #QF 0.98 assign (resid 9 and name HN ) (resid 11 and name HB* ) 4.25 2.45 2.45 !peak 110 #SUP 1.00 #QF 0.28 assign (resid 8 and name HB1 ) (resid 9 and name HN ) 3.24 1.44 1.44 !peak 111 #SUP 0.99 #QF 0.99 assign (resid 9 and name HN ) (resid 29 and name HG1* ) 3.33 1.53 1.53 !peak 112 #SUP 0.99 #QF 0.99 assign (resid 8 and name HD1* ) (resid 9 and name HN ) 4.21 2.41 2.41 !peak 113 #SUP 1.00 #QF 0.96 assign (resid 8 and name HD2* ) (resid 9 and name HN ) 4.21 2.41 2.41 !peak 113 #SUP 1.00 #QF 0.96 assign (resid 10 and name HN ) (resid 13 and name HN ) 3.79 1.99 1.99 !peak 117 #SUP 0.95 #QF 0.95 assign (resid 10 and name HN ) (resid 11 and name HA ) 3.98 2.18 2.18 !peak 120 #SUP 1.00 assign (resid 10 and name HN ) (resid 10 and name HB2 ) 2.53 0.73 0.73 !peak 123 #SUP 0.97 #QF 0.97 assign (resid 10 and name HN ) (resid 11 and name HB* ) 3.88 2.08 2.08 !peak 126 #SUP 1.00 #QF 0.86 assign (resid 10 and name HN ) (resid 13 and name HD1* ) 3.54 1.74 1.74 !peak 127 #SUP 0.93 #QF 0.93 assign (resid 9 and name HN ) (resid 11 and name HN ) 3.34 1.54 1.54 !peak 129 #SUP 0.99 #QF 0.99 assign (resid 10 and name HN ) (resid 11 and name HN ) 2.64 0.84 0.84 !peak 130 #SUP 0.76 #QF 0.76 assign (resid 28 and name HN ) (resid 31 and name HN ) 3.75 1.95 1.95 !peak 131 #SUP 0.94 #QF 0.94 assign (resid 8 and name HA ) (resid 11 and name HN ) 3.16 1.36 1.36 !peak 134 #SUP 0.99 #QF 0.91 assign (resid 9 and name HA ) (resid 11 and name HN ) 3.60 1.80 1.80 !peak 135 #SUP 0.97 #QF 0.97 assign (resid 10 and name HB2 ) (resid 11 and name HN ) 3.37 1.57 1.57 !peak 138 #SUP 1.00 #QF 0.98 assign (resid 10 and name HB1 ) (resid 11 and name HN ) 3.53 1.73 1.73 !peak 138 #SUP 1.00 #QF 0.98 assign (resid 10 and name HD* ) (resid 11 and name HN ) 3.67 1.87 1.87 !peak 140 #SUP 0.87 #QF 0.87 assign (resid 11 and name HN ) (resid 11 and name HB* ) 2.48 0.68 0.68 !peak 142 #SUP 0.95 #QF 0.95 assign (resid 8 and name HB1 ) (resid 11 and name HN ) 4.28 2.48 2.48 !peak 143 #SUP 0.96 #QF 0.96 assign (resid 11 and name HN ) (resid 68 and name HD2* ) 3.61 1.81 1.81 !peak 144 #SUP 0.98 #QF 0.87 assign (resid 9 and name HN ) (resid 12 and name HN ) 3.68 1.88 1.88 !peak 146 #SUP 1.00 assign (resid 11 and name HN ) (resid 12 and name HN ) 2.76 0.96 0.96 !peak 148 #SUP 0.94 #QF 0.94 assign (resid 12 and name HN ) (resid 14 and name HN ) 3.39 1.59 1.59 !peak 149 #SUP 0.97 #QF 0.97 assign (resid 8 and name HA ) (resid 12 and name HN ) 3.42 1.62 1.62 !peak 151 #SUP 0.99 #QF 0.98 assign (resid 10 and name HA ) (resid 12 and name HN ) 3.71 1.91 1.91 !peak 151 #SUP 0.99 #QF 0.98 assign (resid 12 and name HN ) (resid 12 and name HB2 ) 2.94 1.14 1.14 !peak 155 #SUP 0.98 #QF 0.98 assign (resid 12 and name HN ) (resid 12 and name HB1 ) 2.94 1.14 1.14 !peak 156 #SUP 0.95 #QF 0.93 assign (resid 11 and name HB* ) (resid 12 and name HN ) 2.72 0.92 0.92 !peak 157 #SUP 0.97 #QF 0.97 assign (resid 12 and name HN ) (resid 64 and name HD2* ) 3.73 1.93 1.93 !peak 158 #SUP 0.96 #QF 0.96 assign (resid 12 and name HN ) (resid 12 and name HD1* ) 3.49 1.69 1.69 !peak 159 #SUP 0.99 #QF 0.98 assign (resid 12 and name HN ) (resid 64 and name HD1* ) 3.73 1.93 1.93 !peak 159 #SUP 0.99 #QF 0.98 assign (resid 12 and name HN ) (resid 13 and name HN ) 2.79 0.99 0.99 !peak 160 #SUP 0.98 #QF 0.98 assign (resid 11 and name HN ) (resid 13 and name HN ) 3.41 1.61 1.61 !peak 161 #SUP 0.96 #QF 0.96 assign (resid 13 and name HN ) (resid 14 and name HN ) 2.73 0.93 0.93 !peak 162 #SUP 0.99 #QF 0.99 assign (resid 10 and name HA ) (resid 13 and name HN ) 3.01 1.21 1.21 !peak 164 #SUP 0.95 #QF 0.95 assign (resid 13 and name HN ) (resid 14 and name HG2 ) 3.73 1.93 1.93 !peak 167 #SUP 0.96 #QF 0.96 assign (resid 13 and name HN ) (resid 13 and name HB ) 2.56 0.76 0.76 !peak 168 #SUP 0.97 #QF 0.97 assign (resid 12 and name HB1 ) (resid 13 and name HN ) 3.22 1.42 1.42 !peak 169 #SUP 0.97 #QF 0.97 assign (resid 13 and name HN ) (resid 13 and name HG11 ) 2.67 0.87 0.87 !peak 170 #SUP 0.98 #QF 0.98 assign (resid 11 and name HB* ) (resid 13 and name HN ) 3.87 2.07 2.07 !peak 171 #SUP 1.00 #QF 0.91 assign (resid 13 and name HN ) (resid 14 and name HB2 ) 4.11 2.31 2.31 !peak 171 #SUP 1.00 #QF 0.91 assign (resid 13 and name HN ) (resid 13 and name HD1* ) 2.83 1.03 1.03 !peak 173 #SUP 0.97 #QF 0.97 assign (resid 12 and name HD1* ) (resid 13 and name HN ) 3.64 1.84 1.84 !peak 174 #SUP 0.96 #QF 0.96 assign (resid 14 and name HN ) (resid 15 and name HN ) 2.74 0.94 0.94 !peak 177 #SUP 0.99 #QF 0.99 assign (resid 11 and name HA ) (resid 14 and name HN ) 3.19 1.39 1.39 !peak 182 #SUP 0.93 #QF 0.83 assign (resid 14 and name HN ) (resid 14 and name HG2 ) 2.76 0.96 0.96 !peak 184 #SUP 0.99 #QF 0.99 assign (resid 13 and name HB ) (resid 14 and name HN ) 2.84 1.04 1.04 !peak 185 #SUP 0.98 #QF 0.98 assign (resid 14 and name HN ) (resid 16 and name HB2 ) 4.06 2.26 2.26 !peak 186 #SUP 0.55 #QF 0.55 assign (resid 14 and name HN ) (resid 14 and name HB1 ) 2.99 1.19 1.19 !peak 187 #SUP 0.99 #QF 0.99 assign (resid 14 and name HN ) (resid 14 and name HB2 ) 2.68 0.88 0.88 !peak 189 #SUP 0.99 #QF 0.99 assign (resid 13 and name HG12 ) (resid 14 and name HN ) 3.86 2.06 2.06 !peak 190 #SUP 0.98 #QF 0.98 assign (resid 13 and name HG2* ) (resid 14 and name HN ) 2.88 1.08 1.08 !peak 191 #SUP 0.98 #QF 0.98 assign (resid 14 and name HN ) (resid 15 and name HG1* ) 3.57 1.77 1.77 !peak 192 #SUP 0.94 #QF 0.94 assign (resid 15 and name HN ) (resid 18 and name HD* ) 3.86 2.06 2.06 !peak 197 #SUP 0.59 #QF 0.59 assign (resid 15 and name HN ) (resid 22 and name HE* ) 3.96 2.16 2.16 !peak 198 #SUP 0.96 #QF 0.96 assign (resid 12 and name HA ) (resid 15 and name HN ) 3.32 1.52 1.51 !peak 200 #SUP 0.94 #QF 0.77 assign (resid 11 and name HA ) (resid 15 and name HN ) 3.47 1.67 1.67 !peak 201 #SUP 0.88 #QF 0.88 assign (resid 15 and name HN ) (resid 18 and name HB2 ) 3.94 2.14 2.14 !peak 202 #SUP 0.84 #QF 0.84 assign (resid 15 and name HN ) (resid 17 and name HD2 ) 3.74 1.94 1.94 !peak 203 #SUP 0.98 #QF 0.98 assign (resid 15 and name HN ) (resid 15 and name HB ) 3.25 1.45 1.45 !peak 204 #SUP 0.98 #QF 0.98 assign (resid 14 and name HG1 ) (resid 15 and name HN ) 3.85 2.05 2.05 !peak 205 #SUP 0.97 #QF 0.97 assign (resid 14 and name HG2 ) (resid 15 and name HN ) 3.60 1.80 1.80 !peak 206 #SUP 0.99 #QF 0.99 assign (resid 13 and name HB ) (resid 15 and name HN ) 3.78 1.98 1.98 !peak 207 #SUP 0.72 #QF 0.72 assign (resid 14 and name HB1 ) (resid 15 and name HN ) 3.10 1.30 1.30 !peak 208 #SUP 0.96 #QF 0.96 assign (resid 14 and name HB2 ) (resid 15 and name HN ) 3.00 1.20 1.20 !peak 209 #SUP 0.97 #QF 0.97 assign (resid 15 and name HN ) (resid 15 and name HG2* ) 2.61 0.81 0.81 !peak 210 #SUP 0.98 #QF 0.98 assign (resid 15 and name HN ) (resid 16 and name HN ) 2.71 0.91 0.91 !peak 212 #SUP 0.99 #QF 0.99 assign (resid 16 and name HN ) (resid 18 and name HE* ) 4.01 2.21 2.21 !peak 214 #SUP 1.00 #QF 0.30 assign (resid 16 and name HN ) (resid 22 and name HD* ) 4.16 2.36 2.36 !peak 214 #SUP 1.00 #QF 0.30 assign (resid 16 and name HN ) (resid 22 and name HE* ) 3.62 1.82 1.82 !peak 215 #SUP 1.00 assign (resid 13 and name HA ) (resid 16 and name HN ) 3.26 1.46 1.46 !peak 218 #SUP 0.97 #QF 0.97 assign (resid 16 and name HN ) (resid 17 and name HD1 ) 3.05 1.25 1.25 !peak 219 #SUP 0.99 #QF 0.99 assign (resid 16 and name HN ) (resid 17 and name HD2 ) 3.13 1.33 1.33 !peak 220 #SUP 0.99 #QF 0.99 assign (resid 15 and name HB ) (resid 16 and name HN ) 3.48 1.68 1.68 !peak 221 #SUP 0.94 #QF 0.94 assign (resid 16 and name HN ) (resid 16 and name HB2 ) 2.79 0.99 0.99 !peak 222 #SUP 0.84 #QF 0.84 assign (resid 16 and name HN ) (resid 17 and name HG2 ) 3.84 2.04 2.04 !peak 223 #SUP 0.70 #QF 0.70 assign (resid 16 and name HN ) (resid 19 and name HG2* ) 3.37 1.57 1.57 !peak 224 #SUP 0.95 #QF 0.95 assign (resid 15 and name HG2* ) (resid 16 and name HN ) 2.97 1.17 1.17 !peak 225 #SUP 0.98 #QF 0.98 assign (resid 16 and name HN ) (resid 16 and name HG1 ) 3.71 1.91 1.91 !peak 227 #SUP 0.97 #QF 0.97 assign (resid 16 and name HN ) (resid 18 and name HN ) 3.80 2.00 2.00 !peak 229 #SUP 0.95 #QF 0.95 assign (resid 18 and name HN ) (resid 19 and name HN ) 2.58 0.78 0.78 !peak 230 #SUP 0.98 #QF 0.98 assign (resid 18 and name HN ) (resid 18 and name HE* ) 3.49 1.69 1.69 !peak 231 #SUP 1.00 assign (resid 16 and name HA ) (resid 18 and name HN ) 3.60 1.80 1.80 !peak 234 #SUP 0.95 #QF 0.95 assign (resid 18 and name HN ) (resid 18 and name HB2 ) 3.00 1.20 1.20 !peak 235 #SUP 0.97 #QF 0.97 assign (resid 17 and name HD2 ) (resid 18 and name HN ) 3.13 1.33 1.33 !peak 236 #SUP 0.98 #QF 0.98 assign (resid 18 and name HN ) (resid 18 and name HB1 ) 3.04 1.24 1.24 !peak 237 #SUP 0.96 #QF 0.96 assign (resid 15 and name HB ) (resid 18 and name HN ) 3.67 1.87 1.87 !peak 238 #SUP 0.99 #QF 0.99 assign (resid 18 and name HN ) (resid 19 and name HB ) 4.35 2.55 2.55 !peak 239 #SUP 0.92 #QF 0.92 assign (resid 17 and name HG2 ) (resid 18 and name HN ) 3.82 2.02 2.02 !peak 242 #SUP 0.97 #QF 0.97 assign (resid 18 and name HN ) (resid 19 and name HG2* ) 3.14 1.34 1.34 !peak 243 #SUP 0.91 #QF 0.91 assign (resid 19 and name HN ) (resid 20 and name HN ) 3.54 1.74 1.74 !peak 246 #SUP 0.96 #QF 0.96 assign (resid 19 and name HN ) (resid 22 and name HD* ) 3.95 2.15 2.15 !peak 249 #SUP 0.94 #QF 0.94 assign (resid 16 and name HA ) (resid 19 and name HN ) 3.27 1.47 1.47 !peak 252 #SUP 0.98 #QF 0.98 assign (resid 18 and name HB2 ) (resid 19 and name HN ) 3.52 1.72 1.72 !peak 253 #SUP 0.99 #QF 0.99 assign (resid 17 and name HD2 ) (resid 19 and name HN ) 4.01 2.21 2.21 !peak 254 #SUP 0.99 #QF 0.98 assign (resid 19 and name HN ) (resid 22 and name HB2 ) 4.35 2.55 2.55 !peak 254 #SUP 0.99 #QF 0.98 assign (resid 18 and name HB1 ) (resid 19 and name HN ) 3.35 1.55 1.55 !peak 255 #SUP 0.96 #QF 0.96 assign (resid 19 and name HN ) (resid 19 and name HG2* ) 2.55 0.75 0.75 !peak 257 #SUP 0.95 #QF 0.95 assign (resid 15 and name HG1* ) (resid 19 and name HN ) 3.85 2.05 2.05 !peak 258 #SUP 0.54 #QF 0.54 assign (resid 17 and name HB2 ) (resid 19 and name HN ) 4.35 2.55 2.55 !peak 259 #SUP 0.99 #QF 0.71 assign (resid 19 and name HA ) (resid 20 and name HN ) 2.58 0.78 0.78 !peak 263 #SUP 0.91 #QF 0.91 assign (resid 20 and name HN ) (resid 60 and name HA ) 3.60 1.80 1.80 !peak 264 #SUP 0.99 #QF 0.99 assign (resid 19 and name HB ) (resid 20 and name HN ) 2.83 1.03 1.03 !peak 267 #SUP 0.93 #QF 0.93 assign (resid 20 and name HN ) (resid 20 and name HB2 ) 2.69 0.89 0.89 !peak 268 #SUP 0.88 #QF 0.88 assign (resid 20 and name HN ) (resid 20 and name HB1 ) 2.87 1.07 1.07 !peak 269 #SUP 0.93 #QF 0.93 assign (resid 21 and name HN ) (resid 21 and name HD* ) 3.26 1.46 1.46 !peak 276 #SUP 1.00 assign (resid 21 and name HN ) (resid 21 and name HB2 ) 2.89 1.09 1.09 !peak 280 #SUP 0.87 #QF 0.87 assign (resid 20 and name HB1 ) (resid 21 and name HN ) 2.90 1.10 1.10 !peak 285 #SUP 0.99 #QF 0.99 assign (resid 21 and name HN ) (resid 22 and name HN ) 3.36 1.56 1.56 !peak 288 #SUP 1.00 assign (resid 21 and name HD* ) (resid 22 and name HN ) 3.71 1.91 1.91 !peak 291 #SUP 1.00 assign (resid 22 and name HN ) (resid 22 and name HD* ) 3.45 1.65 1.65 !peak 292 #SUP 1.00 assign (resid 21 and name HA ) (resid 22 and name HN ) 2.59 0.79 0.79 !peak 293 #SUP 0.91 #QF 0.91 assign (resid 20 and name HA ) (resid 22 and name HN ) 3.85 2.05 2.05 !peak 294 #SUP 0.88 #QF 0.88 assign (resid 21 and name HB1 ) (resid 22 and name HN ) 3.55 1.75 1.75 !peak 296 #SUP 0.99 #QF 0.99 assign (resid 22 and name HN ) (resid 22 and name HB2 ) 2.72 0.92 0.92 !peak 297 #SUP 0.97 #QF 0.97 assign (resid 22 and name HN ) (resid 22 and name HB1 ) 2.71 0.91 0.91 !peak 298 #SUP 0.98 #QF 0.98 assign (resid 22 and name HN ) (resid 24 and name HG2 ) 4.29 2.49 2.49 !peak 300 #SUP 0.95 #QF 0.95 assign (resid 20 and name HB1 ) (resid 22 and name HN ) 4.32 2.52 2.52 !peak 301 #SUP 0.99 #QF 0.99 assign (resid 19 and name HG2* ) (resid 22 and name HN ) 3.23 1.43 1.43 !peak 302 #SUP 0.92 #QF 0.92 assign (resid 23 and name HN ) (resid 25 and name HN ) 3.64 1.84 1.84 !peak 305 #SUP 0.97 #QF 0.97 assign (resid 22 and name HN ) (resid 23 and name HN ) 2.88 1.08 1.08 !peak 306 #SUP 0.97 #QF 0.97 assign (resid 23 and name HN ) (resid 23 and name HD22 ) 3.71 1.91 1.91 !peak 308 #SUP 0.99 #QF 0.99 assign (resid 22 and name HD* ) (resid 23 and name HN ) 3.22 1.42 1.42 !peak 309 #SUP 0.98 #QF 0.98 assign (resid 22 and name HB2 ) (resid 23 and name HN ) 3.27 1.47 1.47 !peak 313 #SUP 0.96 #QF 0.96 assign (resid 22 and name HB1 ) (resid 23 and name HN ) 2.73 0.93 0.93 !peak 314 #SUP 0.97 #QF 0.83 assign (resid 23 and name HN ) (resid 23 and name HB2 ) 3.00 1.20 1.20 !peak 314 #SUP 0.97 #QF 0.83 assign (resid 23 and name HN ) (resid 23 and name HB1 ) 3.00 1.20 1.20 !peak 315 #SUP 0.96 #QF 0.96 assign (resid 23 and name HN ) (resid 24 and name HG2 ) 3.72 1.92 1.92 !peak 316 #SUP 0.88 #QF 0.88 assign (resid 22 and name HN ) (resid 24 and name HN ) 3.88 2.08 2.08 !peak 320 #SUP 1.00 assign (resid 24 and name HN ) (resid 27 and name HN ) 3.91 2.11 2.11 !peak 321 #SUP 0.99 #QF 0.99 assign (resid 24 and name HN ) (resid 57 and name HE* ) 3.94 2.14 2.14 !peak 322 #SUP 0.87 #QF 0.87 assign (resid 21 and name HA ) (resid 24 and name HN ) 3.60 1.80 1.80 !peak 323 #SUP 0.99 #QF 0.99 assign (resid 21 and name HB1 ) (resid 24 and name HN ) 3.30 1.50 1.50 !peak 326 #SUP 0.96 #QF 0.96 assign (resid 23 and name HB2 ) (resid 24 and name HN ) 3.23 1.43 1.43 !peak 327 #SUP 0.97 #QF 0.97 assign (resid 23 and name HB1 ) (resid 24 and name HN ) 3.23 1.43 1.43 !peak 328 #SUP 0.99 #QF 0.99 assign (resid 24 and name HN ) (resid 24 and name HG1 ) 3.29 1.49 1.49 !peak 329 #SUP 0.98 #QF 0.98 assign (resid 24 and name HN ) (resid 24 and name HG2 ) 2.77 0.97 0.97 !peak 330 #SUP 0.99 #QF 0.99 assign (resid 24 and name HN ) (resid 25 and name HB1 ) 3.83 2.03 2.03 !peak 331 #SUP 0.91 #QF 0.91 assign (resid 24 and name HN ) (resid 25 and name HB2 ) 3.91 2.11 2.11 !peak 332 #SUP 0.98 #QF 0.98 assign (resid 24 and name HN ) (resid 24 and name HB2 ) 3.04 1.24 1.24 !peak 333 #SUP 0.97 #QF 0.97 assign (resid 24 and name HN ) (resid 25 and name HN ) 2.81 1.01 1.01 !peak 334 #SUP 1.00 assign (resid 25 and name HN ) (resid 26 and name HN ) 2.71 0.91 0.91 !peak 335 #SUP 1.00 assign (resid 22 and name HN ) (resid 25 and name HN ) 3.82 2.02 2.02 !peak 338 #SUP 0.99 #QF 0.99 assign (resid 25 and name HN ) (resid 57 and name HD* ) 3.75 1.95 1.95 !peak 340 #SUP 0.88 #QF 0.88 assign (resid 25 and name HN ) (resid 57 and name HE* ) 3.17 1.37 1.37 !peak 341 #SUP 1.00 assign (resid 22 and name HD* ) (resid 25 and name HN ) 4.35 2.55 2.55 !peak 342 #SUP 1.00 #QF 0.83 assign (resid 25 and name HN ) (resid 57 and name HZ ) 4.35 2.55 2.55 !peak 342 #SUP 1.00 #QF 0.83 assign (resid 22 and name HA ) (resid 25 and name HN ) 3.12 1.32 1.32 !peak 345 #SUP 1.00 #QF 0.89 assign (resid 25 and name HN ) (resid 26 and name HA ) 4.05 2.25 2.25 !peak 346 #SUP 0.98 #QF 0.98 assign (resid 21 and name HB1 ) (resid 25 and name HN ) 3.53 1.73 1.73 !peak 347 #SUP 0.99 #QF 0.99 assign (resid 22 and name HB1 ) (resid 25 and name HN ) 4.35 2.55 2.55 !peak 348 #SUP 0.98 #QF 0.67 assign (resid 24 and name HG1 ) (resid 25 and name HN ) 3.72 1.92 1.92 !peak 349 #SUP 1.00 assign (resid 24 and name HB1 ) (resid 25 and name HN ) 2.93 1.13 1.13 !peak 350 #SUP 0.89 #QF 0.89 assign (resid 25 and name HN ) (resid 25 and name HB1 ) 2.80 1.00 1.00 !peak 351 #SUP 0.99 #QF 0.99 assign (resid 25 and name HN ) (resid 25 and name HB2 ) 2.76 0.96 0.96 !peak 352 #SUP 0.98 #QF 0.98 assign (resid 25 and name HN ) (resid 25 and name HG ) 3.57 1.77 1.77 !peak 353 #SUP 1.00 assign (resid 24 and name HB2 ) (resid 25 and name HN ) 3.09 1.29 1.29 !peak 354 #SUP 0.98 #QF 0.98 assign (resid 25 and name HN ) (resid 26 and name HB1 ) 4.14 2.34 2.34 !peak 355 #SUP 0.99 #QF 0.99 assign (resid 25 and name HN ) (resid 26 and name HG* ) 4.35 2.55 2.55 !peak 356 #SUP 0.81 #QF 0.81 assign (resid 25 and name HN ) (resid 25 and name HD1* ) 3.48 1.68 1.68 !peak 358 #SUP 1.00 #QF 0.51 assign (resid 24 and name HN ) (resid 26 and name HN ) 3.37 1.57 1.57 !peak 360 #SUP 0.99 #QF 0.99 assign (resid 26 and name HN ) (resid 29 and name HN ) 3.91 2.11 2.11 !peak 362 #SUP 1.00 assign (resid 26 and name HN ) (resid 27 and name HN ) 2.76 0.96 0.96 !peak 364 #SUP 0.99 #QF 0.99 assign (resid 22 and name HD* ) (resid 26 and name HN ) 3.77 1.97 1.97 !peak 365 #SUP 0.98 #QF 0.98 assign (resid 23 and name HA ) (resid 26 and name HN ) 3.21 1.41 1.41 !peak 367 #SUP 0.99 #QF 0.99 assign (resid 22 and name HA ) (resid 26 and name HN ) 3.29 1.49 1.49 !peak 368 #SUP 0.98 #QF 0.98 assign (resid 26 and name HN ) (resid 28 and name HB1 ) 4.29 2.49 2.49 !peak 370 #SUP 1.00 #QF 0.97 assign (resid 26 and name HN ) (resid 29 and name HB ) 4.35 2.55 2.55 !peak 370 #SUP 1.00 #QF 0.97 assign (resid 25 and name HB1 ) (resid 26 and name HN ) 2.91 1.11 1.11 !peak 371 #SUP 0.96 #QF 0.96 assign (resid 26 and name HN ) (resid 26 and name HB2 ) 2.66 0.86 0.86 !peak 372 #SUP 0.99 #QF 0.99 assign (resid 25 and name HG ) (resid 26 and name HN ) 3.59 1.79 1.79 !peak 373 #SUP 0.74 #QF 0.74 assign (resid 26 and name HN ) (resid 27 and name HB* ) 3.51 1.71 1.71 !peak 374 #SUP 0.90 #QF 0.90 assign (resid 26 and name HN ) (resid 26 and name HB1 ) 2.76 0.96 0.96 !peak 375 #SUP 0.99 #QF 0.99 assign (resid 26 and name HN ) (resid 29 and name HG2* ) 4.09 2.29 2.29 !peak 376 #SUP 0.99 #QF 0.99 assign (resid 12 and name HD1* ) (resid 26 and name HN ) 3.64 1.84 1.84 !peak 377 #SUP 0.93 #QF 0.56 assign (resid 12 and name HD2* ) (resid 26 and name HN ) 3.64 1.84 1.84 !peak 378 #SUP 0.99 #QF 0.99 assign (resid 25 and name HN ) (resid 27 and name HN ) 3.45 1.65 1.65 !peak 381 #SUP 0.92 #QF 0.92 assign (resid 24 and name HB1 ) (resid 27 and name HN ) 4.32 2.52 2.52 !peak 386 #SUP 0.95 #QF 0.94 assign (resid 24 and name HB1 ) (resid 28 and name HN ) 4.35 2.55 2.55 !peak 386 #SUP 0.95 #QF 0.94 assign (resid 26 and name HB2 ) (resid 27 and name HN ) 2.97 1.17 1.17 !peak 387 #SUP 0.94 #QF 0.94 assign (resid 26 and name HD1 ) (resid 27 and name HN ) 4.00 2.20 2.20 !peak 388 #SUP 0.96 #QF 0.96 assign (resid 27 and name HN ) (resid 27 and name HB* ) 2.44 0.64 0.64 !peak 389 #SUP 0.92 #QF 0.92 assign (resid 26 and name HB1 ) (resid 27 and name HN ) 3.07 1.27 1.27 !peak 390 #SUP 1.00 assign (resid 26 and name HG* ) (resid 27 and name HN ) 3.45 1.65 1.65 !peak 391 #SUP 0.95 #QF 0.95 assign (resid 28 and name HN ) (resid 29 and name HN ) 2.68 0.88 0.88 !peak 393 #SUP 0.99 #QF 0.99 assign (resid 28 and name HN ) (resid 57 and name HZ ) 3.56 1.76 1.76 !peak 394 #SUP 0.99 #QF 0.99 assign (resid 28 and name HN ) (resid 28 and name HB1 ) 2.62 0.83 0.83 !peak 396 #SUP 0.98 #QF 0.98 assign (resid 28 and name HN ) (resid 28 and name HB2 ) 2.64 0.84 0.84 !peak 397 #SUP 0.83 #QF 0.83 assign (resid 29 and name HN ) (resid 31 and name HN ) 3.56 1.76 1.76 !peak 404 #SUP 0.99 #QF 0.99 assign (resid 29 and name HN ) (resid 30 and name HB2 ) 3.80 2.00 2.00 !peak 407 #SUP 0.71 #QF 0.71 assign (resid 26 and name HA ) (resid 29 and name HN ) 3.11 1.31 1.31 !peak 408 #SUP 0.98 #QF 0.98 assign (resid 28 and name HB1 ) (resid 29 and name HN ) 2.65 0.85 0.85 !peak 410 #SUP 1.00 #QF 0.93 assign (resid 29 and name HN ) (resid 32 and name HG12 ) 3.63 1.83 1.83 !peak 411 #SUP 0.91 #QF 0.88 assign (resid 28 and name HG ) (resid 29 and name HN ) 3.24 1.44 1.44 !peak 412 #SUP 0.88 #QF 0.88 assign (resid 26 and name HG* ) (resid 29 and name HN ) 4.00 2.20 2.20 !peak 413 #SUP 0.97 #QF 0.97 assign (resid 29 and name HN ) (resid 32 and name HG11 ) 4.22 2.42 2.42 !peak 414 #SUP 0.89 #QF 0.89 assign (resid 29 and name HN ) (resid 29 and name HG2* ) 2.57 0.77 0.77 !peak 415 #SUP 0.98 #QF 0.98 assign (resid 12 and name HD2* ) (resid 29 and name HN ) 3.65 1.85 1.85 !peak 417 #SUP 0.79 #QF 0.79 assign (resid 30 and name HN ) (resid 33 and name HN ) 3.78 1.98 1.98 !peak 418 #SUP 0.96 #QF 0.96 assign (resid 29 and name HN ) (resid 30 and name HN ) 2.71 0.91 0.91 !peak 419 #SUP 0.98 #QF 0.98 assign (resid 28 and name HN ) (resid 30 and name HN ) 3.60 1.80 1.80 !peak 421 #SUP 0.92 #QF 0.92 assign (resid 28 and name HA ) (resid 30 and name HN ) 3.73 1.93 1.93 !peak 423 #SUP 0.68 #QF 0.68 assign (resid 30 and name HN ) (resid 30 and name HB2 ) 2.60 0.80 0.80 !peak 425 #SUP 0.91 #QF 0.81 assign (resid 26 and name HA ) (resid 30 and name HN ) 3.36 1.56 1.56 !peak 426 #SUP 0.99 #QF 0.99 assign (resid 29 and name HB ) (resid 30 and name HN ) 2.83 1.03 1.03 !peak 428 #SUP 0.97 #QF 0.97 assign (resid 30 and name HN ) (resid 31 and name HB2 ) 3.91 2.11 2.11 !peak 429 #SUP 0.96 #QF 0.96 assign (resid 30 and name HN ) (resid 31 and name HB1 ) 3.80 2.00 2.00 !peak 430 #SUP 0.99 #QF 0.99 assign (resid 30 and name HN ) (resid 32 and name HG12 ) 3.93 2.13 2.13 !peak 431 #SUP 0.52 #QF 0.52 assign (resid 27 and name HB* ) (resid 30 and name HN ) 3.89 2.09 2.09 !peak 432 #SUP 0.99 #QF 0.99 assign (resid 31 and name HN ) (resid 33 and name HN ) 3.41 1.61 1.61 !peak 437 #SUP 1.00 assign (resid 30 and name HN ) (resid 31 and name HN ) 2.75 0.95 0.95 !peak 439 #SUP 1.00 assign (resid 31 and name HN ) (resid 32 and name HN ) 2.76 0.96 0.96 !peak 440 #SUP 1.00 assign (resid 28 and name HA ) (resid 31 and name HN ) 3.13 1.33 1.33 !peak 442 #SUP 1.00 assign (resid 30 and name HB1 ) (resid 31 and name HN ) 2.81 1.01 1.01 !peak 444 #SUP 0.80 #QF 0.80 assign (resid 31 and name HN ) (resid 32 and name HA ) 3.98 2.18 2.18 !peak 445 #SUP 0.99 #QF 0.99 assign (resid 29 and name HA ) (resid 31 and name HN ) 3.67 1.87 1.87 !peak 446 #SUP 1.00 assign (resid 29 and name HB ) (resid 31 and name HN ) 3.73 1.93 1.93 !peak 447 #SUP 0.91 #QF 0.91 assign (resid 31 and name HN ) (resid 31 and name HB2 ) 2.67 0.87 0.87 !peak 448 #SUP 1.00 assign (resid 31 and name HN ) (resid 31 and name HB1 ) 2.64 0.84 0.84 !peak 449 #SUP 0.99 #QF 0.99 assign (resid 31 and name HN ) (resid 32 and name HG12 ) 3.23 1.43 1.43 !peak 450 #SUP 0.99 #QF 0.99 assign (resid 31 and name HN ) (resid 31 and name HD1 ) 3.50 1.70 1.70 !peak 451 #SUP 0.97 #QF 0.97 assign (resid 31 and name HN ) (resid 31 and name HG2 ) 3.52 1.72 1.72 !peak 453 #SUP 1.00 assign (resid 31 and name HN ) (resid 32 and name HG11 ) 4.05 2.25 2.25 !peak 454 #SUP 0.99 #QF 0.99 assign (resid 31 and name HN ) (resid 32 and name HG2* ) 3.69 1.89 1.89 !peak 456 #SUP 0.80 #QF 0.80 assign (resid 31 and name HN ) (resid 32 and name HD1* ) 3.93 2.13 2.13 !peak 457 #SUP 0.94 #QF 0.94 assign (resid 54 and name HN ) (resid 55 and name HN ) 3.57 1.77 1.77 !peak 458 #SUP 0.97 #QF 0.97 assign (resid 32 and name HN ) (resid 33 and name HN ) 2.72 0.92 0.92 !peak 461 #SUP 0.98 #QF 0.98 assign (resid 54 and name HN ) (resid 58 and name HN ) 3.54 1.74 1.74 !peak 462 #SUP 0.98 #QF 0.98 assign (resid 33 and name HN ) (resid 35 and name HN ) 3.61 1.81 1.81 !peak 463 #SUP 0.98 #QF 0.98 assign (resid 54 and name HN ) (resid 57 and name HD* ) 3.55 1.75 1.74 !peak 465 #SUP 0.93 #QF 0.93 assign (resid 53 and name HA ) (resid 54 and name HN ) 2.40 0.60 0.60 !peak 469 #SUP 0.91 #QF 0.91 assign (resid 30 and name HA ) (resid 33 and name HN ) 3.12 1.32 1.32 !peak 470 #SUP 0.95 #QF 0.95 assign (resid 33 and name HN ) (resid 33 and name HB2 ) 3.01 1.21 1.21 !peak 473 #SUP 0.64 #QF 0.64 assign (resid 29 and name HA ) (resid 33 and name HN ) 3.21 1.41 1.41 !peak 474 #SUP 0.98 #QF 0.98 assign (resid 54 and name HN ) (resid 57 and name HB1 ) 3.61 1.81 1.81 !peak 475 #SUP 0.87 #QF 0.87 assign (resid 31 and name HB2 ) (resid 33 and name HN ) 4.22 2.42 2.42 !peak 476 #SUP 0.98 #QF 0.98 assign (resid 32 and name HG12 ) (resid 33 and name HN ) 2.69 0.89 0.89 !peak 477 #SUP 0.95 #QF 0.95 assign (resid 53 and name HB* ) (resid 54 and name HN ) 2.61 0.81 0.81 !peak 478 #SUP 0.96 #QF 0.96 assign (resid 32 and name HG11 ) (resid 33 and name HN ) 3.50 1.70 1.70 !peak 479 #SUP 0.98 #QF 0.98 assign (resid 32 and name HG2* ) (resid 33 and name HN ) 3.34 1.54 1.54 !peak 480 #SUP 0.99 #QF 0.99 assign (resid 33 and name HN ) (resid 36 and name HG2* ) 3.54 1.74 1.74 !peak 480 #SUP 0.99 #QF 0.99 assign (resid 32 and name HD1* ) (resid 33 and name HN ) 3.53 1.73 1.73 !peak 481 #SUP 0.99 #QF 0.66 assign (resid 54 and name HN ) (resid 61 and name HD1* ) 3.84 2.04 2.04 !peak 482 #SUP 0.97 #QF 0.97 assign (resid 33 and name HN ) (resid 34 and name HN ) 2.78 0.98 0.98 !peak 483 #SUP 0.97 #QF 0.97 assign (resid 32 and name HN ) (resid 34 and name HN ) 3.52 1.72 1.72 !peak 484 #SUP 0.97 #QF 0.97 assign (resid 34 and name HN ) (resid 35 and name HN ) 2.68 0.88 0.88 !peak 485 #SUP 0.94 #QF 0.94 assign (resid 34 and name HN ) (resid 36 and name HN ) 3.24 1.44 1.44 !peak 487 #SUP 0.94 #QF 0.94 assign (resid 33 and name HA ) (resid 34 and name HN ) 2.95 1.15 1.15 !peak 488 #SUP 0.84 #QF 0.84 assign (resid 30 and name HA ) (resid 34 and name HN ) 3.64 1.84 1.84 !peak 490 #SUP 0.80 #QF 0.80 assign (resid 34 and name HN ) (resid 34 and name HB2 ) 2.91 1.11 1.11 !peak 491 #SUP 0.83 #QF 0.63 assign (resid 34 and name HN ) (resid 34 and name HB1 ) 2.91 1.11 1.11 !peak 491 #SUP 0.83 #QF 0.63 assign (resid 32 and name HG12 ) (resid 34 and name HN ) 3.89 2.09 2.09 !peak 492 #SUP 0.90 #QF 0.90 assign (resid 34 and name HN ) (resid 36 and name HG2* ) 3.39 1.59 1.59 !peak 493 #SUP 0.95 #QF 0.95 assign (resid 35 and name HN ) (resid 36 and name HN ) 2.58 0.78 0.78 !peak 498 #SUP 0.98 #QF 0.98 assign (resid 35 and name HN ) (resid 35 and name HB2 ) 3.02 1.22 1.22 !peak 501 #SUP 0.96 #QF 0.96 assign (resid 35 and name HN ) (resid 35 and name HB1 ) 3.02 1.22 1.22 !peak 502 #SUP 0.93 #QF 0.93 assign (resid 32 and name HB ) (resid 35 and name HN ) 3.93 2.13 2.13 !peak 503 #SUP 0.87 #QF 0.87 assign (resid 35 and name HN ) (resid 36 and name HG1* ) 3.30 1.50 1.50 !peak 504 #SUP 0.96 #QF 0.96 assign (resid 35 and name HN ) (resid 36 and name HG2* ) 3.06 1.26 1.26 !peak 505 #SUP 0.97 #QF 0.97 assign (resid 33 and name HN ) (resid 36 and name HN ) 3.92 2.12 2.12 !peak 507 #SUP 0.79 #QF 0.79 assign (resid 36 and name HN ) (resid 37 and name HA ) 4.02 2.22 2.22 !peak 510 #SUP 0.87 #QF 0.87 assign (resid 34 and name HA ) (resid 36 and name HN ) 3.68 1.88 1.88 !peak 512 #SUP 0.87 #QF 0.87 assign (resid 35 and name HB2 ) (resid 36 and name HN ) 3.43 1.63 1.63 !peak 513 #SUP 0.92 #QF 0.92 assign (resid 36 and name HN ) (resid 36 and name HB ) 3.17 1.37 1.37 !peak 514 #SUP 0.92 #QF 0.92 assign (resid 36 and name HN ) (resid 42 and name HB* ) 4.24 2.44 2.43 !peak 515 #SUP 0.92 #QF 0.92 assign (resid 32 and name HG11 ) (resid 36 and name HN ) 4.24 2.44 2.43 !peak 516 #SUP 0.90 #QF 0.66 assign (resid 36 and name HN ) (resid 36 and name HG1* ) 2.72 0.92 0.92 !peak 517 #SUP 0.94 #QF 0.94 assign (resid 36 and name HN ) (resid 36 and name HG2* ) 2.54 0.74 0.74 !peak 518 #SUP 0.95 #QF 0.95 assign (resid 37 and name HN ) (resid 42 and name HN ) 3.90 2.10 2.10 !peak 521 #SUP 0.98 #QF 0.98 assign (resid 36 and name HN ) (resid 37 and name HN ) 3.59 1.79 1.79 !peak 523 #SUP 0.97 #QF 0.97 assign (resid 36 and name HA ) (resid 37 and name HN ) 2.56 0.76 0.76 !peak 526 #SUP 0.94 #QF 0.94 assign (resid 36 and name HB ) (resid 37 and name HN ) 2.65 0.85 0.85 !peak 528 #SUP 0.91 #QF 0.91 assign (resid 37 and name HN ) (resid 41 and name HB1 ) 3.41 1.61 1.61 !peak 529 #SUP 0.99 #QF 0.86 assign (resid 37 and name HN ) (resid 41 and name HB2 ) 3.18 1.38 1.38 !peak 530 #SUP 0.98 #QF 0.98 assign (resid 36 and name HG1* ) (resid 37 and name HN ) 3.08 1.28 1.28 !peak 531 #SUP 0.98 #QF 0.98 assign (resid 36 and name HG2* ) (resid 37 and name HN ) 2.99 1.19 1.19 !peak 532 #SUP 0.97 #QF 0.97 assign (resid 37 and name HN ) (resid 38 and name HN ) 2.63 0.83 0.83 !peak 533 #SUP 0.97 #QF 0.97 assign (resid 38 and name HN ) (resid 39 and name HN ) 3.56 1.76 1.76 !peak 534 #SUP 0.97 #QF 0.97 assign (resid 37 and name HD21 ) (resid 38 and name HN ) 3.85 2.05 2.05 !peak 536 #SUP 0.72 #QF 0.72 assign (resid 38 and name HN ) (resid 39 and name HA ) 3.92 2.12 2.12 !peak 542 #SUP 0.52 #QF 0.52 assign (resid 38 and name HN ) (resid 38 and name HB2 ) 3.25 1.45 1.45 !peak 543 #SUP 0.98 #QF 0.98 assign (resid 38 and name HN ) (resid 38 and name HB1 ) 3.25 1.45 1.45 !peak 544 #SUP 0.98 #QF 0.98 assign (resid 37 and name HB2 ) (resid 38 and name HN ) 3.29 1.49 1.49 !peak 545 #SUP 0.88 #QF 0.63 assign (resid 37 and name HB1 ) (resid 38 and name HN ) 3.29 1.49 1.49 !peak 545 #SUP 0.88 #QF 0.63 assign (resid 38 and name HN ) (resid 41 and name HG2 ) 3.60 1.80 1.80 !peak 546 #SUP 0.98 #QF 0.98 assign (resid 36 and name HB ) (resid 38 and name HN ) 2.84 1.04 1.04 !peak 547 #SUP 0.85 #QF 0.85 assign (resid 38 and name HN ) (resid 41 and name HG1 ) 3.60 1.80 1.80 !peak 548 #SUP 0.96 #QF 0.75 assign (resid 38 and name HN ) (resid 41 and name HB2 ) 2.90 1.10 1.10 !peak 549 #SUP 0.97 #QF 0.97 assign (resid 38 and name HN ) (resid 42 and name HB* ) 3.86 2.06 2.06 !peak 550 #SUP 0.98 #QF 0.98 assign (resid 36 and name HG1* ) (resid 38 and name HN ) 3.59 1.79 1.79 !peak 551 #SUP 0.97 #QF 0.97 assign (resid 36 and name HG2* ) (resid 38 and name HN ) 2.94 1.14 1.14 !peak 552 #SUP 0.80 #QF 0.80 assign (resid 38 and name HA ) (resid 39 and name HN ) 2.67 0.87 0.87 !peak 556 #SUP 0.99 #QF 0.99 assign (resid 38 and name HB2 ) (resid 39 and name HN ) 3.00 1.20 1.20 !peak 558 #SUP 0.99 #QF 0.99 assign (resid 38 and name HB1 ) (resid 39 and name HN ) 3.00 1.20 1.20 !peak 559 #SUP 1.00 assign (resid 4 and name HB ) (resid 39 and name HN ) 3.57 1.77 1.77 !peak 561 #SUP 0.89 #QF 0.89 assign (resid 39 and name HN ) (resid 39 and name HB1 ) 2.80 1.00 1.00 !peak 562 #SUP 0.98 #QF 0.98 assign (resid 7 and name HD2 ) (resid 39 and name HN ) 4.00 2.20 2.20 !peak 563 #SUP 0.98 #QF 0.40 assign (resid 39 and name HN ) (resid 39 and name HB2 ) 2.71 0.91 0.91 !peak 564 #SUP 0.99 #QF 0.99 assign (resid 39 and name HN ) (resid 39 and name HD1* ) 3.77 1.97 1.97 !peak 565 #SUP 1.00 assign (resid 39 and name HN ) (resid 39 and name HD2* ) 3.77 1.97 1.97 !peak 565 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 39 and name HN ) 3.44 1.64 1.64 !peak 566 #SUP 1.00 #QF 0.99 assign (resid 41 and name HN ) (resid 44 and name HN ) 3.97 2.17 2.17 !peak 572 #SUP 0.73 #QF 0.73 assign (resid 38 and name HN ) (resid 41 and name HN ) 3.22 1.42 1.42 !peak 573 #SUP 0.99 #QF 0.99 assign (resid 38 and name HA ) (resid 41 and name HN ) 3.79 1.99 1.99 !peak 575 #SUP 0.93 #QF 0.93 assign (resid 29 and name HA ) (resid 32 and name HN ) 3.15 1.35 1.35 !peak 581 #SUP 0.99 #QF 0.99 assign (resid 41 and name HN ) (resid 41 and name HB1 ) 2.98 1.18 1.18 !peak 583 #SUP 0.98 #QF 0.98 assign (resid 41 and name HN ) (resid 41 and name HB2 ) 2.71 0.91 0.91 !peak 584 #SUP 0.85 #QF 0.85 assign (resid 31 and name HB1 ) (resid 32 and name HN ) 2.87 1.07 1.07 !peak 585 #SUP 0.80 #QF 0.80 assign (resid 32 and name HN ) (resid 32 and name HG12 ) 2.54 0.74 0.74 !peak 586 #SUP 0.98 #QF 0.98 assign (resid 31 and name HD1 ) (resid 32 and name HN ) 3.60 1.80 1.80 !peak 588 #SUP 0.97 #QF 0.97 assign (resid 28 and name HG ) (resid 32 and name HN ) 3.61 1.81 1.81 !peak 589 #SUP 0.98 #QF 0.91 assign (resid 32 and name HN ) (resid 32 and name HG11 ) 2.94 1.14 1.14 !peak 592 #SUP 1.00 assign (resid 36 and name HG1* ) (resid 41 and name HN ) 3.94 2.14 2.14 !peak 594 #SUP 1.00 assign (resid 32 and name HN ) (resid 32 and name HG2* ) 2.92 1.12 1.12 !peak 595 #SUP 0.99 #QF 0.99 assign (resid 36 and name HG2* ) (resid 41 and name HN ) 3.71 1.91 1.91 !peak 596 #SUP 0.97 #QF 0.97 assign (resid 32 and name HN ) (resid 32 and name HD1* ) 3.10 1.30 1.30 !peak 597 #SUP 0.99 #QF 0.99 assign (resid 41 and name HN ) (resid 42 and name HN ) 2.69 0.89 0.89 !peak 598 #SUP 0.99 #QF 0.99 assign (resid 42 and name HN ) (resid 43 and name HN ) 2.77 0.97 0.97 !peak 599 #SUP 0.99 #QF 0.99 assign (resid 42 and name HN ) (resid 45 and name HN ) 3.82 2.02 2.02 !peak 600 #SUP 0.99 #QF 0.99 assign (resid 38 and name HN ) (resid 42 and name HN ) 3.39 1.59 1.59 !peak 603 #SUP 0.98 #QF 0.98 assign (resid 39 and name HA ) (resid 42 and name HN ) 2.99 1.19 1.19 !peak 604 #SUP 0.93 #QF 0.93 assign (resid 41 and name HB1 ) (resid 42 and name HN ) 3.12 1.32 1.32 !peak 607 #SUP 0.98 #QF 0.98 assign (resid 41 and name HB2 ) (resid 42 and name HN ) 2.96 1.16 1.16 !peak 608 #SUP 0.98 #QF 0.98 assign (resid 39 and name HG ) (resid 42 and name HN ) 4.35 2.55 2.55 !peak 609 #SUP 0.93 #QF 0.30 assign (resid 42 and name HN ) (resid 42 and name HB* ) 2.52 0.72 0.72 !peak 610 #SUP 0.98 #QF 0.98 assign (resid 36 and name HG1* ) (resid 42 and name HN ) 2.98 1.18 1.18 !peak 612 #SUP 0.98 #QF 0.98 assign (resid 36 and name HG2* ) (resid 42 and name HN ) 3.15 1.35 1.35 !peak 613 #SUP 0.97 #QF 0.97 assign (resid 43 and name HN ) (resid 46 and name HN ) 3.77 1.97 1.97 !peak 614 #SUP 0.99 #QF 0.99 assign (resid 40 and name HA ) (resid 43 and name HN ) 3.31 1.51 1.51 !peak 619 #SUP 0.91 #QF 0.91 assign (resid 43 and name HN ) (resid 44 and name HB ) 3.98 2.18 2.18 !peak 621 #SUP 0.98 #QF 0.98 assign (resid 41 and name HB2 ) (resid 43 and name HN ) 4.26 2.46 2.46 !peak 622 #SUP 0.86 #QF 0.65 assign (resid 43 and name HN ) (resid 45 and name HB ) 4.35 2.55 2.55 !peak 622 #SUP 0.86 #QF 0.65 assign (resid 43 and name HN ) (resid 43 and name HB ) 2.64 0.84 0.84 !peak 623 #SUP 1.00 assign (resid 43 and name HN ) (resid 43 and name HG12 ) 3.15 1.35 1.35 !peak 625 #SUP 0.94 #QF 0.94 assign (resid 42 and name HB* ) (resid 43 and name HN ) 2.79 0.99 0.99 !peak 626 #SUP 0.99 #QF 0.99 assign (resid 43 and name HN ) (resid 43 and name HD1* ) 3.04 1.24 1.24 !peak 629 #SUP 0.69 #QF 0.69 assign (resid 44 and name HN ) (resid 46 and name HN ) 3.41 1.61 1.61 !peak 630 #SUP 0.94 #QF 0.94 assign (resid 43 and name HN ) (resid 44 and name HN ) 2.83 1.03 1.03 !peak 631 #SUP 1.00 assign (resid 40 and name HA ) (resid 44 and name HN ) 3.98 2.18 2.18 !peak 635 #SUP 0.88 #QF 0.75 assign (resid 42 and name HA ) (resid 44 and name HN ) 4.18 2.38 2.38 !peak 635 #SUP 0.88 #QF 0.75 assign (resid 44 and name HN ) (resid 44 and name HB ) 2.62 0.82 0.82 !peak 637 #SUP 0.99 #QF 0.99 assign (resid 44 and name HN ) (resid 45 and name HB ) 3.93 2.13 2.13 !peak 638 #SUP 0.99 #QF 0.99 assign (resid 43 and name HB ) (resid 44 and name HN ) 2.90 1.10 1.10 !peak 639 #SUP 0.99 #QF 0.99 assign (resid 42 and name HB* ) (resid 44 and name HN ) 3.72 1.92 1.92 !peak 641 #SUP 0.94 #QF 0.94 assign (resid 44 and name HN ) (resid 44 and name HG2* ) 3.07 1.27 1.27 !peak 643 #SUP 0.99 #QF 0.99 assign (resid 43 and name HG2* ) (resid 44 and name HN ) 3.04 1.24 1.24 !peak 644 #SUP 0.99 #QF 0.99 assign (resid 45 and name HN ) (resid 46 and name HN ) 2.67 0.87 0.87 !peak 645 #SUP 0.99 #QF 0.99 assign (resid 43 and name HN ) (resid 45 and name HN ) 3.36 1.56 1.56 !peak 646 #SUP 0.94 #QF 0.94 assign (resid 44 and name HN ) (resid 45 and name HN ) 2.74 0.94 0.94 !peak 648 #SUP 0.99 #QF 0.99 assign (resid 41 and name HA ) (resid 45 and name HN ) 3.54 1.74 1.74 !peak 649 #SUP 0.98 #QF 0.98 assign (resid 42 and name HA ) (resid 45 and name HN ) 3.10 1.30 1.30 !peak 650 #SUP 0.94 #QF 0.94 assign (resid 44 and name HB ) (resid 45 and name HN ) 2.71 0.91 0.91 !peak 653 #SUP 0.48 #QF 0.48 assign (resid 45 and name HN ) (resid 45 and name HB ) 2.58 0.78 0.78 !peak 655 #SUP 0.97 #QF 0.97 assign (resid 43 and name HB ) (resid 45 and name HN ) 3.84 2.04 2.04 !peak 656 #SUP 0.99 #QF 0.99 assign (resid 45 and name HN ) (resid 46 and name HB2 ) 3.67 1.87 1.87 !peak 659 #SUP 0.99 #QF 0.99 assign (resid 43 and name HG2* ) (resid 45 and name HN ) 3.83 2.03 2.03 !peak 662 #SUP 0.99 #QF 0.99 assign (resid 32 and name HD1* ) (resid 45 and name HN ) 3.96 2.16 2.16 !peak 663 #SUP 0.77 #QF 0.77 assign (resid 46 and name HN ) (resid 48 and name HN ) 3.49 1.69 1.69 !peak 667 #SUP 1.00 assign (resid 46 and name HN ) (resid 47 and name HA ) 4.09 2.29 2.29 !peak 669 #SUP 0.89 #QF 0.89 assign (resid 43 and name HA ) (resid 46 and name HN ) 3.03 1.23 1.23 !peak 671 #SUP 0.98 #QF 0.98 assign (resid 46 and name HN ) (resid 48 and name HG2 ) 4.35 2.55 2.55 !peak 672 #SUP 0.99 #QF 0.50 assign (resid 45 and name HB ) (resid 46 and name HN ) 3.08 1.28 1.28 !peak 673 #SUP 0.94 #QF 0.47 assign (resid 46 and name HN ) (resid 47 and name HG1 ) 3.53 1.73 1.73 !peak 674 #SUP 0.64 #QF 0.64 assign (resid 46 and name HN ) (resid 46 and name HG ) 2.71 0.91 0.91 !peak 676 #SUP 0.93 #QF 0.93 assign (resid 46 and name HN ) (resid 47 and name HG2 ) 4.35 2.55 2.55 !peak 677 #SUP 0.92 #QF 0.92 assign (resid 46 and name HN ) (resid 46 and name HB2 ) 2.89 1.09 1.09 !peak 679 #SUP 0.99 #QF 0.99 assign (resid 45 and name HG2* ) (resid 46 and name HN ) 3.11 1.31 1.31 !peak 681 #SUP 0.89 #QF 0.89 assign (resid 45 and name HN ) (resid 47 and name HN ) 3.41 1.61 1.61 !peak 686 #SUP 0.98 #QF 0.98 assign (resid 47 and name HN ) (resid 48 and name HN ) 2.76 0.96 0.96 !peak 687 #SUP 1.00 assign (resid 44 and name HA ) (resid 47 and name HN ) 3.10 1.30 1.30 !peak 690 #SUP 0.99 #QF 0.99 assign (resid 47 and name HN ) (resid 47 and name HD2 ) 3.52 1.72 1.72 !peak 691 #SUP 0.99 #QF 0.99 assign (resid 47 and name HN ) (resid 47 and name HD1 ) 3.52 1.72 1.72 !peak 692 #SUP 1.00 assign (resid 47 and name HN ) (resid 48 and name HG2 ) 3.90 2.10 2.10 !peak 693 #SUP 0.98 #QF 0.98 assign (resid 47 and name HN ) (resid 47 and name HB2 ) 2.67 0.87 0.87 !peak 694 #SUP 0.98 #QF 0.98 assign (resid 47 and name HN ) (resid 47 and name HG1 ) 2.76 0.96 0.96 !peak 695 #SUP 0.99 #QF 0.99 assign (resid 47 and name HN ) (resid 47 and name HG2 ) 3.11 1.31 1.31 !peak 697 #SUP 1.00 assign (resid 46 and name HB2 ) (resid 47 and name HN ) 3.14 1.34 1.34 !peak 699 #SUP 0.98 #QF 0.98 assign (resid 47 and name HN ) (resid 65 and name HD2* ) 3.46 1.66 1.66 !peak 700 #SUP 0.94 #QF 0.94 assign (resid 47 and name HN ) (resid 65 and name HD1* ) 3.46 1.66 1.66 !peak 701 #SUP 0.93 #QF 0.93 assign (resid 44 and name HA ) (resid 48 and name HN ) 3.69 1.89 1.89 !peak 703 #SUP 0.99 #QF 0.99 assign (resid 48 and name HN ) (resid 51 and name HD* ) 4.35 2.55 2.55 !peak 705 #SUP 0.95 #QF 0.77 assign (resid 47 and name HG2 ) (resid 48 and name HN ) 3.95 2.15 2.15 !peak 706 #SUP 0.69 #QF 0.69 assign (resid 47 and name HN ) (resid 49 and name HN ) 3.32 1.52 1.51 !peak 709 #SUP 0.92 #QF 0.92 assign (resid 49 and name HN ) (resid 51 and name HN ) 3.44 1.64 1.64 !peak 712 #SUP 0.86 #QF 0.86 assign (resid 46 and name HA ) (resid 49 and name HN ) 3.12 1.32 1.32 !peak 715 #SUP 0.98 #QF 0.98 assign (resid 49 and name HN ) (resid 50 and name HA ) 3.90 2.10 2.10 !peak 716 #SUP 1.00 assign (resid 49 and name HN ) (resid 49 and name HG2 ) 3.21 1.41 1.41 !peak 717 #SUP 0.99 #QF 0.99 assign (resid 48 and name HG2 ) (resid 49 and name HN ) 2.89 1.09 1.09 !peak 718 #SUP 0.79 #QF 0.79 assign (resid 48 and name HB1 ) (resid 49 and name HN ) 3.26 1.46 1.46 !peak 719 #SUP 0.99 #QF 0.88 assign (resid 49 and name HN ) (resid 50 and name HB2 ) 3.92 2.12 2.12 !peak 720 #SUP 0.77 #QF 0.77 assign (resid 32 and name HG2* ) (resid 49 and name HN ) 4.35 2.55 2.55 !peak 724 #SUP 1.00 assign (resid 49 and name HN ) (resid 61 and name HG2* ) 4.17 2.37 2.37 !peak 725 #SUP 0.99 #QF 0.33 assign (resid 49 and name HN ) (resid 50 and name HN ) 2.79 0.99 0.99 !peak 728 #SUP 0.99 #QF 0.99 assign (resid 48 and name HN ) (resid 50 and name HN ) 3.51 1.71 1.71 !peak 729 #SUP 0.99 #QF 0.99 assign (resid 50 and name HN ) (resid 51 and name HN ) 2.80 1.00 1.00 !peak 730 #SUP 1.00 assign (resid 48 and name HA ) (resid 50 and name HN ) 3.60 1.80 1.80 !peak 731 #SUP 0.99 #QF 0.99 assign (resid 47 and name HA ) (resid 50 and name HN ) 3.13 1.33 1.33 !peak 732 #SUP 0.98 #QF 0.56 assign (resid 50 and name HN ) (resid 50 and name HB1 ) 2.73 0.93 0.93 !peak 736 #SUP 1.00 assign (resid 50 and name HN ) (resid 50 and name HB2 ) 2.71 0.91 0.91 !peak 738 #SUP 0.99 #QF 0.99 assign (resid 50 and name HN ) (resid 61 and name HB ) 4.35 2.55 2.55 !peak 740 #SUP 1.00 #QF 0.88 assign (resid 50 and name HN ) (resid 53 and name HB* ) 3.80 2.00 2.00 !peak 741 #SUP 1.00 assign (resid 50 and name HN ) (resid 61 and name HG2* ) 2.81 1.01 1.01 !peak 744 #SUP 1.00 assign (resid 48 and name HN ) (resid 51 and name HN ) 4.06 2.26 2.26 !peak 749 #SUP 0.96 #QF 0.96 assign (resid 48 and name HA ) (resid 51 and name HN ) 3.09 1.29 1.29 !peak 751 #SUP 0.99 #QF 0.99 assign (resid 49 and name HA ) (resid 51 and name HN ) 3.53 1.73 1.73 !peak 752 #SUP 0.98 #QF 0.98 assign (resid 50 and name HB1 ) (resid 51 and name HN ) 2.87 1.07 1.07 !peak 758 #SUP 0.99 #QF 0.99 assign (resid 47 and name HB2 ) (resid 47 and name HE ) 3.78 1.98 1.98 !peak 761 #SUP 0.91 #QF 0.91 assign (resid 51 and name HN ) (resid 51 and name HB2 ) 2.47 0.67 0.67 !peak 762 #SUP 0.97 #QF 0.97 assign (resid 51 and name HN ) (resid 51 and name HG1 ) 3.08 1.28 1.28 !peak 763 #SUP 0.98 #QF 0.98 assign (resid 47 and name HG2 ) (resid 47 and name HE ) 3.23 1.43 1.43 !peak 764 #SUP 1.00 assign (resid 51 and name HN ) (resid 51 and name HG2 ) 3.08 1.28 1.28 !peak 765 #SUP 0.99 #QF 0.99 assign (resid 43 and name HG2* ) (resid 47 and name HE ) 3.27 1.47 1.47 !peak 766 #SUP 0.99 #QF 0.99 assign (resid 50 and name HN ) (resid 52 and name HN ) 3.55 1.75 1.75 !peak 768 #SUP 0.99 #QF 0.99 assign (resid 58 and name HN ) (resid 59 and name HN ) 3.09 1.29 1.28 !peak 769 #SUP 0.98 #QF 0.98 assign (resid 59 and name HN ) (resid 61 and name HN ) 3.57 1.77 1.77 !peak 770 #SUP 0.96 #QF 0.96 assign (resid 56 and name HA ) (resid 59 and name HN ) 3.34 1.54 1.54 !peak 774 #SUP 0.99 #QF 0.99 assign (resid 55 and name HA ) (resid 59 and name HN ) 3.18 1.38 1.38 !peak 775 #SUP 0.90 #QF 0.90 assign (resid 59 and name HN ) (resid 59 and name HB ) 2.77 0.97 0.97 !peak 776 #SUP 0.95 #QF 0.95 assign (resid 48 and name HA ) (resid 52 and name HN ) 3.79 1.99 1.99 !peak 778 #SUP 0.76 #QF 0.76 assign (resid 49 and name HA ) (resid 52 and name HN ) 3.08 1.28 1.28 !peak 779 #SUP 0.99 #QF 0.99 assign (resid 50 and name HA ) (resid 52 and name HN ) 3.72 1.92 1.92 !peak 782 #SUP 0.97 #QF 0.97 assign (resid 59 and name HN ) (resid 62 and name HD1 ) 3.92 2.12 2.12 !peak 784 #SUP 0.98 #QF 0.77 assign (resid 50 and name HB1 ) (resid 52 and name HN ) 3.92 2.12 2.12 !peak 786 #SUP 0.93 #QF 0.93 assign (resid 49 and name HB2 ) (resid 52 and name HN ) 4.35 2.55 2.55 !peak 787 #SUP 0.73 #QF 0.57 assign (resid 49 and name HB1 ) (resid 52 and name HN ) 4.35 2.55 2.55 !peak 788 #SUP 0.68 #QF 0.29 assign (resid 52 and name HN ) (resid 52 and name HG2 ) 3.01 1.21 1.21 !peak 791 #SUP 0.91 #QF 0.67 assign (resid 52 and name HN ) (resid 52 and name HG1 ) 3.01 1.21 1.21 !peak 791 #SUP 0.91 #QF 0.67 assign (resid 58 and name HB2 ) (resid 59 and name HN ) 3.20 1.40 1.40 !peak 792 #SUP 0.87 #QF 0.87 assign (resid 58 and name HB1 ) (resid 59 and name HN ) 2.80 1.00 1.00 !peak 793 #SUP 0.91 #QF 0.91 assign (resid 50 and name HN ) (resid 53 and name HN ) 3.87 2.07 2.07 !peak 794 #SUP 0.99 #QF 0.62 assign (resid 53 and name HN ) (resid 54 and name HN ) 4.10 2.30 2.30 !peak 794 #SUP 0.99 #QF 0.62 assign (resid 52 and name HN ) (resid 53 and name HN ) 2.57 0.77 0.77 !peak 796 #SUP 0.99 #QF 0.99 assign (resid 49 and name HA ) (resid 53 and name HN ) 3.63 1.83 1.83 !peak 799 #SUP 0.96 #QF 0.96 assign (resid 50 and name HA ) (resid 53 and name HN ) 3.34 1.54 1.54 !peak 801 #SUP 0.99 #QF 0.99 assign (resid 52 and name HB1 ) (resid 53 and name HN ) 3.65 1.85 1.85 !peak 803 #SUP 0.97 #QF 0.84 assign (resid 53 and name HN ) (resid 53 and name HB* ) 2.50 0.70 0.70 !peak 806 #SUP 0.95 #QF 0.95 assign (resid 53 and name HN ) (resid 61 and name HD1* ) 3.44 1.64 1.64 !peak 808 #SUP 1.00 assign (resid 55 and name HN ) (resid 58 and name HN ) 3.56 1.76 1.76 !peak 811 #SUP 1.00 assign (resid 54 and name HA ) (resid 55 and name HN ) 2.54 0.74 0.74 !peak 813 #SUP 0.88 #QF 0.88 assign (resid 55 and name HN ) (resid 55 and name HG1 ) 3.07 1.27 1.27 !peak 818 #SUP 0.99 #QF 0.99 assign (resid 55 and name HN ) (resid 55 and name HG2 ) 3.07 1.27 1.27 !peak 819 #SUP 0.89 #QF 0.89 assign (resid 55 and name HN ) (resid 55 and name HB2 ) 3.04 1.24 1.24 !peak 820 #SUP 1.00 assign (resid 55 and name HN ) (resid 55 and name HB1 ) 2.80 1.00 1.00 !peak 821 #SUP 0.98 #QF 0.98 assign (resid 55 and name HN ) (resid 58 and name HB2 ) 3.70 1.90 1.90 !peak 823 #SUP 0.84 #QF 0.84 assign (resid 55 and name HN ) (resid 58 and name HB1 ) 3.65 1.85 1.85 !peak 824 #SUP 1.00 assign (resid 54 and name HN ) (resid 57 and name HN ) 4.01 2.21 2.20 !peak 825 #SUP 0.96 #QF 0.96 assign (resid 57 and name HN ) (resid 57 and name HD* ) 3.30 1.50 1.50 !peak 827 #SUP 0.99 #QF 0.99 assign (resid 57 and name HN ) (resid 59 and name HN ) 3.71 1.91 1.91 !peak 828 #SUP 0.89 #QF 0.89 assign (resid 21 and name HE* ) (resid 57 and name HN ) 3.65 1.85 1.85 !peak 829 #SUP 0.99 #QF 0.99 assign (resid 21 and name HB2 ) (resid 57 and name HN ) 4.32 2.52 2.52 !peak 833 #SUP 0.99 #QF 0.95 assign (resid 57 and name HN ) (resid 58 and name HA ) 4.35 2.55 2.55 !peak 833 #SUP 0.99 #QF 0.95 assign (resid 57 and name HN ) (resid 57 and name HB2 ) 2.68 0.88 0.88 !peak 834 #SUP 0.89 #QF 0.76 assign (resid 57 and name HN ) (resid 57 and name HB1 ) 2.91 1.11 1.11 !peak 834 #SUP 0.89 #QF 0.76 assign (resid 56 and name HG1 ) (resid 57 and name HN ) 3.53 1.73 1.73 !peak 837 #SUP 0.99 #QF 0.99 assign (resid 56 and name HG2 ) (resid 57 and name HN ) 3.09 1.29 1.28 !peak 838 #SUP 0.93 #QF 0.93 assign (resid 57 and name HN ) (resid 58 and name HB1 ) 4.02 2.22 2.22 !peak 839 #SUP 0.94 #QF 0.94 assign (resid 57 and name HD* ) (resid 58 and name HN ) 3.61 1.81 1.81 !peak 841 #SUP 0.97 #QF 0.80 assign (resid 56 and name HA ) (resid 58 and name HN ) 3.45 1.65 1.65 !peak 843 #SUP 0.98 #QF 0.98 assign (resid 54 and name HA ) (resid 58 and name HN ) 3.42 1.62 1.62 !peak 844 #SUP 0.93 #QF 0.93 assign (resid 55 and name HA ) (resid 58 and name HN ) 2.78 0.98 0.98 !peak 845 #SUP 0.85 #QF 0.85 assign (resid 58 and name HN ) (resid 59 and name HB ) 3.88 2.08 2.08 !peak 846 #SUP 0.74 #QF 0.74 assign (resid 57 and name HB1 ) (resid 58 and name HN ) 3.04 1.24 1.24 !peak 848 #SUP 0.87 #QF 0.43 assign (resid 55 and name HB2 ) (resid 58 and name HN ) 3.71 1.91 1.91 !peak 850 #SUP 0.97 #QF 0.97 assign (resid 55 and name HB1 ) (resid 58 and name HN ) 3.24 1.44 1.44 !peak 851 #SUP 0.93 #QF 0.93 assign (resid 58 and name HN ) (resid 58 and name HB2 ) 2.71 0.91 0.91 !peak 853 #SUP 0.83 #QF 0.83 assign (resid 58 and name HN ) (resid 58 and name HB1 ) 2.74 0.94 0.94 !peak 854 #SUP 0.97 #QF 0.97 assign (resid 58 and name HN ) (resid 61 and name HD1* ) 3.60 1.80 1.80 !peak 855 #SUP 0.98 #QF 0.98 assign (resid 60 and name HN ) (resid 63 and name HN ) 3.87 2.07 2.07 !peak 856 #SUP 0.98 #QF 0.98 assign (resid 58 and name HN ) (resid 60 and name HN ) 3.63 1.83 1.83 !peak 857 #SUP 0.99 #QF 0.99 assign (resid 60 and name HN ) (resid 62 and name HN ) 3.69 1.89 1.89 !peak 858 #SUP 1.00 assign (resid 60 and name HN ) (resid 61 and name HN ) 2.77 0.97 0.97 !peak 859 #SUP 1.00 assign (resid 59 and name HN ) (resid 60 and name HN ) 2.84 1.04 1.04 !peak 861 #SUP 0.99 #QF 0.99 assign (resid 57 and name HA ) (resid 60 and name HN ) 3.14 1.34 1.34 !peak 862 #SUP 0.86 #QF 0.86 assign (resid 59 and name HB ) (resid 60 and name HN ) 2.89 1.09 1.09 !peak 863 #SUP 0.96 #QF 0.63 assign (resid 58 and name HA ) (resid 60 and name HN ) 3.91 2.11 2.11 !peak 865 #SUP 0.99 #QF 0.99 assign (resid 60 and name HN ) (resid 60 and name HB2 ) 3.02 1.22 1.22 !peak 866 #SUP 0.96 #QF 0.96 assign (resid 60 and name HN ) (resid 60 and name HB1 ) 3.02 1.22 1.22 !peak 867 #SUP 0.99 #QF 0.99 assign (resid 19 and name HB ) (resid 60 and name HN ) 3.88 2.08 2.08 !peak 868 #SUP 0.99 #QF 0.99 assign (resid 60 and name HN ) (resid 63 and name HB ) 4.22 2.42 2.42 !peak 868 #SUP 0.99 #QF 0.99 assign (resid 59 and name HG2* ) (resid 60 and name HN ) 3.10 1.30 1.30 !peak 870 #SUP 1.00 assign (resid 60 and name HN ) (resid 61 and name HG11 ) 3.42 1.62 1.62 !peak 871 #SUP 0.80 #QF 0.80 assign (resid 25 and name HD1* ) (resid 60 and name HN ) 4.13 2.33 2.33 !peak 872 #SUP 0.88 #QF 0.43 assign (resid 25 and name HD2* ) (resid 60 and name HN ) 4.13 2.33 2.33 !peak 872 #SUP 0.88 #QF 0.43 assign (resid 61 and name HN ) (resid 63 and name HN ) 3.68 1.88 1.88 !peak 873 #SUP 0.98 #QF 0.98 assign (resid 58 and name HN ) (resid 61 and name HN ) 3.83 2.03 2.03 !peak 874 #SUP 0.90 #QF 0.90 assign (resid 57 and name HA ) (resid 61 and name HN ) 3.87 2.07 2.07 !peak 879 #SUP 0.93 #QF 0.93 assign (resid 59 and name HA ) (resid 61 and name HN ) 3.65 1.85 1.85 !peak 881 #SUP 0.96 #QF 0.96 assign (resid 58 and name HA ) (resid 61 and name HN ) 3.39 1.59 1.59 !peak 882 #SUP 0.99 #QF 0.99 assign (resid 60 and name HB1 ) (resid 61 and name HN ) 3.34 1.54 1.54 !peak 884 #SUP 0.99 #QF 0.99 assign (resid 61 and name HN ) (resid 63 and name HB ) 3.86 2.06 2.06 !peak 885 #SUP 0.66 #QF 0.66 assign (resid 61 and name HN ) (resid 61 and name HB ) 2.73 0.93 0.93 !peak 886 #SUP 0.99 #QF 0.99 assign (resid 58 and name HB1 ) (resid 61 and name HN ) 4.28 2.48 2.48 !peak 887 #SUP 0.99 #QF 0.34 assign (resid 59 and name HG2* ) (resid 61 and name HN ) 4.35 2.55 2.55 !peak 887 #SUP 0.99 #QF 0.34 assign (resid 61 and name HN ) (resid 61 and name HG11 ) 2.71 0.91 0.91 !peak 888 #SUP 0.98 #QF 0.98 assign (resid 61 and name HN ) (resid 63 and name HD1* ) 3.73 1.93 1.93 !peak 889 #SUP 0.95 #QF 0.95 assign (resid 61 and name HN ) (resid 61 and name HG2* ) 3.14 1.34 1.34 !peak 891 #SUP 0.98 #QF 0.98 assign (resid 61 and name HN ) (resid 61 and name HD1* ) 3.00 1.20 1.20 !peak 892 #SUP 0.99 #QF 0.99 assign (resid 61 and name HN ) (resid 61 and name HG12 ) 2.92 1.12 1.12 !peak 893 #SUP 0.99 #QF 0.99 assign (resid 62 and name HN ) (resid 63 and name HN ) 2.86 1.06 1.06 !peak 896 #SUP 1.00 assign (resid 63 and name HN ) (resid 64 and name HN ) 2.75 0.95 0.95 !peak 897 #SUP 0.99 #QF 0.99 assign (resid 60 and name HA ) (resid 63 and name HN ) 3.17 1.37 1.37 !peak 898 #SUP 1.00 assign (resid 61 and name HA ) (resid 63 and name HN ) 3.72 1.92 1.92 !peak 900 #SUP 0.82 #QF 0.82 assign (resid 63 and name HN ) (resid 63 and name HB ) 2.52 0.72 0.72 !peak 902 #SUP 0.93 #QF 0.93 assign (resid 63 and name HN ) (resid 63 and name HG11 ) 2.68 0.88 0.88 !peak 903 #SUP 1.00 assign (resid 62 and name HG2 ) (resid 63 and name HN ) 3.29 1.49 1.49 !peak 904 #SUP 1.00 #QF 0.99 assign (resid 61 and name HB ) (resid 63 and name HN ) 3.63 1.83 1.83 !peak 905 #SUP 0.95 #QF 0.95 assign (resid 63 and name HN ) (resid 63 and name HD1* ) 2.96 1.16 1.16 !peak 909 #SUP 0.94 #QF 0.94 assign (resid 61 and name HG2* ) (resid 63 and name HN ) 3.86 2.06 2.06 !peak 910 #SUP 0.97 #QF 0.97 assign (resid 62 and name HN ) (resid 64 and name HN ) 3.56 1.76 1.76 !peak 914 #SUP 0.98 #QF 0.98 assign (resid 60 and name HA ) (resid 64 and name HN ) 3.68 1.88 1.88 !peak 916 #SUP 0.99 #QF 0.99 assign (resid 61 and name HA ) (resid 64 and name HN ) 3.21 1.41 1.41 !peak 919 #SUP 0.98 #QF 0.98 assign (resid 64 and name HN ) (resid 64 and name HB2 ) 2.68 0.88 0.88 !peak 920 #SUP 0.99 #QF 0.99 assign (resid 63 and name HB ) (resid 64 and name HN ) 2.77 0.97 0.97 !peak 921 #SUP 0.96 #QF 0.96 assign (resid 64 and name HN ) (resid 64 and name HG ) 3.42 1.62 1.62 !peak 923 #SUP 0.57 #QF 0.57 assign (resid 64 and name HN ) (resid 64 and name HB1 ) 2.68 0.88 0.88 !peak 924 #SUP 0.99 #QF 0.99 assign (resid 63 and name HG2* ) (resid 64 and name HN ) 2.96 1.16 1.16 !peak 926 #SUP 1.00 assign (resid 65 and name HN ) (resid 66 and name HN ) 2.82 1.02 1.02 !peak 928 #SUP 0.99 #QF 0.99 assign (resid 63 and name HN ) (resid 65 and name HN ) 3.55 1.75 1.74 !peak 930 #SUP 0.86 #QF 0.86 assign (resid 64 and name HN ) (resid 65 and name HN ) 2.75 0.95 0.95 !peak 932 #SUP 0.99 #QF 0.99 assign (resid 61 and name HA ) (resid 65 and name HN ) 3.51 1.71 1.71 !peak 935 #SUP 0.99 #QF 0.99 assign (resid 65 and name HN ) (resid 66 and name HB2 ) 3.96 2.16 2.16 !peak 936 #SUP 0.97 #QF 0.97 assign (resid 64 and name HB2 ) (resid 65 and name HN ) 3.14 1.34 1.34 !peak 937 #SUP 0.98 #QF 0.98 assign (resid 46 and name HB1 ) (resid 65 and name HN ) 3.60 1.80 1.80 !peak 938 #SUP 0.61 #QF 0.61 assign (resid 65 and name HN ) (resid 68 and name HG ) 3.98 2.18 2.18 !peak 939 #SUP 0.90 #QF 0.90 assign (resid 65 and name HN ) (resid 65 and name HB2 ) 2.91 1.11 1.11 !peak 940 #SUP 0.97 #QF 0.97 assign (resid 64 and name HB1 ) (resid 65 and name HN ) 3.14 1.34 1.34 !peak 943 #SUP 0.92 #QF 0.92 assign (resid 64 and name HD2* ) (resid 65 and name HN ) 3.51 1.71 1.71 !peak 944 #SUP 0.99 #QF 0.87 assign (resid 66 and name HN ) (resid 68 and name HN ) 3.46 1.66 1.66 !peak 947 #SUP 1.00 assign (resid 66 and name HN ) (resid 67 and name HN ) 2.78 0.98 0.98 !peak 948 #SUP 1.00 assign (resid 64 and name HN ) (resid 66 and name HN ) 3.57 1.77 1.77 !peak 949 #SUP 0.99 #QF 0.99 assign (resid 66 and name HN ) (resid 67 and name HA ) 4.05 2.25 2.25 !peak 951 #SUP 0.85 #QF 0.85 assign (resid 66 and name HN ) (resid 67 and name HB1 ) 3.96 2.16 2.16 !peak 953 #SUP 0.67 #QF 0.67 assign (resid 66 and name HN ) (resid 67 and name HB2 ) 4.05 2.25 2.25 !peak 954 #SUP 0.97 #QF 0.97 assign (resid 66 and name HN ) (resid 66 and name HB2 ) 2.68 0.88 0.88 !peak 955 #SUP 0.97 #QF 0.97 assign (resid 66 and name HN ) (resid 66 and name HB1 ) 2.86 1.06 1.06 !peak 956 #SUP 1.00 assign (resid 62 and name HB1 ) (resid 66 and name HN ) 4.35 2.55 2.55 !peak 957 #SUP 0.99 #QF 0.61 assign (resid 63 and name HB ) (resid 66 and name HN ) 4.35 2.55 2.55 !peak 957 #SUP 0.99 #QF 0.61 assign (resid 65 and name HB2 ) (resid 66 and name HN ) 3.22 1.42 1.42 !peak 958 #SUP 0.98 #QF 0.98 assign (resid 62 and name HG2 ) (resid 66 and name HN ) 4.35 2.55 2.55 !peak 959 #SUP 0.87 #QF 0.87 assign (resid 63 and name HG2* ) (resid 66 and name HN ) 3.97 2.17 2.17 !peak 961 #SUP 1.00 #QF 0.39 assign (resid 65 and name HD1* ) (resid 66 and name HN ) 3.86 2.06 2.06 !peak 962 #SUP 1.00 #QF 0.99 assign (resid 66 and name HN ) (resid 68 and name HD1* ) 4.17 2.37 2.37 !peak 962 #SUP 1.00 #QF 0.99 assign (resid 67 and name HN ) (resid 68 and name HN ) 2.71 0.91 0.91 !peak 964 #SUP 1.00 assign (resid 64 and name HN ) (resid 67 and name HN ) 4.01 2.21 2.20 !peak 965 #SUP 0.95 #QF 0.43 assign (resid 67 and name HN ) (resid 70 and name HN ) 4.15 2.35 2.35 !peak 965 #SUP 0.95 #QF 0.43 assign (resid 67 and name HN ) (resid 67 and name HD* ) 3.42 1.62 1.62 !peak 966 #SUP 1.00 assign (resid 67 and name HN ) (resid 68 and name HA ) 4.10 2.30 2.30 !peak 969 #SUP 1.00 assign (resid 67 and name HN ) (resid 67 and name HB1 ) 2.72 0.92 0.92 !peak 971 #SUP 0.99 #QF 0.99 assign (resid 67 and name HN ) (resid 67 and name HB2 ) 2.72 0.92 0.92 !peak 972 #SUP 0.99 #QF 0.99 assign (resid 66 and name HB2 ) (resid 67 and name HN ) 3.25 1.45 1.45 !peak 973 #SUP 1.00 assign (resid 67 and name HN ) (resid 68 and name HG ) 3.50 1.70 1.70 !peak 974 #SUP 0.94 #QF 0.94 assign (resid 11 and name HB* ) (resid 67 and name HN ) 3.60 1.80 1.80 !peak 975 #SUP 0.97 #QF 0.97 assign (resid 67 and name HN ) (resid 68 and name HB1 ) 4.35 2.55 2.55 !peak 976 #SUP 0.99 #QF 0.99 assign (resid 63 and name HG2* ) (resid 67 and name HN ) 3.75 1.95 1.95 !peak 977 #SUP 0.98 #QF 0.53 assign (resid 15 and name HG1* ) (resid 67 and name HN ) 3.60 1.80 1.80 !peak 978 #SUP 0.95 #QF 0.95 assign (resid 67 and name HN ) (resid 69 and name HN ) 3.64 1.84 1.84 !peak 980 #SUP 0.95 #QF 0.91 assign (resid 69 and name HN ) (resid 71 and name HN ) 3.90 2.10 2.10 !peak 980 #SUP 0.95 #QF 0.91 assign (resid 66 and name HA ) (resid 69 and name HN ) 3.18 1.38 1.38 !peak 982 #SUP 0.93 #QF 0.93 assign (resid 65 and name HA ) (resid 69 and name HN ) 3.70 1.90 1.90 !peak 985 #SUP 0.97 #QF 0.70 assign (resid 69 and name HN ) (resid 69 and name HG2 ) 3.17 1.37 1.37 !peak 986 #SUP 0.98 #QF 0.98 assign (resid 69 and name HN ) (resid 69 and name HB2 ) 2.55 0.75 0.75 !peak 987 #SUP 0.85 #QF 0.85 assign (resid 11 and name HB* ) (resid 69 and name HN ) 4.35 2.55 2.55 !peak 988 #SUP 0.95 #QF 0.90 assign (resid 68 and name HB1 ) (resid 69 and name HN ) 3.16 1.36 1.36 !peak 989 #SUP 0.95 #QF 0.95 assign (resid 68 and name HD1* ) (resid 69 and name HN ) 3.57 1.77 1.77 !peak 991 #SUP 0.95 #QF 0.95 assign (resid 69 and name HN ) (resid 70 and name HN ) 2.71 0.91 0.91 !peak 992 #SUP 0.97 #QF 0.97 assign (resid 70 and name HN ) (resid 71 and name HN ) 2.82 1.02 1.02 !peak 993 #SUP 0.98 #QF 0.98 assign (resid 67 and name HA ) (resid 70 and name HN ) 3.03 1.23 1.23 !peak 996 #SUP 0.99 #QF 0.44 assign (resid 68 and name HA ) (resid 70 and name HN ) 3.55 1.75 1.75 !peak 997 #SUP 0.85 #QF 0.85 assign (resid 69 and name HB2 ) (resid 70 and name HN ) 2.94 1.14 1.14 !peak 1000 #SUP 0.90 #QF 0.90 assign (resid 69 and name HA ) (resid 71 and name HN ) 3.44 1.64 1.64 !peak 1005 #SUP 0.72 #QF 0.72 assign (resid 70 and name HB2 ) (resid 71 and name HN ) 3.43 1.63 1.63 !peak 1007 #SUP 0.89 #QF 0.82 assign (resid 70 and name HB1 ) (resid 71 and name HN ) 3.43 1.63 1.63 !peak 1007 #SUP 0.89 #QF 0.82 assign (resid 69 and name HB2 ) (resid 71 and name HN ) 4.24 2.44 2.44 !peak 1010 #SUP 0.99 #QF 0.87 assign (resid 69 and name HB1 ) (resid 71 and name HN ) 4.35 2.55 2.55 !peak 1010 #SUP 0.99 #QF 0.87 assign (resid 71 and name HN ) (resid 71 and name HB2 ) 3.04 1.24 1.24 !peak 1011 #SUP 0.99 #QF 0.99 assign (resid 71 and name HN ) (resid 71 and name HB1 ) 3.04 1.24 1.24 !peak 1012 #SUP 0.92 #QF 0.92 assign (resid 68 and name HN ) (resid 70 and name HN ) 3.72 1.92 1.92 !peak 1017 #SUP 0.97 #QF 0.97 assign (resid 67 and name HD* ) (resid 68 and name HN ) 3.34 1.54 1.54 !peak 1018 #SUP 1.00 assign (resid 66 and name HA ) (resid 68 and name HN ) 3.82 2.02 2.02 !peak 1019 #SUP 0.97 #QF 0.97 assign (resid 65 and name HA ) (resid 68 and name HN ) 3.20 1.40 1.40 !peak 1021 #SUP 0.85 #QF 0.85 assign (resid 67 and name HB1 ) (resid 68 and name HN ) 2.95 1.15 1.15 !peak 1022 #SUP 1.00 assign (resid 67 and name HB2 ) (resid 68 and name HN ) 3.15 1.35 1.35 !peak 1023 #SUP 1.00 assign (resid 68 and name HN ) (resid 68 and name HG ) 2.60 0.80 0.80 !peak 1025 #SUP 0.99 #QF 0.69 assign (resid 11 and name HB* ) (resid 68 and name HN ) 3.32 1.52 1.51 !peak 1026 #SUP 1.00 assign (resid 68 and name HN ) (resid 68 and name HB1 ) 3.08 1.28 1.28 !peak 1027 #SUP 1.00 assign (resid 68 and name HN ) (resid 68 and name HD2* ) 3.33 1.53 1.53 !peak 1028 #SUP 1.00 #QF 0.68 assign (resid 68 and name HN ) (resid 68 and name HD1* ) 2.98 1.18 1.18 !peak 1029 #SUP 0.95 #QF 0.95 assign (resid 39 and name HN ) (resid 40 and name HN ) 2.83 1.03 1.03 !peak 1030 #SUP 0.98 #QF 0.98 assign (resid 8 and name HN ) (resid 10 and name HN ) 3.60 1.80 1.80 !peak 1033 #SUP 0.90 #QF 0.90 assign (resid 40 and name HN ) (resid 42 and name HN ) 3.32 1.52 1.52 !peak 1034 #SUP 0.76 #QF 0.76 assign (resid 8 and name HN ) (resid 11 and name HN ) 3.84 2.04 2.04 !peak 1035 #SUP 0.97 #QF 0.97 assign (resid 38 and name HA ) (resid 40 and name HN ) 3.73 1.93 1.93 !peak 1036 #SUP 0.98 #QF 0.98 assign (resid 4 and name HA ) (resid 8 and name HN ) 3.50 1.70 1.70 !peak 1039 #SUP 0.98 #QF 0.98 assign (resid 7 and name HB2 ) (resid 8 and name HN ) 2.75 0.95 0.95 !peak 1044 #SUP 0.61 #QF 0.61 assign (resid 8 and name HN ) (resid 8 and name HG ) 2.74 0.94 0.94 !peak 1045 #SUP 0.69 #QF 0.48 assign (resid 39 and name HB1 ) (resid 40 and name HN ) 2.86 1.06 1.06 !peak 1045 #SUP 0.69 #QF 0.48 assign (resid 8 and name HN ) (resid 8 and name HB1 ) 3.05 1.25 1.25 !peak 1048 #SUP 0.98 #QF 0.98 assign (resid 8 and name HN ) (resid 68 and name HD2* ) 3.33 1.53 1.53 !peak 1049 #SUP 0.83 #QF 0.57 assign (resid 8 and name HN ) (resid 8 and name HD1* ) 3.03 1.23 1.23 !peak 1050 #SUP 0.98 #QF 0.22 assign (resid 8 and name HN ) (resid 8 and name HD2* ) 3.03 1.23 1.23 !peak 1050 #SUP 0.98 #QF 0.22 assign (resid 3 and name HG1* ) (resid 7 and name HN ) 3.98 2.18 2.18 !peak 1052 #SUP 0.90 #QF 0.90 assign (resid 10 and name HN ) (resid 10 and name HD* ) 3.37 1.57 1.57 !peak 1053 #SUP 0.71 #QF 0.71 assign (resid 12 and name HB2 ) (resid 13 and name HN ) 3.22 1.42 1.42 !peak 1054 #SUP 0.99 #QF 0.99 assign (resid 12 and name HD2* ) (resid 13 and name HN ) 3.64 1.84 1.84 !peak 1055 #SUP 0.90 #QF 0.90 assign (resid 15 and name HA ) (resid 18 and name HN ) 3.30 1.50 1.50 !peak 1056 #SUP 0.81 #QF 0.81 assign (resid 19 and name HN ) (resid 63 and name HG2* ) 3.85 2.05 2.05 !peak 1057 #SUP 1.00 #QF 0.85 assign (resid 21 and name HB2 ) (resid 22 and name HN ) 3.85 2.05 2.05 !peak 1060 #SUP 0.96 #QF 0.96 assign (resid 23 and name HN ) (resid 24 and name HN ) 3.11 1.31 1.31 !peak 1061 #SUP 0.86 #QF 0.86 assign (resid 21 and name HB2 ) (resid 25 and name HN ) 3.96 2.16 2.16 !peak 1062 #SUP 0.99 #QF 0.99 assign (resid 26 and name HN ) (resid 26 and name HG* ) 3.05 1.25 1.25 !peak 1063 #SUP 0.90 #QF 0.90 assign (resid 27 and name HN ) (resid 29 and name HN ) 3.50 1.70 1.70 !peak 1064 #SUP 0.96 #QF 0.96 assign (resid 29 and name HN ) (resid 29 and name HG1* ) 3.04 1.24 1.24 !peak 1066 #SUP 0.90 #QF 0.90 assign (resid 33 and name HN ) (resid 33 and name HB1 ) 3.01 1.21 1.21 !peak 1070 #SUP 0.93 #QF 0.93 assign (resid 33 and name HN ) (resid 36 and name HG1* ) 3.73 1.93 1.93 !peak 1072 #SUP 0.66 #QF 0.66 assign (resid 35 and name HB1 ) (resid 36 and name HN ) 3.43 1.63 1.63 !peak 1074 #SUP 0.81 #QF 0.81 assign (resid 39 and name HB1 ) (resid 41 and name HN ) 4.09 2.29 2.29 !peak 1076 #SUP 0.94 #QF 0.94 assign (resid 4 and name HB ) (resid 42 and name HN ) 4.27 2.47 2.47 !peak 1077 #SUP 1.00 #QF 0.68 assign (resid 45 and name HA ) (resid 47 and name HN ) 3.64 1.84 1.84 !peak 1079 #SUP 1.00 assign (resid 46 and name HB1 ) (resid 47 and name HN ) 3.03 1.23 1.23 !peak 1080 #SUP 0.91 #QF 0.91 assign (resid 48 and name HN ) (resid 48 and name HG1 ) 3.27 1.47 1.47 !peak 1081 #SUP 0.96 #QF 0.96 assign (resid 50 and name HN ) (resid 50 and name HG2 ) 3.56 1.76 1.76 !peak 1082 #SUP 1.00 assign (resid 51 and name HB2 ) (resid 52 and name HN ) 2.69 0.89 0.89 !peak 1083 #SUP 0.86 #QF 0.86 assign (resid 52 and name HN ) (resid 53 and name HB* ) 3.34 1.54 1.54 !peak 1084 #SUP 0.96 #QF 0.96 assign (resid 60 and name HN ) (resid 63 and name HD1* ) 3.55 1.75 1.74 !peak 1086 #SUP 1.00 assign (resid 61 and name HG2* ) (resid 64 and name HN ) 3.69 1.89 1.89 !peak 1088 #SUP 0.99 #QF 0.99 assign (resid 65 and name HN ) (resid 67 and name HN ) 3.57 1.77 1.77 !peak 1090 #SUP 0.98 #QF 0.98 assign (resid 64 and name HA ) (resid 67 and name HN ) 3.57 1.77 1.77 !peak 1091 #SUP 0.60 #QF 0.60 assign (resid 36 and name HB ) (resid 42 and name HN ) 3.55 1.75 1.75 !peak 1094 #SUP 0.79 #QF 0.79 assign (resid 23 and name HB2 ) (resid 23 and name HD21 ) 3.21 1.41 1.41 !peak 1095 #SUP 0.98 #QF 0.98 assign (resid 23 and name HB1 ) (resid 23 and name HD21 ) 3.21 1.41 1.41 !peak 1096 #SUP 0.98 #QF 0.98 assign (resid 23 and name HA ) (resid 23 and name HD21 ) 3.94 2.14 2.14 !peak 1097 #SUP 0.97 #QF 0.97 assign (resid 23 and name HN ) (resid 23 and name HD21 ) 3.71 1.91 1.91 !peak 1101 #SUP 0.97 #QF 0.97 assign (resid 23 and name HA ) (resid 23 and name HD22 ) 3.94 2.14 2.14 !peak 1105 #SUP 0.93 #QF 0.93 assign (resid 23 and name HB2 ) (resid 23 and name HD22 ) 3.21 1.41 1.41 !peak 1106 #SUP 0.98 #QF 0.98 assign (resid 23 and name HB1 ) (resid 23 and name HD22 ) 3.21 1.41 1.41 !peak 1107 #SUP 0.98 #QF 0.98 assign (resid 37 and name HN ) (resid 37 and name HD22 ) 3.65 1.85 1.85 !peak 1111 #SUP 0.98 #QF 0.98 assign (resid 37 and name HN ) (resid 37 and name HD21 ) 3.30 1.50 1.50 !peak 1112 #SUP 0.97 #QF 0.97 assign (resid 36 and name HA ) (resid 37 and name HD21 ) 3.65 1.85 1.85 !peak 1115 #SUP 0.91 #QF 0.91 assign (resid 63 and name HN ) (resid 66 and name HN ) 3.78 1.98 1.98 !peak 1118 #SUP 0.95 #QF 0.95 assign (resid 47 and name HG1 ) (resid 47 and name HE ) 3.13 1.33 1.33 !peak 1120 #SUP 0.97 #QF 0.97 assign (resid 5 and name HD* ) (resid 5 and name HE* ) 2.41 0.61 0.61 !peak 187 #SUP 1.00 #QF 0.99 assign (resid 7 and name HD1 ) (resid 7 and name HE* ) 2.62 0.83 0.83 !peak 187 #SUP 1.00 #QF 0.99 assign (resid 31 and name HG1 ) (resid 31 and name HD2 ) 2.50 0.70 0.70 !peak 194 #SUP 0.88 #QF 0.60 assign (resid 10 and name HA ) (resid 10 and name HB2 ) 2.64 0.84 0.84 !peak 211 #SUP 0.92 #QF 0.54 assign (resid 32 and name HG2* ) (resid 32 and name HD1* ) 2.42 0.62 0.62 !peak 219 #SUP 0.94 #QF 0.94 assign (resid 12 and name HD1* ) (resid 29 and name HG2* ) 2.88 1.08 1.08 !peak 225 #SUP 0.89 #QF 0.70 assign (resid 44 and name HN ) (resid 44 and name HG1* ) 3.07 1.27 1.27 !peak 246 #SUP 0.99 #QF 0.99 assign (resid 26 and name HD1 ) (resid 26 and name HE* ) 2.53 0.73 0.73 !peak 252 #SUP 1.00 assign (resid 44 and name HA ) (resid 44 and name HG1* ) 2.79 0.99 0.99 !peak 253 #SUP 1.00 assign (resid 51 and name HA ) (resid 51 and name HB1 ) 2.50 0.70 0.70 !peak 271 #SUP 0.96 #QF 0.96 assign (resid 5 and name HB1 ) (resid 5 and name HD* ) 2.50 0.70 0.70 !peak 274 #SUP 0.85 #QF 0.85 assign (resid 8 and name HA ) (resid 8 and name HD1* ) 3.27 1.47 1.47 !peak 275 #SUP 0.99 #QF 0.99 assign (resid 68 and name HA ) (resid 68 and name HD2* ) 2.79 0.99 0.99 !peak 279 #SUP 0.94 #QF 0.88 assign (resid 4 and name HA ) (resid 4 and name HG2* ) 2.84 1.04 1.04 !peak 286 #SUP 0.95 #QF 0.95 assign (resid 51 and name HB2 ) (resid 51 and name HD* ) 2.92 1.12 1.12 !peak 289 #SUP 1.00 #QF 0.98 assign (resid 51 and name HB1 ) (resid 51 and name HD* ) 3.03 1.23 1.23 !peak 289 #SUP 1.00 #QF 0.98 assign (resid 28 and name HA ) (resid 28 and name HD2* ) 3.33 1.53 1.53 !peak 297 #SUP 0.99 #QF 0.99 assign (resid 61 and name HG2* ) (resid 61 and name HD1* ) 2.53 0.73 0.73 !peak 301 #SUP 0.98 #QF 0.98 assign (resid 13 and name HG2* ) (resid 13 and name HG12 ) 2.70 0.90 0.90 !peak 305 #SUP 1.00 #QF 0.97 assign (resid 68 and name HB2 ) (resid 68 and name HD1* ) 2.72 0.92 0.92 !peak 308 #SUP 1.00 #QF 0.75 assign (resid 12 and name HA ) (resid 15 and name HG2* ) 2.54 0.74 0.74 !peak 312 #SUP 0.92 #QF 0.92 assign (resid 15 and name HG2* ) (resid 19 and name HG2* ) 2.65 0.85 0.85 !peak 314 #SUP 0.85 #QF 0.85 assign (resid 32 and name HB ) (resid 32 and name HD1* ) 2.77 0.97 0.97 !peak 323 #SUP 1.00 #QF 0.96 assign (resid 26 and name HB1 ) (resid 26 and name HG* ) 2.56 0.76 0.76 !peak 327 #SUP 0.94 #QF 0.94 assign (resid 32 and name HG2* ) (resid 32 and name HG12 ) 2.85 1.05 1.05 !peak 334 #SUP 1.00 #QF 0.99 assign (resid 69 and name HA ) (resid 69 and name HG1 ) 3.07 1.27 1.27 !peak 347 #SUP 0.96 #QF 0.30 assign (resid 41 and name HA ) (resid 44 and name HB ) 2.58 0.78 0.78 !peak 349 #SUP 0.35 #QF 0.35 assign (resid 45 and name HA ) (resid 45 and name HG1* ) 2.79 0.99 0.99 !peak 354 #SUP 0.99 #QF 0.99 assign (resid 13 and name HA ) (resid 13 and name HG2* ) 2.59 0.79 0.79 !peak 365 #SUP 0.99 #QF 0.99 assign (resid 16 and name HA ) (resid 19 and name HG2* ) 2.67 0.87 0.87 !peak 373 #SUP 1.00 #QF 0.97 assign (resid 29 and name HG2* ) (resid 32 and name HD1* ) 2.76 0.96 0.96 !peak 376 #SUP 0.92 #QF 0.27 assign (resid 32 and name HD1* ) (resid 45 and name HG2* ) 3.00 1.20 1.20 !peak 376 #SUP 0.92 #QF 0.27 assign (resid 29 and name HA ) (resid 29 and name HG2* ) 2.60 0.80 0.80 !peak 378 #SUP 0.98 #QF 0.98 assign (resid 3 and name HA ) (resid 3 and name HG1* ) 2.81 1.01 1.01 !peak 381 #SUP 1.00 assign (resid 19 and name HG1* ) (resid 63 and name HG2* ) 2.60 0.80 0.80 !peak 385 #SUP 0.64 #QF 0.64 assign (resid 3 and name HA ) (resid 3 and name HG2* ) 2.61 0.81 0.81 !peak 395 #SUP 0.67 #QF 0.67 assign (resid 5 and name HN ) (resid 5 and name HB2 ) 2.75 0.95 0.95 !peak 400 #SUP 0.97 #QF 0.82 assign (resid 45 and name HA ) (resid 45 and name HG2* ) 2.79 0.99 0.99 !peak 402 #SUP 0.95 #QF 0.95 assign (resid 53 and name HB* ) (resid 61 and name HD1* ) 2.62 0.82 0.82 !peak 409 #SUP 0.99 #QF 0.99 assign (resid 7 and name HB2 ) (resid 7 and name HD2 ) 2.84 1.04 1.04 !peak 415 #SUP 1.00 #QF 0.78 assign (resid 28 and name HD2* ) (resid 49 and name HG1 ) 3.64 1.84 1.84 !peak 419 #SUP 0.85 #QF 0.85 assign (resid 28 and name HB2 ) (resid 28 and name HD2* ) 2.79 0.99 0.99 !peak 421 #SUP 0.88 #QF 0.88 assign (resid 10 and name HD* ) (resid 10 and name HE* ) 2.63 0.83 0.83 !peak 424 #SUP 0.91 #QF 0.91 assign (resid 59 and name HG2* ) (resid 63 and name HD1* ) 2.63 0.83 0.83 !peak 425 #SUP 0.89 #QF 0.89 assign (resid 19 and name HA ) (resid 19 and name HG1* ) 2.64 0.84 0.84 !peak 428 #SUP 0.81 #QF 0.81 assign (resid 28 and name HG ) (resid 32 and name HD1* ) 2.64 0.84 0.84 !peak 431 #SUP 0.33 #QF 0.33 assign (resid 15 and name HG1* ) (resid 63 and name HG2* ) 2.64 0.84 0.84 !peak 439 #SUP 0.71 #QF 0.71 assign (resid 31 and name HB1 ) (resid 31 and name HD2 ) 3.14 1.34 1.34 !peak 440 #SUP 1.00 #QF 0.99 assign (resid 26 and name HG* ) (resid 26 and name HE* ) 2.65 0.85 0.85 !peak 449 #SUP 0.99 #QF 0.99 assign (resid 44 and name HA ) (resid 44 and name HG2* ) 2.79 0.99 0.99 !peak 451 #SUP 0.99 #QF 0.77 assign (resid 36 and name HA ) (resid 36 and name HG1* ) 2.66 0.86 0.86 !peak 463 #SUP 0.98 #QF 0.98 assign (resid 8 and name HB2 ) (resid 8 and name HD2* ) 2.91 1.11 1.11 !peak 467 #SUP 1.00 #QF 0.49 assign (resid 12 and name HB2 ) (resid 12 and name HD1* ) 2.94 1.14 1.14 !peak 467 #SUP 1.00 #QF 0.49 assign (resid 36 and name HG2* ) (resid 42 and name HA ) 2.77 0.97 0.97 !peak 472 #SUP 1.00 assign (resid 8 and name HD1* ) (resid 42 and name HB* ) 2.99 1.19 1.19 !peak 473 #SUP 0.70 #QF 0.70 assign (resid 32 and name HD1* ) (resid 45 and name HG1* ) 3.00 1.20 1.20 !peak 481 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 39 and name HA ) 2.99 1.19 1.19 !peak 484 #SUP 0.94 #QF 0.94 assign (resid 28 and name HB1 ) (resid 28 and name HD1* ) 3.19 1.39 1.39 !peak 485 #SUP 0.98 #QF 0.94 assign (resid 2 and name HA ) (resid 3 and name HN ) 2.68 0.88 0.88 !peak 486 #SUP 0.98 #QF 0.98 assign (resid 43 and name HB ) (resid 43 and name HD1* ) 2.68 0.88 0.88 !peak 493 #SUP 0.99 #QF 0.99 assign (resid 32 and name HA ) (resid 32 and name HG2* ) 2.68 0.88 0.88 !peak 497 #SUP 0.98 #QF 0.98 assign (resid 43 and name HA ) (resid 43 and name HG2* ) 2.69 0.89 0.89 !peak 503 #SUP 0.99 #QF 0.99 assign (resid 71 and name HA ) (resid 72 and name HD1 ) 2.72 0.92 0.92 !peak 505 #SUP 1.00 assign (resid 10 and name HA ) (resid 10 and name HG1 ) 3.09 1.29 1.28 !peak 519 #SUP 0.99 #QF 0.56 assign (resid 13 and name HB ) (resid 13 and name HD1* ) 2.73 0.93 0.93 !peak 524 #SUP 0.99 #QF 0.35 assign (resid 10 and name HA ) (resid 10 and name HG2 ) 3.09 1.29 1.28 !peak 525 #SUP 0.99 #QF 0.60 assign (resid 63 and name HA ) (resid 63 and name HG2* ) 2.71 0.91 0.91 !peak 528 #SUP 0.94 #QF 0.94 assign (resid 15 and name HA ) (resid 15 and name HG1* ) 2.71 0.91 0.91 !peak 536 #SUP 0.98 #QF 0.98 assign (resid 29 and name HA ) (resid 29 and name HG1* ) 2.71 0.91 0.91 !peak 538 #SUP 1.00 assign (resid 71 and name HA ) (resid 72 and name HD2 ) 2.72 0.92 0.92 !peak 541 #SUP 0.98 #QF 0.98 assign (resid 59 and name HA ) (resid 59 and name HG2* ) 2.72 0.92 0.92 !peak 543 #SUP 0.99 #QF 0.99 assign (resid 29 and name HN ) (resid 29 and name HB ) 2.72 0.92 0.92 !peak 546 #SUP 0.99 #QF 0.99 assign (resid 19 and name HG2* ) (resid 22 and name HD* ) 2.72 0.92 0.92 !peak 548 #SUP 0.98 #QF 0.98 assign (resid 12 and name HD2* ) (resid 26 and name HG* ) 2.99 1.19 1.19 !peak 557 #SUP 0.88 #QF 0.49 assign (resid 46 and name HB2 ) (resid 46 and name HD2* ) 3.13 1.33 1.33 !peak 557 #SUP 0.88 #QF 0.49 assign (resid 15 and name HN ) (resid 15 and name HG1* ) 2.72 0.92 0.92 !peak 561 #SUP 0.99 #QF 0.99 assign (resid 46 and name HB2 ) (resid 46 and name HD1* ) 3.13 1.33 1.33 !peak 562 #SUP 1.00 #QF 0.80 assign (resid 4 and name HA ) (resid 4 and name HG1* ) 2.84 1.04 1.04 !peak 564 #SUP 1.00 assign (resid 43 and name HA ) (resid 65 and name HD2* ) 3.53 1.73 1.73 !peak 567 #SUP 0.95 #QF 0.75 assign (resid 63 and name HG2* ) (resid 63 and name HG12 ) 2.73 0.93 0.93 !peak 568 #SUP 0.95 #QF 0.95 assign (resid 15 and name HB ) (resid 63 and name HG2* ) 2.73 0.93 0.93 !peak 570 #SUP 0.95 #QF 0.95 assign (resid 41 and name HA ) (resid 44 and name HG1* ) 3.41 1.61 1.61 !peak 571 #SUP 1.00 assign (resid 4 and name HG1* ) (resid 42 and name HB* ) 2.96 1.16 1.16 !peak 575 #SUP 0.89 #QF 0.89 assign (resid 64 and name HB1 ) (resid 64 and name HD2* ) 2.94 1.14 1.14 !peak 576 #SUP 0.99 #QF 0.99 assign (resid 4 and name HG1* ) (resid 38 and name HA ) 3.57 1.77 1.77 !peak 578 #SUP 0.97 #QF 0.97 assign (resid 55 and name HA ) (resid 57 and name HB1 ) 3.19 1.39 1.39 !peak 580 #SUP 0.40 #QF 0.40 assign (resid 63 and name HB ) (resid 63 and name HD1* ) 2.76 0.96 0.96 !peak 585 #SUP 0.98 #QF 0.27 assign (resid 61 and name HA ) (resid 61 and name HG2* ) 2.74 0.94 0.94 !peak 586 #SUP 0.99 #QF 0.99 assign (resid 28 and name HD1* ) (resid 61 and name HD1* ) 3.54 1.74 1.74 !peak 589 #SUP 0.96 #QF 0.96 assign (resid 55 and name HA ) (resid 56 and name HA ) 2.74 0.94 0.94 !peak 591 #SUP 0.95 #QF 0.95 assign (resid 12 and name HD2* ) (resid 26 and name HA ) 2.84 1.04 1.04 !peak 598 #SUP 0.95 #QF 0.95 assign (resid 8 and name HB1 ) (resid 8 and name HD1* ) 2.92 1.12 1.12 !peak 604 #SUP 1.00 assign (resid 24 and name HA ) (resid 27 and name HB* ) 2.75 0.95 0.95 !peak 611 #SUP 0.89 #QF 0.89 assign (resid 9 and name HB1 ) (resid 10 and name HN ) 3.11 1.31 1.31 !peak 616 #SUP 0.97 #QF 0.82 assign (resid 4 and name HG1* ) (resid 39 and name HA ) 2.99 1.19 1.19 !peak 620 #SUP 0.99 #QF 0.99 assign (resid 26 and name HA ) (resid 26 and name HG* ) 2.76 0.96 0.96 !peak 622 #SUP 0.99 #QF 0.99 assign (resid 63 and name HA ) (resid 63 and name HG12 ) 2.76 0.96 0.96 !peak 623 #SUP 0.28 #QF 0.28 assign (resid 6 and name HN ) (resid 6 and name HB2 ) 3.00 1.20 1.20 !peak 630 #SUP 0.98 #QF 0.98 assign (resid 25 and name HD2* ) (resid 61 and name HA ) 3.36 1.56 1.56 !peak 631 #SUP 0.99 #QF 0.99 assign (resid 53 and name HB* ) (resid 58 and name HA ) 2.77 0.97 0.97 !peak 638 #SUP 0.95 #QF 0.95 assign (resid 46 and name HB1 ) (resid 46 and name HD1* ) 2.83 1.03 1.03 !peak 639 #SUP 1.00 assign (resid 14 and name HA ) (resid 14 and name HG2 ) 2.77 0.97 0.97 !peak 640 #SUP 0.79 #QF 0.79 assign (resid 9 and name HN ) (resid 9 and name HG2 ) 2.90 1.10 1.10 !peak 650 #SUP 0.84 #QF 0.84 assign (resid 32 and name HN ) (resid 32 and name HB ) 3.02 1.22 1.22 !peak 663 #SUP 0.97 #QF 0.97 assign (resid 15 and name HG1* ) (resid 64 and name HA ) 3.02 1.22 1.22 !peak 664 #SUP 1.00 assign (resid 29 and name HA ) (resid 32 and name HG12 ) 2.79 0.99 0.99 !peak 670 #SUP 0.98 #QF 0.98 assign (resid 28 and name HB2 ) (resid 28 and name HD1* ) 2.79 0.99 0.99 !peak 680 #SUP 0.85 #QF 0.85 assign (resid 68 and name HA ) (resid 68 and name HG ) 3.09 1.29 1.28 !peak 684 #SUP 1.00 #QF 0.95 assign (resid 13 and name HG2* ) (resid 13 and name HG11 ) 2.79 0.99 0.99 !peak 686 #SUP 0.99 #QF 0.99 assign (resid 10 and name HA ) (resid 13 and name HD1* ) 2.80 1.00 1.00 !peak 690 #SUP 0.96 #QF 0.96 assign (resid 3 and name HG2* ) (resid 7 and name HE* ) 2.80 1.00 1.00 !peak 691 #SUP 0.95 #QF 0.95 assign (resid 8 and name HA ) (resid 11 and name HB* ) 2.80 1.00 1.00 !peak 694 #SUP 1.00 assign (resid 40 and name HA ) (resid 40 and name HG2 ) 3.09 1.29 1.29 !peak 695 #SUP 0.87 #QF 0.56 assign (resid 40 and name HA ) (resid 40 and name HG1 ) 3.09 1.29 1.29 !peak 695 #SUP 0.87 #QF 0.56 assign (resid 36 and name HG1* ) (resid 42 and name HA ) 2.80 1.00 1.00 !peak 696 #SUP 0.99 #QF 0.99 assign (resid 18 and name HB2 ) (resid 63 and name HG2* ) 2.80 1.00 1.00 !peak 699 #SUP 0.93 #QF 0.93 assign (resid 50 and name HA ) (resid 61 and name HD1* ) 2.81 1.01 1.01 !peak 708 #SUP 1.00 assign (resid 15 and name HA ) (resid 18 and name HD* ) 2.81 1.01 1.01 !peak 709 #SUP 0.94 #QF 0.94 assign (resid 39 and name HG ) (resid 43 and name HD1* ) 3.04 1.24 1.24 !peak 712 #SUP 0.80 #QF 0.80 assign (resid 19 and name HA ) (resid 19 and name HG2* ) 2.81 1.01 1.01 !peak 714 #SUP 1.00 assign (resid 64 and name HB2 ) (resid 64 and name HD1* ) 2.94 1.14 1.14 !peak 716 #SUP 0.99 #QF 0.99 assign (resid 46 and name HD1* ) (resid 65 and name HB1 ) 4.36 2.56 2.56 !peak 723 #SUP 0.85 #QF 0.71 assign (resid 60 and name HA ) (resid 63 and name HD1* ) 2.82 1.02 1.02 !peak 729 #SUP 0.98 #QF 0.98 assign (resid 29 and name HA ) (resid 32 and name HD1* ) 2.86 1.06 1.06 !peak 734 #SUP 1.00 #QF 0.60 assign (resid 13 and name HA ) (resid 13 and name HG12 ) 2.82 1.02 1.02 !peak 735 #SUP 0.99 #QF 0.99 assign (resid 9 and name HA ) (resid 9 and name HG1 ) 3.18 1.38 1.38 !peak 737 #SUP 0.96 #QF 0.96 assign (resid 66 and name HA ) (resid 69 and name HB2 ) 3.15 1.35 1.35 !peak 744 #SUP 0.99 #QF 0.98 assign (resid 64 and name HB1 ) (resid 64 and name HD1* ) 2.94 1.14 1.14 !peak 745 #SUP 1.00 assign (resid 22 and name HA ) (resid 22 and name HD* ) 2.83 1.03 1.03 !peak 746 #SUP 0.99 #QF 0.99 assign (resid 8 and name HN ) (resid 8 and name HB2 ) 2.98 1.18 1.18 !peak 751 #SUP 1.00 #QF 0.98 assign (resid 8 and name HB2 ) (resid 9 and name HN ) 3.12 1.32 1.32 !peak 751 #SUP 1.00 #QF 0.98 assign (resid 46 and name HB1 ) (resid 46 and name HD2* ) 2.83 1.03 1.03 !peak 758 #SUP 0.92 #QF 0.92 assign (resid 36 and name HA ) (resid 36 and name HG2* ) 2.83 1.03 1.03 !peak 759 #SUP 0.87 #QF 0.87 assign (resid 40 and name HA ) (resid 43 and name HD1* ) 2.83 1.03 1.03 !peak 761 #SUP 0.81 #QF 0.81 assign (resid 50 and name HB2 ) (resid 61 and name HG2* ) 2.84 1.04 1.04 !peak 762 #SUP 0.99 #QF 0.99 assign (resid 12 and name HD1* ) (resid 26 and name HA ) 2.84 1.04 1.04 !peak 763 #SUP 1.00 assign (resid 13 and name HA ) (resid 13 and name HG11 ) 2.84 1.04 1.04 !peak 764 #SUP 0.97 #QF 0.97 assign (resid 46 and name HB1 ) (resid 65 and name HD2* ) 3.02 1.22 1.22 !peak 771 #SUP 1.00 assign (resid 15 and name HA ) (resid 15 and name HG2* ) 2.84 1.04 1.04 !peak 784 #SUP 0.95 #QF 0.95 assign (resid 48 and name HN ) (resid 48 and name HB2 ) 2.97 1.17 1.17 !peak 787 #SUP 1.00 assign (resid 8 and name HB1 ) (resid 29 and name HG1* ) 2.86 1.06 1.06 !peak 789 #SUP 0.98 #QF 0.98 assign (resid 8 and name HB2 ) (resid 8 and name HD1* ) 2.91 1.11 1.11 !peak 793 #SUP 0.98 #QF 0.97 assign (resid 45 and name HA ) (resid 48 and name HG2 ) 2.86 1.06 1.06 !peak 797 #SUP 0.92 #QF 0.92 assign (resid 29 and name HG1* ) (resid 30 and name HN ) 2.95 1.15 1.15 !peak 798 #SUP 0.92 #QF 0.57 assign (resid 51 and name HA ) (resid 51 and name HG1 ) 2.98 1.18 1.18 !peak 800 #SUP 0.67 #QF 0.67 assign (resid 30 and name HN ) (resid 30 and name HB1 ) 2.86 1.06 1.06 !peak 812 #SUP 0.95 #QF 0.95 assign (resid 19 and name HG2* ) (resid 22 and name HA ) 2.87 1.07 1.07 !peak 819 #SUP 0.62 #QF 0.62 assign (resid 12 and name HB1 ) (resid 12 and name HD1* ) 2.94 1.14 1.14 !peak 824 #SUP 0.51 #QF 0.51 assign (resid 55 and name HB2 ) (resid 56 and name HA ) 2.87 1.07 1.07 !peak 825 #SUP 0.99 #QF 0.99 assign (resid 47 and name HA ) (resid 47 and name HG1 ) 2.87 1.07 1.07 !peak 827 #SUP 0.92 #QF 0.92 assign (resid 32 and name HG2* ) (resid 32 and name HG11 ) 2.87 1.07 1.07 !peak 834 #SUP 1.00 assign (resid 68 and name HB1 ) (resid 68 and name HD1* ) 2.87 1.07 1.07 !peak 837 #SUP 1.00 assign (resid 26 and name HA ) (resid 29 and name HB ) 2.87 1.07 1.07 !peak 842 #SUP 0.99 #QF 0.99 assign (resid 19 and name HG1* ) (resid 60 and name HA ) 2.88 1.08 1.08 !peak 852 #SUP 0.79 #QF 0.79 assign (resid 18 and name HB1 ) (resid 63 and name HG2* ) 2.97 1.17 1.17 !peak 854 #SUP 0.92 #QF 0.86 assign (resid 48 and name HA ) (resid 51 and name HB2 ) 3.00 1.20 1.20 !peak 857 #SUP 0.91 #QF 0.91 assign (resid 48 and name HA ) (resid 51 and name HD* ) 2.88 1.08 1.08 !peak 860 #SUP 0.90 #QF 0.90 assign (resid 16 and name HA ) (resid 19 and name HG1* ) 3.38 1.58 1.58 !peak 862 #SUP 0.77 #QF 0.77 assign (resid 12 and name HA ) (resid 12 and name HD1* ) 3.49 1.69 1.69 !peak 864 #SUP 1.00 assign (resid 54 and name HN ) (resid 54 and name HB1 ) 3.13 1.33 1.33 !peak 867 #SUP 0.98 #QF 0.98 assign (resid 46 and name HN ) (resid 46 and name HB1 ) 3.15 1.35 1.35 !peak 869 #SUP 1.00 assign (resid 46 and name HD2* ) (resid 65 and name HB1 ) 4.36 2.56 2.56 !peak 876 #SUP 0.76 #QF 0.59 assign (resid 46 and name HB2 ) (resid 65 and name HD2* ) 3.09 1.29 1.28 !peak 880 #SUP 0.99 #QF 0.99 assign (resid 10 and name HG1 ) (resid 10 and name HE* ) 3.10 1.30 1.30 !peak 881 #SUP 0.97 #QF 0.97 assign (resid 25 and name HB2 ) (resid 25 and name HD1* ) 3.21 1.41 1.41 !peak 891 #SUP 0.97 #QF 0.78 assign (resid 25 and name HB2 ) (resid 25 and name HD2* ) 3.21 1.41 1.41 !peak 891 #SUP 0.97 #QF 0.78 assign (resid 8 and name HG ) (resid 29 and name HG1* ) 3.42 1.62 1.62 !peak 894 #SUP 0.99 #QF 0.95 assign (resid 12 and name HG ) (resid 64 and name HD2* ) 3.73 1.93 1.93 !peak 894 #SUP 0.99 #QF 0.95 assign (resid 8 and name HG ) (resid 68 and name HD2* ) 3.79 1.99 1.99 !peak 894 #SUP 0.99 #QF 0.95 assign (resid 49 and name HB2 ) (resid 61 and name HD1* ) 3.09 1.29 1.29 !peak 897 #SUP 0.95 #QF 0.95 assign (resid 4 and name HG2* ) (resid 5 and name HN ) 3.15 1.35 1.35 !peak 900 #SUP 0.99 #QF 0.99 assign (resid 61 and name HG2* ) (resid 61 and name HG11 ) 2.90 1.10 1.10 !peak 915 #SUP 0.78 #QF 0.78 assign (resid 12 and name HG ) (resid 29 and name HG2* ) 3.32 1.52 1.51 !peak 917 #SUP 0.99 #QF 0.46 assign (resid 68 and name HB2 ) (resid 68 and name HD2* ) 3.21 1.41 1.41 !peak 922 #SUP 1.00 #QF 0.66 assign (resid 15 and name HB ) (resid 19 and name HG1* ) 2.94 1.14 1.14 !peak 925 #SUP 0.92 #QF 0.74 assign (resid 65 and name HN ) (resid 65 and name HB1 ) 2.91 1.11 1.11 !peak 926 #SUP 0.98 #QF 0.98 assign (resid 6 and name HN ) (resid 6 and name HG1 ) 3.32 1.52 1.52 !peak 928 #SUP 0.69 #QF 0.57 assign (resid 40 and name HA ) (resid 43 and name HB ) 3.29 1.49 1.49 !peak 930 #SUP 0.93 #QF 0.93 assign (resid 15 and name HG1* ) (resid 67 and name HB2 ) 2.91 1.11 1.11 !peak 934 #SUP 1.00 assign (resid 68 and name HN ) (resid 68 and name HB2 ) 3.21 1.41 1.41 !peak 938 #SUP 1.00 assign (resid 68 and name HB2 ) (resid 69 and name HN ) 3.37 1.57 1.57 !peak 938 #SUP 1.00 assign (resid 48 and name HA ) (resid 48 and name HG2 ) 3.17 1.37 1.37 !peak 941 #SUP 0.96 #QF 0.96 assign (resid 8 and name HB2 ) (resid 29 and name HG1* ) 2.92 1.12 1.12 !peak 943 #SUP 0.97 #QF 0.97 assign (resid 6 and name HA ) (resid 6 and name HG2 ) 3.34 1.54 1.54 !peak 946 #SUP 0.81 #QF 0.20 assign (resid 41 and name HA ) (resid 41 and name HG1 ) 3.22 1.42 1.42 !peak 946 #SUP 0.81 #QF 0.20 assign (resid 46 and name HB1 ) (resid 61 and name HG2* ) 3.01 1.21 1.21 !peak 949 #SUP 0.91 #QF 0.66 assign (resid 49 and name HB1 ) (resid 61 and name HG2* ) 3.33 1.53 1.53 !peak 949 #SUP 0.91 #QF 0.66 assign (resid 36 and name HB ) (resid 41 and name HB2 ) 2.92 1.12 1.12 !peak 952 #SUP 0.99 #QF 0.99 assign (resid 4 and name HG2* ) (resid 5 and name HA ) 3.41 1.61 1.61 !peak 954 #SUP 0.99 #QF 0.75 assign (resid 63 and name HA ) (resid 63 and name HG11 ) 2.92 1.12 1.12 !peak 960 #SUP 0.98 #QF 0.98 assign (resid 9 and name HA ) (resid 9 and name HG2 ) 3.18 1.38 1.38 !peak 961 #SUP 0.99 #QF 0.99 assign (resid 8 and name HB1 ) (resid 8 and name HD2* ) 2.92 1.12 1.12 !peak 964 #SUP 1.00 assign (resid 54 and name HN ) (resid 54 and name HB2 ) 3.13 1.33 1.33 !peak 966 #SUP 0.96 #QF 0.96 assign (resid 19 and name HN ) (resid 19 and name HG1* ) 2.92 1.12 1.12 !peak 969 #SUP 0.86 #QF 0.86 assign (resid 5 and name HA ) (resid 5 and name HG2 ) 2.96 1.16 1.16 !peak 970 #SUP 0.84 #QF 0.84 assign (resid 12 and name HD1* ) (resid 29 and name HB ) 3.40 1.60 1.60 !peak 973 #SUP 1.00 assign (resid 23 and name HA ) (resid 26 and name HB2 ) 2.93 1.13 1.13 !peak 974 #SUP 0.98 #QF 0.98 assign (resid 7 and name HA ) (resid 7 and name HG1 ) 3.20 1.40 1.40 !peak 980 #SUP 0.98 #QF 0.96 assign (resid 13 and name HN ) (resid 13 and name HG2* ) 3.18 1.38 1.38 !peak 981 #SUP 0.96 #QF 0.96 assign (resid 63 and name HG2* ) (resid 63 and name HG11 ) 2.94 1.14 1.14 !peak 987 #SUP 1.00 assign (resid 58 and name HA ) (resid 61 and name HD1* ) 2.94 1.14 1.14 !peak 990 #SUP 0.99 #QF 0.99 assign (resid 19 and name HB ) (resid 60 and name HA ) 3.14 1.34 1.34 !peak 994 #SUP 1.00 #QF 0.94 assign (resid 11 and name HB* ) (resid 67 and name HD* ) 2.94 1.14 1.14 !peak 995 #SUP 1.00 assign (resid 16 and name HA ) (resid 16 and name HG1 ) 3.15 1.35 1.35 !peak 997 #SUP 0.97 #QF 0.97 assign (resid 7 and name HD1 ) (resid 39 and name HD1* ) 3.46 1.66 1.66 !peak 1002 #SUP 0.91 #QF 0.69 assign (resid 7 and name HD1 ) (resid 39 and name HD2* ) 3.46 1.66 1.66 !peak 1002 #SUP 0.91 #QF 0.69 assign (resid 64 and name HB2 ) (resid 64 and name HD2* ) 2.94 1.14 1.14 !peak 1005 #SUP 0.99 #QF 0.99 assign (resid 12 and name HB1 ) (resid 12 and name HD2* ) 2.94 1.14 1.14 !peak 1009 #SUP 0.90 #QF 0.90 assign (resid 61 and name HG2* ) (resid 61 and name HG12 ) 2.95 1.15 1.15 !peak 1013 #SUP 1.00 assign (resid 4 and name HN ) (resid 4 and name HG2* ) 3.08 1.28 1.28 !peak 1029 #SUP 1.00 assign (resid 43 and name HA ) (resid 43 and name HG12 ) 3.04 1.24 1.24 !peak 1031 #SUP 1.00 assign (resid 3 and name HB ) (resid 4 and name HN ) 3.21 1.41 1.41 !peak 1033 #SUP 1.00 assign (resid 32 and name HG2* ) (resid 45 and name HB ) 3.41 1.61 1.61 !peak 1034 #SUP 0.97 #QF 0.95 assign (resid 13 and name HN ) (resid 13 and name HG12 ) 3.09 1.29 1.28 !peak 1042 #SUP 1.00 assign (resid 31 and name HA ) (resid 31 and name HG1 ) 2.96 1.16 1.16 !peak 1048 #SUP 0.99 #QF 0.99 assign (resid 52 and name HG2 ) (resid 52 and name HE* ) 3.27 1.47 1.47 !peak 1049 #SUP 0.99 #QF 0.91 assign (resid 52 and name HG1 ) (resid 52 and name HE* ) 3.27 1.47 1.47 !peak 1049 #SUP 0.99 #QF 0.91 assign (resid 27 and name HA ) (resid 30 and name HB2 ) 3.09 1.29 1.29 !peak 1051 #SUP 0.81 #QF 0.81 assign (resid 7 and name HB1 ) (resid 68 and name HD2* ) 2.96 1.16 1.16 !peak 1053 #SUP 0.61 #QF 0.61 assign (resid 19 and name HG1* ) (resid 20 and name HN ) 3.22 1.42 1.42 !peak 1063 #SUP 0.78 #QF 0.78 assign (resid 71 and name HB2 ) (resid 72 and name HD1 ) 3.65 1.85 1.85 !peak 1068 #SUP 1.00 assign (resid 41 and name HA ) (resid 41 and name HG2 ) 3.22 1.42 1.42 !peak 1072 #SUP 0.99 #QF 0.99 assign (resid 50 and name HB1 ) (resid 61 and name HG2* ) 2.97 1.17 1.17 !peak 1074 #SUP 0.99 #QF 0.99 assign (resid 50 and name HA ) (resid 50 and name HG1 ) 3.06 1.26 1.26 !peak 1075 #SUP 0.99 #QF 0.99 assign (resid 65 and name HA ) (resid 68 and name HB2 ) 3.22 1.42 1.42 !peak 1087 #SUP 0.76 #QF 0.43 assign (resid 65 and name HA ) (resid 68 and name HG ) 3.45 1.65 1.65 !peak 1087 #SUP 0.76 #QF 0.43 assign (resid 51 and name HA ) (resid 51 and name HG2 ) 2.98 1.18 1.18 !peak 1093 #SUP 0.94 #QF 0.94 assign (resid 13 and name HA ) (resid 13 and name HD1* ) 3.24 1.44 1.44 !peak 1102 #SUP 1.00 assign (resid 25 and name HA ) (resid 57 and name HZ ) 2.98 1.18 1.18 !peak 1105 #SUP 0.99 #QF 0.99 assign (resid 41 and name HA ) (resid 44 and name HN ) 2.98 1.18 1.18 !peak 1107 #SUP 0.99 #QF 0.99 assign (resid 32 and name HB ) (resid 45 and name HG2* ) 3.37 1.57 1.57 !peak 1111 #SUP 0.93 #QF 0.93 assign (resid 12 and name HN ) (resid 12 and name HG ) 3.50 1.70 1.70 !peak 1112 #SUP 0.92 #QF 0.92 assign (resid 32 and name HB ) (resid 33 and name HN ) 3.25 1.45 1.45 !peak 1113 #SUP 0.98 #QF 0.98 assign (resid 19 and name HG2* ) (resid 22 and name HB2 ) 2.98 1.18 1.18 !peak 1115 #SUP 1.00 assign (resid 12 and name HD1* ) (resid 26 and name HG* ) 2.99 1.19 1.19 !peak 1123 #SUP 0.99 #QF 0.99 assign (resid 3 and name HA ) (resid 6 and name HB1 ) 3.25 1.45 1.45 !peak 1125 #SUP 0.71 #QF 0.71 assign (resid 14 and name HN ) (resid 14 and name HG1 ) 2.99 1.19 1.19 !peak 1139 #SUP 0.90 #QF 0.90 assign (resid 42 and name HA ) (resid 45 and name HB ) 3.26 1.46 1.46 !peak 1144 #SUP 1.00 assign (resid 50 and name HA ) (resid 53 and name HB* ) 2.99 1.19 1.19 !peak 1145 #SUP 0.97 #QF 0.97 assign (resid 47 and name HB1 ) (resid 47 and name HD2 ) 3.21 1.41 1.41 !peak 1147 #SUP 1.00 assign (resid 43 and name HA ) (resid 46 and name HB1 ) 3.40 1.60 1.60 !peak 1153 #SUP 0.90 #QF 0.90 assign (resid 10 and name HA ) (resid 13 and name HB ) 3.00 1.20 1.20 !peak 1156 #SUP 0.91 #QF 0.91 assign (resid 36 and name HG1* ) (resid 41 and name HB2 ) 3.00 1.20 1.20 !peak 1160 #SUP 0.99 #QF 0.99 assign (resid 11 and name HB* ) (resid 64 and name HA ) 3.32 1.52 1.51 !peak 1172 #SUP 0.96 #QF 0.78 assign (resid 25 and name HG ) (resid 29 and name HG2* ) 3.01 1.21 1.21 !peak 1174 #SUP 0.70 #QF 0.70 assign (resid 31 and name HA ) (resid 34 and name HN ) 3.34 1.54 1.54 !peak 1175 #SUP 0.99 #QF 0.98 assign (resid 46 and name HA ) (resid 46 and name HG ) 3.01 1.21 1.21 !peak 1186 #SUP 0.97 #QF 0.97 assign (resid 67 and name HA ) (resid 67 and name HD* ) 3.01 1.21 1.21 !peak 1187 #SUP 1.00 assign (resid 43 and name HN ) (resid 43 and name HG2* ) 3.15 1.35 1.35 !peak 1189 #SUP 1.00 assign (resid 29 and name HG2* ) (resid 32 and name HG12 ) 3.50 1.70 1.70 !peak 1190 #SUP 0.98 #QF 0.75 assign (resid 6 and name HB2 ) (resid 7 and name HN ) 3.41 1.61 1.61 !peak 1194 #SUP 0.99 #QF 0.99 assign (resid 15 and name HG1* ) (resid 67 and name HD* ) 3.02 1.22 1.22 !peak 1198 #SUP 0.81 #QF 0.81 assign (resid 8 and name HB1 ) (resid 29 and name HG2* ) 3.02 1.22 1.22 !peak 1199 #SUP 0.94 #QF 0.94 assign (resid 13 and name HA ) (resid 16 and name HB2 ) 3.02 1.22 1.22 !peak 1200 #SUP 0.96 #QF 0.96 assign (resid 15 and name HG1* ) (resid 67 and name HB1 ) 3.15 1.35 1.35 !peak 1202 #SUP 0.99 #QF 0.99 assign (resid 49 and name HB2 ) (resid 61 and name HG2* ) 3.33 1.53 1.53 !peak 1204 #SUP 0.97 #QF 0.32 assign (resid 26 and name HA ) (resid 29 and name HG2* ) 3.15 1.35 1.35 !peak 1207 #SUP 0.99 #QF 0.99 assign (resid 12 and name HA ) (resid 12 and name HG ) 3.02 1.22 1.22 !peak 1208 #SUP 0.93 #QF 0.93 assign (resid 11 and name HB* ) (resid 68 and name HG ) 3.02 1.22 1.22 !peak 1211 #SUP 0.99 #QF 0.99 assign (resid 59 and name HG2* ) (resid 63 and name HG11 ) 3.02 1.22 1.22 !peak 1212 #SUP 1.00 assign (resid 46 and name HB1 ) (resid 65 and name HD1* ) 3.02 1.22 1.22 !peak 1214 #SUP 0.88 #QF 0.88 assign (resid 47 and name HA ) (resid 50 and name HB1 ) 3.02 1.22 1.22 !peak 1215 #SUP 0.80 #QF 0.80 assign (resid 28 and name HA ) (resid 31 and name HB2 ) 3.02 1.22 1.22 !peak 1217 #SUP 0.99 #QF 0.99 assign (resid 32 and name HB ) (resid 45 and name HG1* ) 3.37 1.57 1.57 !peak 1219 #SUP 0.99 #QF 0.98 assign (resid 47 and name HG2 ) (resid 65 and name HD1* ) 3.44 1.64 1.64 !peak 1224 #SUP 1.00 assign (resid 31 and name HB2 ) (resid 32 and name HN ) 3.03 1.23 1.23 !peak 1225 #SUP 0.95 #QF 0.95 assign (resid 15 and name HG2* ) (resid 64 and name HA ) 3.03 1.23 1.23 !peak 1227 #SUP 0.97 #QF 0.97 assign (resid 50 and name HB2 ) (resid 62 and name HB1 ) 3.88 2.08 2.08 !peak 1229 #SUP 0.82 #QF 0.23 assign (resid 62 and name HB2 ) (resid 63 and name HG11 ) 4.01 2.21 2.20 !peak 1229 #SUP 0.82 #QF 0.23 assign (resid 50 and name HA ) (resid 61 and name HG2* ) 3.03 1.23 1.23 !peak 1231 #SUP 0.99 #QF 0.99 assign (resid 24 and name HA ) (resid 27 and name HN ) 3.17 1.37 1.37 !peak 1233 #SUP 0.99 #QF 0.99 assign (resid 5 and name HG2 ) (resid 5 and name HE* ) 3.03 1.23 1.23 !peak 1235 #SUP 0.99 #QF 0.99 assign (resid 47 and name HB2 ) (resid 47 and name HD1 ) 3.08 1.28 1.28 !peak 1236 #SUP 0.98 #QF 0.98 assign (resid 21 and name HB2 ) (resid 24 and name HG2 ) 3.30 1.50 1.50 !peak 1239 #SUP 1.00 assign (resid 28 and name HD1* ) (resid 57 and name HZ ) 3.53 1.73 1.73 !peak 1241 #SUP 0.99 #QF 0.99 assign (resid 32 and name HA ) (resid 32 and name HG12 ) 3.17 1.37 1.37 !peak 1245 #SUP 1.00 assign (resid 47 and name HN ) (resid 47 and name HB1 ) 3.04 1.24 1.24 !peak 1248 #SUP 1.00 assign (resid 19 and name HA ) (resid 63 and name HD1* ) 3.04 1.24 1.24 !peak 1250 #SUP 0.95 #QF 0.95 assign (resid 31 and name HA ) (resid 31 and name HG2 ) 3.05 1.25 1.25 !peak 1255 #SUP 0.98 #QF 0.33 assign (resid 3 and name HG2* ) (resid 7 and name HG1 ) 3.33 1.53 1.53 !peak 1257 #SUP 0.91 #QF 0.91 assign (resid 43 and name HA ) (resid 43 and name HG11 ) 3.04 1.24 1.24 !peak 1259 #SUP 0.99 #QF 0.99 assign (resid 19 and name HN ) (resid 19 and name HB ) 3.04 1.24 1.24 !peak 1268 #SUP 0.86 #QF 0.86 assign (resid 46 and name HN ) (resid 46 and name HD2* ) 3.18 1.38 1.38 !peak 1269 #SUP 0.94 #QF 0.94 assign (resid 25 and name HA ) (resid 28 and name HB1 ) 3.04 1.24 1.24 !peak 1271 #SUP 0.96 #QF 0.96 assign (resid 4 and name HA ) (resid 8 and name HG ) 4.06 2.26 2.26 !peak 1273 #SUP 0.93 #QF 0.86 assign (resid 8 and name HA ) (resid 8 and name HG ) 3.05 1.25 1.25 !peak 1281 #SUP 0.99 #QF 0.99 assign (resid 54 and name HB2 ) (resid 55 and name HN ) 3.35 1.55 1.55 !peak 1283 #SUP 0.95 #QF 0.95 assign (resid 58 and name HA ) (resid 58 and name HG2 ) 3.23 1.43 1.43 !peak 1284 #SUP 0.99 #QF 0.99 assign (resid 63 and name HN ) (resid 63 and name HG2* ) 3.19 1.39 1.39 !peak 1287 #SUP 0.95 #QF 0.95 assign (resid 43 and name HA ) (resid 43 and name HD1* ) 3.19 1.39 1.39 !peak 1289 #SUP 1.00 assign (resid 21 and name HB1 ) (resid 24 and name HG2 ) 3.07 1.27 1.27 !peak 1290 #SUP 1.00 assign (resid 43 and name HD1* ) (resid 68 and name HB1 ) 3.60 1.80 1.80 !peak 1297 #SUP 0.70 #QF 0.70 assign (resid 50 and name HA ) (resid 50 and name HG2 ) 3.06 1.26 1.26 !peak 1300 #SUP 0.99 #QF 0.99 assign (resid 16 and name HN ) (resid 16 and name HB1 ) 3.06 1.26 1.26 !peak 1306 #SUP 1.00 assign (resid 7 and name HN ) (resid 7 and name HG2 ) 3.06 1.26 1.26 !peak 1311 #SUP 1.00 assign (resid 28 and name HA ) (resid 31 and name HB1 ) 3.06 1.26 1.26 !peak 1315 #SUP 0.92 #QF 0.92 assign (resid 48 and name HB2 ) (resid 49 and name HN ) 3.33 1.53 1.53 !peak 1317 #SUP 0.99 #QF 0.99 assign (resid 31 and name HB2 ) (resid 31 and name HD1 ) 3.06 1.26 1.26 !peak 1321 #SUP 0.92 #QF 0.92 assign (resid 63 and name HA ) (resid 66 and name HB2 ) 3.07 1.27 1.27 !peak 1323 #SUP 0.97 #QF 0.97 assign (resid 31 and name HB2 ) (resid 31 and name HD2 ) 3.07 1.27 1.27 !peak 1324 #SUP 0.69 #QF 0.69 assign (resid 16 and name HA ) (resid 22 and name HD* ) 3.07 1.27 1.27 !peak 1325 #SUP 0.98 #QF 0.98 assign (resid 61 and name HA ) (resid 61 and name HG12 ) 3.07 1.27 1.27 !peak 1326 #SUP 0.99 #QF 0.99 assign (resid 3 and name HA ) (resid 6 and name HN ) 3.07 1.27 1.27 !peak 1329 #SUP 0.88 #QF 0.88 assign (resid 14 and name HA ) (resid 14 and name HG1 ) 3.34 1.54 1.54 !peak 1330 #SUP 0.99 #QF 0.98 assign (resid 48 and name HG2 ) (resid 49 and name HA ) 3.56 1.76 1.76 !peak 1330 #SUP 0.99 #QF 0.98 assign (resid 24 and name HN ) (resid 24 and name HB1 ) 3.07 1.27 1.27 !peak 1335 #SUP 1.00 assign (resid 69 and name HA ) (resid 69 and name HG2 ) 3.07 1.27 1.27 !peak 1341 #SUP 0.99 #QF 0.99 assign (resid 13 and name HG11 ) (resid 16 and name HB2 ) 4.01 2.21 2.20 !peak 1343 #SUP 0.82 #QF 0.28 assign (resid 7 and name HD2 ) (resid 39 and name HB1 ) 4.25 2.45 2.45 !peak 1343 #SUP 0.82 #QF 0.28 assign (resid 47 and name HA ) (resid 47 and name HG2 ) 3.07 1.27 1.27 !peak 1345 #SUP 1.00 assign (resid 32 and name HA ) (resid 32 and name HD1* ) 3.34 1.54 1.54 !peak 1346 #SUP 0.99 #QF 0.99 assign (resid 49 and name HN ) (resid 49 and name HG1 ) 3.21 1.41 1.41 !peak 1350 #SUP 0.96 #QF 0.96 assign (resid 54 and name HB1 ) (resid 55 and name HN ) 3.35 1.55 1.55 !peak 1351 #SUP 0.98 #QF 0.98 assign (resid 51 and name HG1 ) (resid 51 and name HE* ) 3.11 1.31 1.31 !peak 1352 #SUP 0.95 #QF 0.95 assign (resid 47 and name HB2 ) (resid 47 and name HD2 ) 3.08 1.28 1.28 !peak 1357 #SUP 0.98 #QF 0.98 assign (resid 28 and name HG ) (resid 29 and name HG2* ) 3.08 1.28 1.28 !peak 1362 #SUP 0.41 #QF 0.41 assign (resid 28 and name HA ) (resid 28 and name HG ) 3.08 1.28 1.28 !peak 1364 #SUP 0.97 #QF 0.97 assign (resid 55 and name HB1 ) (resid 56 and name HA ) 3.08 1.28 1.28 !peak 1367 #SUP 0.99 #QF 0.99 assign (resid 66 and name HB1 ) (resid 67 and name HN ) 3.08 1.28 1.28 !peak 1371 #SUP 0.97 #QF 0.97 assign (resid 63 and name HN ) (resid 63 and name HG12 ) 3.09 1.29 1.28 !peak 1372 #SUP 1.00 assign (resid 32 and name HD1* ) (resid 46 and name HA ) 3.09 1.29 1.28 !peak 1375 #SUP 0.91 #QF 0.91 assign (resid 46 and name HN ) (resid 46 and name HD1* ) 3.18 1.38 1.38 !peak 1378 #SUP 1.00 assign (resid 46 and name HB2 ) (resid 65 and name HD1* ) 3.09 1.29 1.28 !peak 1380 #SUP 0.98 #QF 0.98 assign (resid 18 and name HB2 ) (resid 63 and name HD1* ) 3.36 1.56 1.56 !peak 1388 #SUP 0.99 #QF 0.99 assign (resid 60 and name HA ) (resid 63 and name HB ) 3.09 1.29 1.29 !peak 1393 #SUP 0.86 #QF 0.86 assign (resid 28 and name HA ) (resid 32 and name HG2* ) 3.59 1.79 1.79 !peak 1394 #SUP 1.00 #QF 0.98 assign (resid 20 and name HB2 ) (resid 21 and name HN ) 3.37 1.57 1.57 !peak 1395 #SUP 1.00 assign (resid 61 and name HA ) (resid 61 and name HG11 ) 3.10 1.30 1.30 !peak 1400 #SUP 0.99 #QF 0.99 assign (resid 11 and name HB* ) (resid 15 and name HG2* ) 3.32 1.52 1.51 !peak 1410 #SUP 0.99 #QF 0.86 assign (resid 15 and name HG2* ) (resid 64 and name HG ) 3.57 1.77 1.77 !peak 1410 #SUP 0.99 #QF 0.86 assign (resid 10 and name HG2 ) (resid 10 and name HE* ) 3.10 1.30 1.30 !peak 1417 #SUP 0.99 #QF 0.99 assign (resid 13 and name HG2* ) (resid 14 and name HA ) 3.10 1.30 1.30 !peak 1418 #SUP 0.95 #QF 0.95 assign (resid 10 and name HN ) (resid 10 and name HG2 ) 3.56 1.76 1.76 !peak 1420 #SUP 1.00 assign (resid 25 and name HD1* ) (resid 60 and name HB1 ) 3.60 1.80 1.80 !peak 1421 #SUP 0.99 #QF 0.84 assign (resid 28 and name HD1* ) (resid 61 and name HG12 ) 3.83 2.03 2.03 !peak 1423 #SUP 0.92 #QF 0.92 assign (resid 46 and name HA ) (resid 61 and name HG2* ) 3.10 1.30 1.30 !peak 1424 #SUP 0.85 #QF 0.85 assign (resid 57 and name HE* ) (resid 61 and name HD1* ) 3.11 1.31 1.31 !peak 1429 #SUP 0.97 #QF 0.97 assign (resid 19 and name HB ) (resid 59 and name HG2* ) 3.99 2.19 2.19 !peak 1430 #SUP 0.78 #QF 0.22 assign (resid 59 and name HG2* ) (resid 63 and name HB ) 4.12 2.32 2.32 !peak 1430 #SUP 0.78 #QF 0.22 assign (resid 32 and name HD1* ) (resid 45 and name HB ) 3.52 1.72 1.72 !peak 1431 #SUP 0.94 #QF 0.94 assign (resid 51 and name HG2 ) (resid 51 and name HE* ) 3.11 1.31 1.31 !peak 1433 #SUP 0.98 #QF 0.98 assign (resid 29 and name HG2* ) (resid 30 and name HN ) 3.25 1.45 1.45 !peak 1435 #SUP 0.99 #QF 0.99 assign (resid 23 and name HA ) (resid 26 and name HB1 ) 3.11 1.31 1.31 !peak 1438 #SUP 0.97 #QF 0.97 assign (resid 45 and name HG1* ) (resid 46 and name HN ) 3.11 1.31 1.31 !peak 1439 #SUP 1.00 assign (resid 28 and name HN ) (resid 28 and name HD2* ) 3.39 1.59 1.59 !peak 1440 #SUP 0.99 #QF 0.99 assign (resid 62 and name HG2 ) (resid 63 and name HG12 ) 3.89 2.09 2.09 !peak 1441 #SUP 1.00 #QF 0.95 assign (resid 62 and name HG1 ) (resid 63 and name HG12 ) 4.09 2.29 2.29 !peak 1441 #SUP 1.00 #QF 0.95 assign (resid 9 and name HB2 ) (resid 10 and name HN ) 3.11 1.31 1.31 !peak 1444 #SUP 0.96 #QF 0.96 assign (resid 11 and name HA ) (resid 14 and name HB2 ) 3.11 1.31 1.31 !peak 1446 #SUP 0.98 #QF 0.98 assign (resid 28 and name HD2* ) (resid 49 and name HG2 ) 3.64 1.84 1.84 !peak 1451 #SUP 1.00 assign (resid 9 and name HA ) (resid 13 and name HD1* ) 3.40 1.60 1.60 !peak 1452 #SUP 0.90 #QF 0.34 assign (resid 9 and name HA ) (resid 29 and name HG1* ) 3.50 1.70 1.70 !peak 1452 #SUP 0.90 #QF 0.34 assign (resid 25 and name HA ) (resid 57 and name HE* ) 3.12 1.32 1.32 !peak 1456 #SUP 0.99 #QF 0.99 assign (resid 63 and name HA ) (resid 63 and name HD1* ) 3.12 1.32 1.32 !peak 1457 #SUP 0.99 #QF 0.99 assign (resid 44 and name HA ) (resid 47 and name HB2 ) 3.12 1.32 1.32 !peak 1458 #SUP 0.97 #QF 0.97 assign (resid 4 and name HG1* ) (resid 39 and name HN ) 3.44 1.64 1.64 !peak 1465 #SUP 0.99 #QF 0.99 assign (resid 11 and name HB* ) (resid 67 and name HE* ) 3.12 1.32 1.32 !peak 1467 #SUP 1.00 assign (resid 28 and name HB1 ) (resid 28 and name HD2* ) 3.19 1.39 1.39 !peak 1468 #SUP 1.00 #QF 0.98 assign (resid 28 and name HB1 ) (resid 29 and name HG2* ) 3.53 1.73 1.73 !peak 1468 #SUP 1.00 #QF 0.98 assign (resid 9 and name HA ) (resid 12 and name HN ) 3.12 1.32 1.32 !peak 1469 #SUP 0.96 #QF 0.96 assign (resid 11 and name HA ) (resid 67 and name HE* ) 3.12 1.32 1.32 !peak 1470 #SUP 0.99 #QF 0.99 assign (resid 7 and name HB1 ) (resid 8 and name HN ) 3.13 1.33 1.33 !peak 1471 #SUP 0.92 #QF 0.92 assign (resid 44 and name HA ) (resid 47 and name HD1 ) 3.36 1.56 1.56 !peak 1476 #SUP 1.00 assign (resid 26 and name HE* ) (resid 27 and name HA ) 3.13 1.33 1.33 !peak 1480 #SUP 0.69 #QF 0.69 assign (resid 61 and name HN ) (resid 62 and name HG2 ) 3.26 1.46 1.46 !peak 1481 #SUP 0.69 #QF 0.69 assign (resid 21 and name HB1 ) (resid 24 and name HB1 ) 3.13 1.33 1.33 !peak 1487 #SUP 0.95 #QF 0.95 assign (resid 41 and name HA ) (resid 44 and name HG2* ) 3.41 1.61 1.61 !peak 1488 #SUP 0.92 #QF 0.92 assign (resid 25 and name HA ) (resid 28 and name HN ) 3.13 1.33 1.33 !peak 1489 #SUP 0.91 #QF 0.91 assign (resid 58 and name HB1 ) (resid 58 and name HE1 ) 3.22 1.42 1.42 !peak 1490 #SUP 1.00 #QF 0.95 assign (resid 15 and name HG2* ) (resid 16 and name HA ) 3.39 1.59 1.59 !peak 1496 #SUP 0.50 #QF 0.37 assign (resid 24 and name HB2 ) (resid 25 and name HB2 ) 3.27 1.47 1.47 !peak 1501 #SUP 0.80 #QF 0.80 assign (resid 45 and name HA ) (resid 48 and name HB1 ) 3.14 1.34 1.34 !peak 1504 #SUP 0.98 #QF 0.98 assign (resid 43 and name HD1* ) (resid 69 and name HG1 ) 3.41 1.61 1.61 !peak 1505 #SUP 0.60 #QF 0.60 assign (resid 38 and name HN ) (resid 41 and name HB1 ) 3.42 1.62 1.62 !peak 1506 #SUP 0.97 #QF 0.97 assign (resid 62 and name HB1 ) (resid 62 and name HD1 ) 3.14 1.34 1.34 !peak 1516 #SUP 0.97 #QF 0.97 assign (resid 15 and name HG2* ) (resid 64 and name HB1 ) 3.71 1.91 1.91 !peak 1517 #SUP 1.00 assign (resid 36 and name HG2* ) (resid 41 and name HB1 ) 3.43 1.63 1.63 !peak 1522 #SUP 0.66 #QF 0.66 assign (resid 59 and name HA ) (resid 62 and name HD2 ) 3.26 1.46 1.46 !peak 1523 #SUP 0.87 #QF 0.79 assign (resid 25 and name HD2* ) (resid 60 and name HB1 ) 3.60 1.80 1.80 !peak 1525 #SUP 0.98 #QF 0.98 assign (resid 58 and name HB1 ) (resid 58 and name HE2 ) 3.22 1.42 1.42 !peak 1528 #SUP 0.99 #QF 0.95 assign (resid 62 and name HG2 ) (resid 63 and name HG11 ) 3.26 1.46 1.46 !peak 1530 #SUP 0.77 #QF 0.52 assign (resid 62 and name HG1 ) (resid 63 and name HG11 ) 3.50 1.70 1.70 !peak 1530 #SUP 0.77 #QF 0.52 assign (resid 43 and name HN ) (resid 43 and name HG11 ) 3.15 1.35 1.35 !peak 1531 #SUP 0.89 #QF 0.89 assign (resid 30 and name HB2 ) (resid 31 and name HN ) 3.15 1.35 1.35 !peak 1534 #SUP 0.99 #QF 0.99 assign (resid 21 and name HN ) (resid 21 and name HB1 ) 3.29 1.49 1.49 !peak 1538 #SUP 1.00 assign (resid 16 and name HA ) (resid 16 and name HG2 ) 3.15 1.35 1.35 !peak 1539 #SUP 1.00 assign (resid 47 and name HB2 ) (resid 51 and name HE* ) 3.44 1.64 1.64 !peak 1542 #SUP 0.23 #QF 0.23 assign (resid 47 and name HG2 ) (resid 65 and name HD2* ) 3.44 1.64 1.64 !peak 1543 #SUP 0.99 #QF 0.99 assign (resid 14 and name HB2 ) (resid 15 and name HG1* ) 3.15 1.35 1.35 !peak 1544 #SUP 0.95 #QF 0.95 assign (resid 5 and name HG1 ) (resid 9 and name HG2 ) 3.62 1.82 1.82 !peak 1549 #SUP 0.94 #QF 0.94 assign (resid 7 and name HD2 ) (resid 39 and name HA ) 3.42 1.62 1.62 !peak 1554 #SUP 0.97 #QF 0.33 assign (resid 14 and name HG1 ) (resid 67 and name HZ ) 3.16 1.36 1.36 !peak 1558 #SUP 0.76 #QF 0.76 assign (resid 69 and name HN ) (resid 69 and name HG1 ) 3.17 1.37 1.37 !peak 1560 #SUP 0.99 #QF 0.99 assign (resid 51 and name HA ) (resid 51 and name HD* ) 3.68 1.88 1.88 !peak 1563 #SUP 1.00 #QF 0.77 assign (resid 18 and name HD* ) (resid 63 and name HG2* ) 3.59 1.79 1.79 !peak 1565 #SUP 0.90 #QF 0.90 assign (resid 67 and name HA ) (resid 68 and name HA ) 3.74 1.94 1.94 !peak 1568 #SUP 0.97 #QF 0.97 assign (resid 62 and name HB1 ) (resid 62 and name HD2 ) 3.17 1.37 1.37 !peak 1574 #SUP 0.98 #QF 0.98 assign (resid 21 and name HB1 ) (resid 24 and name HB2 ) 3.18 1.38 1.38 !peak 1576 #SUP 0.99 #QF 0.99 assign (resid 26 and name HB1 ) (resid 27 and name HA ) 3.57 1.77 1.77 !peak 1582 #SUP 1.00 assign (resid 19 and name HG2* ) (resid 20 and name HN ) 3.18 1.38 1.38 !peak 1587 #SUP 0.95 #QF 0.95 assign (resid 3 and name HN ) (resid 3 and name HG2* ) 3.18 1.38 1.38 !peak 1588 #SUP 0.99 #QF 0.99 assign (resid 5 and name HA ) (resid 8 and name HN ) 3.27 1.47 1.47 !peak 1589 #SUP 0.98 #QF 0.97 assign (resid 61 and name HA ) (resid 61 and name HD1* ) 3.18 1.38 1.38 !peak 1593 #SUP 1.00 assign (resid 54 and name HA ) (resid 58 and name HE1 ) 3.61 1.81 1.81 !peak 1604 #SUP 0.91 #QF 0.91 assign (resid 48 and name HB2 ) (resid 51 and name HE* ) 3.80 2.00 2.00 !peak 1605 #SUP 0.83 #QF 0.62 assign (resid 50 and name HB1 ) (resid 51 and name HE* ) 4.03 2.23 2.23 !peak 1605 #SUP 0.83 #QF 0.62 assign (resid 59 and name HN ) (resid 59 and name HG2* ) 3.19 1.39 1.39 !peak 1606 #SUP 1.00 assign (resid 39 and name HA ) (resid 39 and name HG ) 3.19 1.39 1.39 !peak 1608 #SUP 0.96 #QF 0.96 assign (resid 18 and name HB1 ) (resid 63 and name HD1* ) 3.19 1.39 1.39 !peak 1614 #SUP 0.97 #QF 0.97 assign (resid 43 and name HG2* ) (resid 47 and name HD1 ) 3.37 1.57 1.57 !peak 1615 #SUP 1.00 assign (resid 61 and name HA ) (resid 64 and name HB2 ) 3.40 1.60 1.60 !peak 1616 #SUP 0.99 #QF 0.99 assign (resid 12 and name HD1* ) (resid 25 and name HG ) 3.84 2.04 2.04 !peak 1620 #SUP 0.91 #QF 0.54 assign (resid 21 and name HA ) (resid 23 and name HN ) 3.20 1.40 1.40 !peak 1625 #SUP 0.51 #QF 0.51 assign (resid 6 and name HA ) (resid 9 and name HG1 ) 3.34 1.54 1.54 !peak 1631 #SUP 0.78 #QF 0.78 assign (resid 63 and name HA ) (resid 66 and name HB1 ) 3.20 1.40 1.40 !peak 1636 #SUP 0.99 #QF 0.99 assign (resid 50 and name HN ) (resid 61 and name HD1* ) 3.21 1.41 1.41 !peak 1642 #SUP 1.00 assign (resid 32 and name HD1* ) (resid 42 and name HA ) 3.69 1.89 1.89 !peak 1644 #SUP 0.97 #QF 0.73 assign (resid 47 and name HB1 ) (resid 47 and name HD1 ) 3.21 1.41 1.41 !peak 1646 #SUP 0.98 #QF 0.98 assign (resid 13 and name HG2* ) (resid 14 and name HG2 ) 3.56 1.76 1.76 !peak 1647 #SUP 0.94 #QF 0.89 assign (resid 28 and name HD1* ) (resid 49 and name HG1 ) 3.64 1.84 1.84 !peak 1647 #SUP 0.94 #QF 0.89 assign (resid 39 and name HB2 ) (resid 40 and name HN ) 3.21 1.41 1.41 !peak 1649 #SUP 0.99 #QF 0.99 assign (resid 62 and name HB2 ) (resid 63 and name HN ) 3.29 1.49 1.49 !peak 1650 #SUP 0.98 #QF 0.68 assign (resid 62 and name HB1 ) (resid 63 and name HN ) 3.62 1.82 1.82 !peak 1650 #SUP 0.98 #QF 0.68 assign (resid 59 and name HG2* ) (resid 63 and name HG12 ) 3.36 1.56 1.56 !peak 1652 #SUP 0.93 #QF 0.93 assign (resid 11 and name HA ) (resid 68 and name HD2* ) 3.78 1.98 1.98 !peak 1653 #SUP 0.99 #QF 0.98 assign (resid 36 and name HG2* ) (resid 37 and name HA ) 3.36 1.56 1.56 !peak 1657 #SUP 0.94 #QF 0.94 assign (resid 51 and name HB2 ) (resid 51 and name HE* ) 3.34 1.54 1.54 !peak 1662 #SUP 0.89 #QF 0.75 assign (resid 51 and name HB1 ) (resid 51 and name HE* ) 3.58 1.78 1.78 !peak 1662 #SUP 0.89 #QF 0.75 assign (resid 3 and name HG2* ) (resid 7 and name HD2 ) 3.96 2.16 2.16 !peak 1663 #SUP 0.80 #QF 0.57 assign (resid 65 and name HB1 ) (resid 66 and name HN ) 3.22 1.42 1.42 !peak 1665 #SUP 0.98 #QF 0.98 assign (resid 25 and name HD1* ) (resid 60 and name HB2 ) 3.60 1.80 1.80 !peak 1666 #SUP 0.95 #QF 0.78 assign (resid 25 and name HD2* ) (resid 60 and name HB2 ) 3.60 1.80 1.80 !peak 1666 #SUP 0.95 #QF 0.78 assign (resid 63 and name HG2* ) (resid 67 and name HB2 ) 3.85 2.05 2.05 !peak 1669 #SUP 0.99 #QF 0.94 assign (resid 29 and name HG1* ) (resid 33 and name HB1 ) 3.63 1.83 1.83 !peak 1671 #SUP 0.92 #QF 0.63 assign (resid 32 and name HD1* ) (resid 46 and name HN ) 3.22 1.42 1.42 !peak 1673 #SUP 0.95 #QF 0.95 assign (resid 27 and name HA ) (resid 30 and name HN ) 3.22 1.42 1.42 !peak 1674 #SUP 0.95 #QF 0.95 assign (resid 43 and name HG2* ) (resid 47 and name HG2 ) 3.22 1.42 1.42 !peak 1677 #SUP 0.92 #QF 0.92 assign (resid 19 and name HG2* ) (resid 22 and name HB1 ) 3.52 1.72 1.72 !peak 1678 #SUP 0.96 #QF 0.96 assign (resid 58 and name HA ) (resid 58 and name HG1 ) 3.23 1.43 1.43 !peak 1689 #SUP 0.99 #QF 0.99 assign (resid 19 and name HG1* ) (resid 63 and name HG11 ) 3.23 1.43 1.43 !peak 1690 #SUP 0.92 #QF 0.92 assign (resid 15 and name HA ) (resid 18 and name HE* ) 3.23 1.43 1.43 !peak 1691 #SUP 0.92 #QF 0.92 assign (resid 26 and name HB1 ) (resid 27 and name HB* ) 3.23 1.43 1.43 !peak 1692 #SUP 0.68 #QF 0.68 assign (resid 10 and name HB1 ) (resid 14 and name HG2 ) 3.53 1.73 1.73 !peak 1693 #SUP 0.42 #QF 0.42 assign (resid 12 and name HG ) (resid 15 and name HG2* ) 3.53 1.73 1.73 !peak 1694 #SUP 0.83 #QF 0.83 assign (resid 55 and name HA ) (resid 58 and name HB1 ) 3.23 1.43 1.43 !peak 1695 #SUP 0.71 #QF 0.71 assign (resid 11 and name HA ) (resid 14 and name HB1 ) 3.53 1.73 1.73 !peak 1698 #SUP 1.00 assign (resid 22 and name HE* ) (resid 26 and name HD2 ) 3.49 1.69 1.69 !peak 1700 #SUP 0.95 #QF 0.73 assign (resid 54 and name HA ) (resid 58 and name HE2 ) 3.61 1.81 1.81 !peak 1701 #SUP 0.93 #QF 0.93 assign (resid 12 and name HD2* ) (resid 26 and name HB1 ) 3.83 2.03 2.03 !peak 1703 #SUP 0.99 #QF 0.99 assign (resid 25 and name HA ) (resid 25 and name HG ) 3.24 1.44 1.44 !peak 1704 #SUP 0.99 #QF 0.99 assign (resid 45 and name HA ) (resid 48 and name HG1 ) 3.53 1.73 1.73 !peak 1710 #SUP 0.98 #QF 0.98 assign (resid 16 and name HA ) (resid 22 and name HE* ) 3.25 1.45 1.45 !peak 1712 #SUP 0.98 #QF 0.98 assign (resid 3 and name HG1* ) (resid 7 and name HE* ) 3.25 1.45 1.45 !peak 1718 #SUP 0.94 #QF 0.94 assign (resid 28 and name HD2* ) (resid 61 and name HD1* ) 3.54 1.74 1.74 !peak 1719 #SUP 1.00 assign (resid 64 and name HA ) (resid 67 and name HB1 ) 3.25 1.45 1.45 !peak 1722 #SUP 0.98 #QF 0.98 assign (resid 4 and name HA ) (resid 7 and name HB1 ) 3.55 1.75 1.74 !peak 1725 #SUP 0.93 #QF 0.93 assign (resid 29 and name HA ) (resid 32 and name HG11 ) 3.25 1.45 1.45 !peak 1726 #SUP 1.00 assign (resid 65 and name HN ) (resid 65 and name HD2* ) 3.42 1.62 1.62 !peak 1727 #SUP 0.98 #QF 0.98 assign (resid 28 and name HB2 ) (resid 29 and name HN ) 3.25 1.45 1.45 !peak 1728 #SUP 0.89 #QF 0.89 assign (resid 43 and name HG2* ) (resid 47 and name HB2 ) 3.69 1.89 1.89 !peak 1729 #SUP 0.99 #QF 0.99 assign (resid 28 and name HD1* ) (resid 57 and name HE* ) 3.39 1.59 1.59 !peak 1730 #SUP 1.00 assign (resid 23 and name HA ) (resid 26 and name HD1 ) 3.25 1.45 1.45 !peak 1732 #SUP 0.96 #QF 0.96 assign (resid 43 and name HG2* ) (resid 44 and name HA ) 3.26 1.46 1.46 !peak 1733 #SUP 1.00 assign (resid 10 and name HN ) (resid 10 and name HG1 ) 3.56 1.76 1.76 !peak 1736 #SUP 0.98 #QF 0.98 assign (resid 64 and name HN ) (resid 64 and name HD2* ) 3.41 1.61 1.61 !peak 1738 #SUP 1.00 assign (resid 61 and name HN ) (resid 62 and name HD1 ) 3.41 1.61 1.61 !peak 1741 #SUP 0.65 #QF 0.65 assign (resid 28 and name HA ) (resid 31 and name HD2 ) 3.26 1.46 1.46 !peak 1744 #SUP 0.93 #QF 0.93 assign (resid 11 and name HB* ) (resid 12 and name HG ) 3.96 2.16 2.16 !peak 1747 #SUP 0.97 #QF 0.92 assign (resid 7 and name HE* ) (resid 39 and name HD2* ) 3.41 1.61 1.61 !peak 1752 #SUP 0.94 #QF 0.94 assign (resid 56 and name HG2 ) (resid 57 and name HB2 ) 3.42 1.62 1.62 !peak 1755 #SUP 0.37 #QF 0.37 assign (resid 60 and name HB2 ) (resid 61 and name HN ) 3.34 1.54 1.54 !peak 1757 #SUP 0.99 #QF 0.99 assign (resid 8 and name HB2 ) (resid 29 and name HG2* ) 3.37 1.57 1.57 !peak 1761 #SUP 0.97 #QF 0.96 assign (resid 11 and name HB* ) (resid 12 and name HA ) 3.27 1.47 1.47 !peak 1764 #SUP 0.96 #QF 0.96 assign (resid 65 and name HN ) (resid 65 and name HD1* ) 3.42 1.62 1.62 !peak 1769 #SUP 1.00 assign (resid 4 and name HB ) (resid 38 and name HA ) 3.27 1.47 1.47 !peak 1770 #SUP 0.68 #QF 0.68 assign (resid 50 and name HG1 ) (resid 58 and name HG1 ) 3.56 1.76 1.76 !peak 1771 #SUP 0.98 #QF 0.98 assign (resid 25 and name HN ) (resid 25 and name HD2* ) 3.48 1.68 1.68 !peak 1772 #SUP 0.99 #QF 0.99 assign (resid 43 and name HA ) (resid 46 and name HB2 ) 3.28 1.48 1.48 !peak 1774 #SUP 0.99 #QF 0.99 assign (resid 5 and name HE* ) (resid 9 and name HG2 ) 3.40 1.60 1.60 !peak 1777 #SUP 0.72 #QF 0.72 assign (resid 46 and name HA ) (resid 49 and name HG1 ) 3.43 1.63 1.63 !peak 1780 #SUP 0.78 #QF 0.78 assign (resid 62 and name HA ) (resid 62 and name HD2 ) 3.29 1.49 1.49 !peak 1782 #SUP 0.70 #QF 0.70 assign (resid 52 and name HB2 ) (resid 53 and name HN ) 3.65 1.85 1.85 !peak 1783 #SUP 0.99 #QF 0.99 assign (resid 59 and name HA ) (resid 62 and name HD1 ) 3.29 1.49 1.49 !peak 1787 #SUP 0.81 #QF 0.81 assign (resid 50 and name HB2 ) (resid 51 and name HN ) 3.29 1.49 1.49 !peak 1788 #SUP 1.00 assign (resid 63 and name HA ) (resid 66 and name HN ) 3.29 1.49 1.49 !peak 1789 #SUP 0.95 #QF 0.95 assign (resid 43 and name HG2* ) (resid 47 and name HN ) 3.29 1.49 1.49 !peak 1792 #SUP 0.75 #QF 0.75 assign (resid 22 and name HE* ) (resid 26 and name HE* ) 3.59 1.79 1.79 !peak 1795 #SUP 0.98 #QF 0.98 assign (resid 41 and name HN ) (resid 42 and name HB* ) 3.30 1.50 1.50 !peak 1799 #SUP 0.96 #QF 0.96 assign (resid 22 and name HA ) (resid 25 and name HB2 ) 3.30 1.50 1.50 !peak 1803 #SUP 0.98 #QF 0.98 assign (resid 16 and name HG1 ) (resid 17 and name HD1 ) 3.62 1.82 1.82 !peak 1804 #SUP 0.99 #QF 0.83 assign (resid 40 and name HN ) (resid 43 and name HD1* ) 3.75 1.95 1.95 !peak 1806 #SUP 1.00 assign (resid 19 and name HG1* ) (resid 60 and name HB1 ) 3.38 1.58 1.58 !peak 1809 #SUP 0.92 #QF 0.92 assign (resid 50 and name HA ) (resid 58 and name HA ) 3.30 1.50 1.50 !peak 1812 #SUP 0.97 #QF 0.97 assign (resid 9 and name HB2 ) (resid 13 and name HD1* ) 3.38 1.58 1.58 !peak 1813 #SUP 0.89 #QF 0.89 assign (resid 3 and name HG1* ) (resid 4 and name HB ) 3.31 1.51 1.51 !peak 1816 #SUP 0.66 #QF 0.66 assign (resid 49 and name HA ) (resid 52 and name HE* ) 3.31 1.51 1.51 !peak 1819 #SUP 0.99 #QF 0.99 assign (resid 21 and name HB1 ) (resid 57 and name HD* ) 3.31 1.51 1.51 !peak 1823 #SUP 0.95 #QF 0.95 assign (resid 26 and name HA ) (resid 26 and name HD1 ) 3.61 1.81 1.81 !peak 1830 #SUP 1.00 assign (resid 48 and name HB2 ) (resid 51 and name HD* ) 3.72 1.92 1.92 !peak 1832 #SUP 0.99 #QF 0.94 assign (resid 48 and name HA ) (resid 51 and name HE* ) 3.32 1.52 1.51 !peak 1835 #SUP 0.97 #QF 0.97 assign (resid 21 and name HB2 ) (resid 57 and name HD* ) 3.32 1.52 1.51 !peak 1838 #SUP 0.97 #QF 0.97 assign (resid 62 and name HA ) (resid 66 and name HN ) 3.57 1.77 1.77 !peak 1840 #SUP 0.96 #QF 0.57 assign (resid 39 and name HB1 ) (resid 43 and name HD1* ) 3.62 1.82 1.82 !peak 1841 #SUP 0.95 #QF 0.95 assign (resid 61 and name HB ) (resid 62 and name HB1 ) 3.47 1.67 1.67 !peak 1843 #SUP 0.77 #QF 0.77 assign (resid 65 and name HA ) (resid 68 and name HB1 ) 3.62 1.82 1.82 !peak 1847 #SUP 0.86 #QF 0.86 assign (resid 23 and name HA ) (resid 26 and name HG* ) 3.93 2.13 2.13 !peak 1853 #SUP 1.00 #QF 0.95 assign (resid 17 and name HB2 ) (resid 18 and name HN ) 3.32 1.52 1.52 !peak 1854 #SUP 0.99 #QF 0.99 assign (resid 2 and name HA ) (resid 4 and name HN ) 3.32 1.52 1.52 !peak 1855 #SUP 0.89 #QF 0.89 assign (resid 59 and name HG2* ) (resid 60 and name HA ) 3.33 1.53 1.53 !peak 1859 #SUP 0.98 #QF 0.98 assign (resid 44 and name HA ) (resid 47 and name HB1 ) 3.78 1.98 1.98 !peak 1861 #SUP 1.00 assign (resid 54 and name HA ) (resid 58 and name HD1 ) 3.56 1.76 1.76 !peak 1866 #SUP 0.91 #QF 0.91 assign (resid 51 and name HN ) (resid 51 and name HD* ) 3.33 1.53 1.53 !peak 1869 #SUP 0.90 #QF 0.90 assign (resid 18 and name HN ) (resid 63 and name HG2* ) 3.79 1.99 1.99 !peak 1870 #SUP 0.86 #QF 0.86 assign (resid 42 and name HB* ) (resid 46 and name HB2 ) 4.34 2.54 2.54 !peak 1871 #SUP 1.00 #QF 0.86 assign (resid 25 and name HB2 ) (resid 26 and name HN ) 3.33 1.53 1.53 !peak 1872 #SUP 0.86 #QF 0.86 assign (resid 6 and name HA ) (resid 9 and name HG2 ) 3.34 1.54 1.54 !peak 1874 #SUP 0.81 #QF 0.81 assign (resid 53 and name HA ) (resid 54 and name HA ) 3.64 1.84 1.84 !peak 1879 #SUP 0.94 #QF 0.94 assign (resid 28 and name HA ) (resid 28 and name HD1* ) 3.33 1.53 1.53 !peak 1880 #SUP 0.91 #QF 0.91 assign (resid 32 and name HG2* ) (resid 49 and name HG2 ) 3.57 1.77 1.77 !peak 1885 #SUP 0.77 #QF 0.77 assign (resid 22 and name HA ) (resid 25 and name HD1* ) 4.04 2.24 2.24 !peak 1897 #SUP 0.95 #QF 0.30 assign (resid 28 and name HN ) (resid 28 and name HD1* ) 3.39 1.59 1.59 !peak 1901 #SUP 0.99 #QF 0.99 assign (resid 20 and name HB1 ) (resid 21 and name HD* ) 3.34 1.54 1.54 !peak 1902 #SUP 0.98 #QF 0.98 assign (resid 7 and name HG1 ) (resid 68 and name HD2* ) 3.80 2.00 2.00 !peak 1903 #SUP 0.95 #QF 0.95 assign (resid 16 and name HD1 ) (resid 22 and name HE* ) 3.60 1.80 1.80 !peak 1906 #SUP 1.00 assign (resid 64 and name HN ) (resid 64 and name HD1* ) 3.41 1.61 1.61 !peak 1908 #SUP 1.00 assign (resid 4 and name HG2* ) (resid 8 and name HN ) 4.11 2.31 2.31 !peak 1911 #SUP 0.93 #QF 0.93 assign (resid 50 and name HA ) (resid 61 and name HB ) 3.36 1.56 1.56 !peak 1915 #SUP 0.98 #QF 0.98 assign (resid 28 and name HN ) (resid 29 and name HG2* ) 3.82 2.02 2.02 !peak 1918 #SUP 0.98 #QF 0.98 assign (resid 31 and name HN ) (resid 31 and name HG1 ) 3.66 1.86 1.86 !peak 1919 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 19 and name HN ) 3.46 1.66 1.66 !peak 1922 #SUP 0.90 #QF 0.86 assign (resid 15 and name HG2* ) (resid 67 and name HD* ) 3.76 1.96 1.96 !peak 1922 #SUP 0.90 #QF 0.86 assign (resid 14 and name HG2 ) (resid 67 and name HE* ) 3.67 1.87 1.87 !peak 1923 #SUP 0.56 #QF 0.56 assign (resid 63 and name HG2* ) (resid 64 and name HA ) 3.36 1.56 1.56 !peak 1925 #SUP 0.97 #QF 0.97 assign (resid 12 and name HG ) (resid 22 and name HE* ) 3.82 2.02 2.02 !peak 1926 #SUP 0.88 #QF 0.88 assign (resid 25 and name HD1* ) (resid 61 and name HA ) 3.36 1.56 1.56 !peak 1927 #SUP 0.80 #QF 0.80 assign (resid 12 and name HD2* ) (resid 22 and name HD* ) 4.05 2.25 2.25 !peak 1928 #SUP 0.96 #QF 0.96 assign (resid 11 and name HB* ) (resid 68 and name HB2 ) 3.96 2.16 2.16 !peak 1931 #SUP 0.98 #QF 0.97 assign (resid 44 and name HA ) (resid 47 and name HD2 ) 3.36 1.56 1.56 !peak 1936 #SUP 1.00 assign (resid 14 and name HB2 ) (resid 15 and name HG2* ) 3.37 1.57 1.57 !peak 1946 #SUP 0.69 #QF 0.69 assign (resid 50 and name HG2 ) (resid 58 and name HG1 ) 3.56 1.76 1.76 !peak 1948 #SUP 0.98 #QF 0.98 assign (resid 43 and name HG2* ) (resid 47 and name HD2 ) 3.37 1.57 1.57 !peak 1951 #SUP 1.00 assign (resid 51 and name HA ) (resid 51 and name HE* ) 4.28 2.48 2.48 !peak 1953 #SUP 0.83 #QF 0.55 assign (resid 42 and name HB* ) (resid 43 and name HA ) 3.37 1.57 1.57 !peak 1958 #SUP 0.99 #QF 0.99 assign (resid 46 and name HG ) (resid 61 and name HG2* ) 4.15 2.35 2.35 !peak 1960 #SUP 1.00 #QF 0.92 assign (resid 40 and name HG2 ) (resid 43 and name HD1* ) 4.35 2.55 2.55 !peak 1961 #SUP 0.78 #QF 0.47 assign (resid 40 and name HG1 ) (resid 43 and name HD1* ) 4.35 2.55 2.55 !peak 1961 #SUP 0.78 #QF 0.47 assign (resid 67 and name HD* ) (resid 68 and name HA ) 3.37 1.57 1.57 !peak 1963 #SUP 0.96 #QF 0.96 assign (resid 11 and name HA ) (resid 67 and name HD* ) 3.37 1.57 1.57 !peak 1964 #SUP 1.00 assign (resid 34 and name HB2 ) (resid 35 and name HN ) 3.79 1.99 1.99 !peak 1965 #SUP 0.96 #QF 0.82 assign (resid 34 and name HB1 ) (resid 35 and name HN ) 3.79 1.99 1.99 !peak 1965 #SUP 0.96 #QF 0.82 assign (resid 50 and name HA ) (resid 58 and name HG2 ) 3.60 1.80 1.80 !peak 1968 #SUP 0.94 #QF 0.84 assign (resid 29 and name HG1* ) (resid 30 and name HA ) 3.37 1.57 1.57 !peak 1970 #SUP 0.96 #QF 0.96 assign (resid 59 and name HG2* ) (resid 63 and name HN ) 3.53 1.73 1.73 !peak 1971 #SUP 1.00 assign (resid 10 and name HB2 ) (resid 10 and name HE* ) 3.58 1.78 1.78 !peak 1975 #SUP 0.99 #QF 0.95 assign (resid 10 and name HB1 ) (resid 10 and name HE* ) 3.76 1.96 1.96 !peak 1975 #SUP 0.99 #QF 0.95 assign (resid 12 and name HN ) (resid 15 and name HG2* ) 3.53 1.73 1.73 !peak 1980 #SUP 0.98 #QF 0.98 assign (resid 41 and name HB2 ) (resid 42 and name HB* ) 3.65 1.85 1.85 !peak 1981 #SUP 1.00 #QF 0.99 assign (resid 42 and name HB* ) (resid 45 and name HB ) 3.96 2.16 2.16 !peak 1981 #SUP 1.00 #QF 0.99 assign (resid 50 and name HN ) (resid 50 and name HG1 ) 3.56 1.76 1.76 !peak 1982 #SUP 0.99 #QF 0.99 assign (resid 9 and name HB1 ) (resid 13 and name HD1* ) 3.38 1.58 1.58 !peak 1984 #SUP 0.91 #QF 0.91 assign (resid 19 and name HG1* ) (resid 60 and name HB2 ) 3.38 1.58 1.58 !peak 1986 #SUP 0.72 #QF 0.72 assign (resid 10 and name HA ) (resid 13 and name HG2* ) 3.54 1.74 1.74 !peak 1990 #SUP 0.98 #QF 0.98 assign (resid 47 and name HA ) (resid 47 and name HD2 ) 3.80 2.00 2.00 !peak 1992 #SUP 0.95 #QF 0.95 assign (resid 15 and name HG1* ) (resid 16 and name HN ) 3.38 1.58 1.58 !peak 1993 #SUP 0.99 #QF 0.99 assign (resid 9 and name HG1 ) (resid 10 and name HN ) 3.69 1.89 1.89 !peak 1994 #SUP 0.95 #QF 0.95 assign (resid 28 and name HD2* ) (resid 57 and name HE* ) 3.39 1.59 1.59 !peak 2000 #SUP 1.00 assign (resid 14 and name HA ) (resid 16 and name HN ) 3.57 1.77 1.77 !peak 2001 #SUP 0.98 #QF 0.82 assign (resid 26 and name HA ) (resid 29 and name HG1* ) 3.39 1.59 1.59 !peak 2003 #SUP 0.95 #QF 0.95 assign (resid 4 and name HA ) (resid 7 and name HG1 ) 3.71 1.91 1.91 !peak 2008 #SUP 1.00 assign (resid 61 and name HA ) (resid 64 and name HB1 ) 3.40 1.60 1.60 !peak 2010 #SUP 0.95 #QF 0.95 assign (resid 15 and name HG2* ) (resid 64 and name HN ) 3.40 1.60 1.60 !peak 2011 #SUP 0.73 #QF 0.73 assign (resid 28 and name HG ) (resid 29 and name HA ) 3.40 1.60 1.60 !peak 2012 #SUP 0.99 #QF 0.99 assign (resid 5 and name HA ) (resid 8 and name HB1 ) 4.02 2.22 2.22 !peak 2013 #SUP 1.00 assign (resid 8 and name HB1 ) (resid 33 and name HB1 ) 4.35 2.55 2.55 !peak 2013 #SUP 1.00 assign (resid 11 and name HB* ) (resid 67 and name HB1 ) 3.40 1.60 1.60 !peak 2018 #SUP 1.00 assign (resid 13 and name HA ) (resid 16 and name HB1 ) 3.40 1.60 1.60 !peak 2020 #SUP 0.99 #QF 0.99 assign (resid 16 and name HB2 ) (resid 19 and name HG2* ) 3.74 1.94 1.94 !peak 2021 #SUP 0.98 #QF 0.71 assign (resid 19 and name HG2* ) (resid 25 and name HB1 ) 3.84 2.04 2.04 !peak 2021 #SUP 0.98 #QF 0.71 assign (resid 11 and name HA ) (resid 15 and name HG1* ) 3.40 1.60 1.60 !peak 2027 #SUP 0.83 #QF 0.83 assign (resid 14 and name HB1 ) (resid 67 and name HZ ) 3.56 1.76 1.76 !peak 2030 #SUP 0.66 #QF 0.66 assign (resid 10 and name HB1 ) (resid 11 and name HA ) 3.56 1.76 1.76 !peak 2032 #SUP 0.93 #QF 0.93 assign (resid 54 and name HA ) (resid 58 and name HD2 ) 3.56 1.76 1.76 !peak 2035 #SUP 0.98 #QF 0.98 assign (resid 3 and name HG2* ) (resid 6 and name HB1 ) 3.60 1.80 1.80 !peak 2036 #SUP 0.86 #QF 0.22 assign (resid 12 and name HD2* ) (resid 26 and name HB2 ) 3.63 1.83 1.83 !peak 2038 #SUP 1.00 assign (resid 43 and name HD1* ) (resid 69 and name HG2 ) 3.41 1.61 1.61 !peak 2041 #SUP 0.98 #QF 0.98 assign (resid 49 and name HA ) (resid 51 and name HB2 ) 3.88 2.08 2.08 !peak 2043 #SUP 0.85 #QF 0.85 assign (resid 50 and name HG1 ) (resid 61 and name HB ) 3.72 1.92 1.92 !peak 2044 #SUP 0.99 #QF 0.99 assign (resid 43 and name HD1* ) (resid 69 and name HA ) 3.41 1.61 1.61 !peak 2046 #SUP 0.95 #QF 0.95 assign (resid 13 and name HG2* ) (resid 15 and name HN ) 4.07 2.27 2.27 !peak 2048 #SUP 0.99 #QF 0.98 assign (resid 5 and name HB1 ) (resid 5 and name HE* ) 3.57 1.77 1.77 !peak 2054 #SUP 1.00 #QF 0.82 assign (resid 5 and name HB2 ) (resid 5 and name HE* ) 3.80 2.00 2.00 !peak 2054 #SUP 1.00 #QF 0.82 assign (resid 23 and name HA ) (resid 26 and name HE* ) 3.73 1.93 1.93 !peak 2055 #SUP 0.89 #QF 0.89 assign (resid 4 and name HG2* ) (resid 38 and name HA ) 3.57 1.77 1.77 !peak 2058 #SUP 0.95 #QF 0.95 assign (resid 2 and name HA ) (resid 3 and name HG1* ) 3.41 1.61 1.61 !peak 2059 #SUP 0.68 #QF 0.68 assign (resid 5 and name HA ) (resid 29 and name HG1* ) 3.41 1.61 1.61 !peak 2060 #SUP 0.94 #QF 0.94 assign (resid 28 and name HD2* ) (resid 29 and name HN ) 3.44 1.64 1.64 !peak 2061 #SUP 0.99 #QF 0.99 assign (resid 19 and name HG2* ) (resid 21 and name HN ) 3.89 2.09 2.09 !peak 2063 #SUP 0.87 #QF 0.87 assign (resid 13 and name HG12 ) (resid 16 and name HB2 ) 3.73 1.93 1.93 !peak 2072 #SUP 0.55 #QF 0.55 assign (resid 26 and name HB2 ) (resid 26 and name HE* ) 3.59 1.79 1.79 !peak 2075 #SUP 0.97 #QF 0.96 assign (resid 63 and name HD1* ) (resid 64 and name HN ) 3.58 1.78 1.78 !peak 2077 #SUP 0.99 #QF 0.99 assign (resid 11 and name HB* ) (resid 63 and name HG2* ) 4.35 2.55 2.55 !peak 2079 #SUP 0.96 #QF 0.37 assign (resid 13 and name HG2* ) (resid 14 and name HB2 ) 4.35 2.55 2.55 !peak 2079 #SUP 0.96 #QF 0.37 assign (resid 63 and name HG2* ) (resid 64 and name HG ) 4.35 2.55 2.55 !peak 2079 #SUP 0.96 #QF 0.37 assign (resid 11 and name HA ) (resid 14 and name HG1 ) 3.42 1.62 1.62 !peak 2080 #SUP 0.99 #QF 0.99 assign (resid 11 and name HB* ) (resid 68 and name HD1* ) 3.44 1.64 1.64 !peak 2081 #SUP 0.96 #QF 0.44 assign (resid 28 and name HA ) (resid 32 and name HN ) 3.42 1.62 1.62 !peak 2082 #SUP 0.61 #QF 0.61 assign (resid 30 and name HB1 ) (resid 31 and name HB1 ) 3.90 2.10 2.10 !peak 2083 #SUP 0.94 #QF 0.94 assign (resid 16 and name HG1 ) (resid 22 and name HD* ) 3.76 1.96 1.96 !peak 2084 #SUP 0.99 #QF 0.99 assign (resid 46 and name HA ) (resid 49 and name HG2 ) 3.43 1.63 1.63 !peak 2087 #SUP 1.00 assign (resid 28 and name HD1* ) (resid 49 and name HG2 ) 3.64 1.84 1.84 !peak 2090 #SUP 0.95 #QF 0.95 assign (resid 3 and name HA ) (resid 7 and name HN ) 4.06 2.26 2.26 !peak 2091 #SUP 0.98 #QF 0.98 assign (resid 60 and name HA ) (resid 63 and name HG11 ) 3.43 1.63 1.63 !peak 2092 #SUP 0.95 #QF 0.95 assign (resid 64 and name HA ) (resid 67 and name HB2 ) 3.43 1.63 1.63 !peak 2094 #SUP 0.99 #QF 0.99 assign (resid 15 and name HG1* ) (resid 67 and name HA ) 3.75 1.95 1.95 !peak 2095 #SUP 0.97 #QF 0.97 assign (resid 55 and name HB2 ) (resid 56 and name HG1 ) 4.06 2.26 2.26 !peak 2096 #SUP 0.97 #QF 0.97 assign (resid 11 and name HA ) (resid 14 and name HG2 ) 3.43 1.63 1.63 !peak 2098 #SUP 0.83 #QF 0.83 assign (resid 43 and name HA ) (resid 65 and name HD1* ) 3.53 1.73 1.73 !peak 2099 #SUP 0.76 #QF 0.68 assign (resid 43 and name HA ) (resid 68 and name HD1* ) 3.88 2.08 2.08 !peak 2099 #SUP 0.76 #QF 0.68 assign (resid 28 and name HD1* ) (resid 29 and name HN ) 3.44 1.64 1.64 !peak 2101 #SUP 0.92 #QF 0.92 assign (resid 19 and name HG2* ) (resid 60 and name HA ) 3.44 1.64 1.64 !peak 2104 #SUP 0.99 #QF 0.99 assign (resid 16 and name HD2 ) (resid 22 and name HE* ) 3.60 1.80 1.80 !peak 2107 #SUP 0.99 #QF 0.99 assign (resid 31 and name HD1 ) (resid 32 and name HD1* ) 3.91 2.11 2.11 !peak 2110 #SUP 0.93 #QF 0.93 assign (resid 28 and name HA ) (resid 31 and name HD1 ) 3.44 1.64 1.64 !peak 2115 #SUP 0.95 #QF 0.95 assign (resid 22 and name HD* ) (resid 23 and name HA ) 3.44 1.64 1.64 !peak 2118 #SUP 0.98 #QF 0.98 assign (resid 67 and name HA ) (resid 70 and name HA ) 3.76 1.96 1.96 !peak 2123 #SUP 0.92 #QF 0.92 assign (resid 8 and name HD1* ) (resid 29 and name HA ) 3.92 2.12 2.12 !peak 2128 #SUP 0.97 #QF 0.97 assign (resid 71 and name HB1 ) (resid 72 and name HD1 ) 3.65 1.85 1.85 !peak 2129 #SUP 0.96 #QF 0.96 assign (resid 24 and name HB2 ) (resid 25 and name HA ) 3.45 1.65 1.65 !peak 2130 #SUP 0.99 #QF 0.99 assign (resid 10 and name HA ) (resid 13 and name HG12 ) 3.92 2.12 2.12 !peak 2133 #SUP 0.95 #QF 0.95 assign (resid 2 and name HA ) (resid 3 and name HB ) 3.61 1.81 1.81 !peak 2134 #SUP 0.63 #QF 0.63 assign (resid 36 and name HG1* ) (resid 41 and name HA ) 3.45 1.65 1.65 !peak 2135 #SUP 0.89 #QF 0.89 assign (resid 4 and name HG1* ) (resid 8 and name HN ) 4.11 2.31 2.31 !peak 2138 #SUP 0.92 #QF 0.87 assign (resid 50 and name HG2 ) (resid 61 and name HD1* ) 3.48 1.68 1.68 !peak 2140 #SUP 0.98 #QF 0.29 assign (resid 32 and name HA ) (resid 35 and name HN ) 3.45 1.65 1.65 !peak 2141 #SUP 0.94 #QF 0.94 assign (resid 26 and name HG* ) (resid 27 and name HA ) 3.78 1.98 1.97 !peak 2149 #SUP 0.96 #QF 0.96 assign (resid 30 and name HA ) (resid 33 and name HA ) 4.09 2.29 2.29 !peak 2150 #SUP 0.88 #QF 0.88 assign (resid 44 and name HA ) (resid 47 and name HG1 ) 3.45 1.65 1.65 !peak 2153 #SUP 0.92 #QF 0.92 assign (resid 2 and name HB1 ) (resid 5 and name HN ) 3.51 1.71 1.71 !peak 2155 #SUP 0.87 #QF 0.87 assign (resid 12 and name HB2 ) (resid 22 and name HE* ) 3.61 1.81 1.81 !peak 2157 #SUP 0.96 #QF 0.96 assign (resid 14 and name HB2 ) (resid 67 and name HE* ) 3.46 1.66 1.66 !peak 2159 #SUP 0.40 #QF 0.40 assign (resid 61 and name HG2* ) (resid 62 and name HB1 ) 3.46 1.66 1.66 !peak 2160 #SUP 0.88 #QF 0.88 assign (resid 50 and name HG1 ) (resid 58 and name HG2 ) 3.56 1.76 1.76 !peak 2161 #SUP 0.98 #QF 0.98 assign (resid 3 and name HN ) (resid 7 and name HE* ) 3.78 1.98 1.98 !peak 2164 #SUP 0.93 #QF 0.93 assign (resid 9 and name HA ) (resid 29 and name HG2* ) 4.00 2.20 2.20 !peak 2167 #SUP 0.96 #QF 0.84 assign (resid 12 and name HA ) (resid 29 and name HG2* ) 4.22 2.42 2.42 !peak 2167 #SUP 0.96 #QF 0.84 assign (resid 16 and name HA ) (resid 16 and name HD1 ) 3.66 1.86 1.86 !peak 2168 #SUP 0.94 #QF 0.94 assign (resid 62 and name HA ) (resid 62 and name HD1 ) 3.78 1.98 1.98 !peak 2169 #SUP 0.83 #QF 0.83 assign (resid 31 and name HG2 ) (resid 32 and name HN ) 3.46 1.66 1.66 !peak 2172 #SUP 1.00 assign (resid 19 and name HG1* ) (resid 64 and name HN ) 3.46 1.66 1.66 !peak 2173 #SUP 0.47 #QF 0.47 assign (resid 26 and name HA ) (resid 27 and name HA ) 3.79 1.99 1.99 !peak 2178 #SUP 1.00 assign (resid 67 and name HE* ) (resid 68 and name HD2* ) 3.63 1.83 1.83 !peak 2181 #SUP 0.96 #QF 0.96 assign (resid 25 and name HN ) (resid 27 and name HB* ) 4.17 2.37 2.37 !peak 2184 #SUP 0.98 #QF 0.58 assign (resid 4 and name HB ) (resid 39 and name HA ) 3.47 1.67 1.67 !peak 2185 #SUP 0.55 #QF 0.55 assign (resid 26 and name HB2 ) (resid 27 and name HB* ) 3.79 1.99 1.99 !peak 2186 #SUP 0.43 #QF 0.43 assign (resid 11 and name HA ) (resid 14 and name HA ) 4.11 2.31 2.31 !peak 2187 #SUP 0.63 #QF 0.63 assign (resid 50 and name HG2 ) (resid 61 and name HB ) 3.72 1.92 1.92 !peak 2188 #SUP 0.98 #QF 0.98 assign (resid 56 and name HA ) (resid 59 and name HG2* ) 3.47 1.67 1.67 !peak 2190 #SUP 0.94 #QF 0.94 assign (resid 14 and name HB1 ) (resid 15 and name HA ) 3.63 1.83 1.83 !peak 2194 #SUP 0.76 #QF 0.76 assign (resid 15 and name HB ) (resid 18 and name HD* ) 3.48 1.68 1.68 !peak 2199 #SUP 0.99 #QF 0.99 assign (resid 46 and name HB1 ) (resid 65 and name HB1 ) 3.64 1.84 1.84 !peak 2206 #SUP 0.95 #QF 0.95 assign (resid 61 and name HG2* ) (resid 65 and name HN ) 3.48 1.68 1.68 !peak 2207 #SUP 0.97 #QF 0.97 assign (resid 20 and name HB2 ) (resid 21 and name HD* ) 3.96 2.16 2.16 !peak 2209 #SUP 0.97 #QF 0.97 assign (resid 8 and name HA ) (resid 11 and name HA ) 4.14 2.34 2.34 !peak 2216 #SUP 0.73 #QF 0.20 assign (resid 10 and name HA ) (resid 11 and name HA ) 4.28 2.48 2.48 !peak 2216 #SUP 0.73 #QF 0.20 assign (resid 21 and name HE* ) (resid 56 and name HG1 ) 3.48 1.68 1.68 !peak 2219 #SUP 0.97 #QF 0.97 assign (resid 10 and name HA ) (resid 14 and name HN ) 3.48 1.68 1.68 !peak 2221 #SUP 0.93 #QF 0.93 assign (resid 47 and name HA ) (resid 47 and name HD1 ) 3.80 2.00 2.00 !peak 2222 #SUP 1.00 assign (resid 21 and name HB2 ) (resid 24 and name HB2 ) 3.49 1.69 1.69 !peak 2227 #SUP 0.98 #QF 0.98 assign (resid 21 and name HE* ) (resid 56 and name HG2 ) 3.49 1.69 1.69 !peak 2228 #SUP 0.95 #QF 0.95 assign (resid 11 and name HB* ) (resid 67 and name HB2 ) 3.49 1.69 1.69 !peak 2229 #SUP 0.99 #QF 0.99 assign (resid 25 and name HB2 ) (resid 57 and name HE* ) 3.49 1.69 1.69 !peak 2231 #SUP 0.77 #QF 0.77 assign (resid 25 and name HA ) (resid 29 and name HN ) 3.49 1.69 1.69 !peak 2234 #SUP 0.99 #QF 0.99 assign (resid 19 and name HN ) (resid 63 and name HD1* ) 3.49 1.69 1.69 !peak 2239 #SUP 0.71 #QF 0.71 assign (resid 13 and name HB ) (resid 14 and name HG1 ) 4.26 2.46 2.46 !peak 2240 #SUP 1.00 #QF 0.58 assign (resid 43 and name HB ) (resid 44 and name HB ) 4.35 2.55 2.55 !peak 2240 #SUP 1.00 #QF 0.58 assign (resid 21 and name HB1 ) (resid 24 and name HG1 ) 3.49 1.69 1.69 !peak 2244 #SUP 0.96 #QF 0.96 assign (resid 46 and name HB1 ) (resid 65 and name HB2 ) 3.64 1.84 1.84 !peak 2246 #SUP 0.95 #QF 0.95 assign (resid 15 and name HG1* ) (resid 64 and name HN ) 3.98 2.18 2.18 !peak 2247 #SUP 0.63 #QF 0.63 assign (resid 26 and name HB1 ) (resid 26 and name HE* ) 3.50 1.70 1.70 !peak 2250 #SUP 0.99 #QF 0.99 assign (resid 28 and name HA ) (resid 32 and name HD1* ) 3.83 2.03 2.03 !peak 2252 #SUP 0.80 #QF 0.80 assign (resid 4 and name HA ) (resid 39 and name HB2 ) 3.54 1.74 1.74 !peak 2253 #SUP 1.00 #QF 0.99 assign (resid 15 and name HB ) (resid 18 and name HB1 ) 3.50 1.70 1.70 !peak 2261 #SUP 0.97 #QF 0.97 assign (resid 50 and name HB1 ) (resid 61 and name HB ) 4.35 2.55 2.55 !peak 2263 #SUP 1.00 #QF 0.27 assign (resid 64 and name HD1* ) (resid 65 and name HN ) 3.51 1.71 1.71 !peak 2267 #SUP 0.93 #QF 0.93 assign (resid 4 and name HB ) (resid 5 and name HA ) 4.16 2.36 2.36 !peak 2273 #SUP 0.59 #QF 0.59 assign (resid 23 and name HA ) (resid 27 and name HB* ) 4.00 2.20 2.20 !peak 2274 #SUP 0.83 #QF 0.83 assign (resid 3 and name HG2* ) (resid 4 and name HB ) 4.00 2.20 2.20 !peak 2277 #SUP 0.89 #QF 0.89 assign (resid 15 and name HG2* ) (resid 22 and name HD* ) 3.67 1.87 1.87 !peak 2278 #SUP 0.98 #QF 0.98 assign (resid 5 and name HG1 ) (resid 9 and name HG1 ) 3.62 1.82 1.82 !peak 2289 #SUP 0.97 #QF 0.91 assign (resid 31 and name HA ) (resid 33 and name HN ) 3.78 1.98 1.97 !peak 2291 #SUP 1.00 #QF 0.94 assign (resid 31 and name HG2 ) (resid 32 and name HG2* ) 3.52 1.72 1.72 !peak 2295 #SUP 0.51 #QF 0.51 assign (resid 3 and name HG2* ) (resid 7 and name HN ) 3.52 1.72 1.72 !peak 2302 #SUP 0.91 #QF 0.91 assign (resid 9 and name HG2 ) (resid 10 and name HN ) 3.69 1.89 1.89 !peak 2304 #SUP 0.94 #QF 0.94 assign (resid 27 and name HB* ) (resid 29 and name HN ) 3.69 1.89 1.89 !peak 2305 #SUP 0.84 #QF 0.84 assign (resid 28 and name HG ) (resid 32 and name HB ) 4.21 2.41 2.41 !peak 2308 #SUP 0.93 #QF 0.35 assign (resid 32 and name HB ) (resid 42 and name HB* ) 4.35 2.55 2.55 !peak 2308 #SUP 0.93 #QF 0.35 assign (resid 48 and name HG1 ) (resid 52 and name HE* ) 3.69 1.89 1.89 !peak 2312 #SUP 0.62 #QF 0.62 assign (resid 16 and name HB2 ) (resid 22 and name HB2 ) 3.98 2.18 2.18 !peak 2315 #SUP 0.99 #QF 0.97 assign (resid 24 and name HB1 ) (resid 27 and name HB* ) 3.78 1.98 1.97 !peak 2316 #SUP 0.67 #QF 0.49 assign (resid 27 and name HB* ) (resid 31 and name HB2 ) 3.94 2.14 2.14 !peak 2316 #SUP 0.67 #QF 0.49 assign (resid 12 and name HG ) (resid 26 and name HA ) 3.82 2.02 2.02 !peak 2317 #SUP 0.91 #QF 0.80 assign (resid 25 and name HB1 ) (resid 26 and name HA ) 3.96 2.16 2.16 !peak 2317 #SUP 0.91 #QF 0.80 assign (resid 28 and name HD2* ) (resid 57 and name HZ ) 3.53 1.73 1.73 !peak 2320 #SUP 0.99 #QF 0.99 assign (resid 42 and name HB* ) (resid 45 and name HN ) 3.69 1.89 1.89 !peak 2321 #SUP 0.69 #QF 0.69 assign (resid 67 and name HB1 ) (resid 68 and name HG ) 3.53 1.73 1.73 !peak 2322 #SUP 1.00 assign (resid 4 and name HG1* ) (resid 7 and name HE* ) 4.12 2.32 2.32 !peak 2325 #SUP 0.95 #QF 0.65 assign (resid 4 and name HG2* ) (resid 7 and name HE* ) 4.12 2.32 2.32 !peak 2325 #SUP 0.95 #QF 0.65 assign (resid 46 and name HA ) (resid 50 and name HN ) 3.53 1.73 1.73 !peak 2327 #SUP 0.91 #QF 0.91 assign (resid 27 and name HB* ) (resid 28 and name HA ) 3.53 1.73 1.73 !peak 2328 #SUP 0.92 #QF 0.92 assign (resid 47 and name HA ) (resid 61 and name HG2* ) 3.54 1.74 1.74 !peak 2331 #SUP 0.83 #QF 0.83 assign (resid 15 and name HG2* ) (resid 64 and name HB2 ) 3.71 1.91 1.91 !peak 2332 #SUP 0.98 #QF 0.98 assign (resid 15 and name HB ) (resid 63 and name HD1* ) 3.76 1.96 1.96 !peak 2333 #SUP 0.98 #QF 0.85 assign (resid 59 and name HG2* ) (resid 62 and name HN ) 4.03 2.23 2.23 !peak 2336 #SUP 0.91 #QF 0.91 assign (resid 50 and name HB2 ) (resid 58 and name HG1 ) 3.68 1.88 1.88 !peak 2337 #SUP 0.96 #QF 0.96 assign (resid 22 and name HA ) (resid 25 and name HD2* ) 4.04 2.24 2.24 !peak 2339 #SUP 0.99 #QF 0.99 assign (resid 42 and name HA ) (resid 46 and name HN ) 3.54 1.74 1.74 !peak 2340 #SUP 0.99 #QF 0.99 assign (resid 4 and name HN ) (resid 7 and name HE* ) 3.54 1.74 1.74 !peak 2341 #SUP 0.93 #QF 0.93 assign (resid 28 and name HD2* ) (resid 46 and name HA ) 3.71 1.91 1.91 !peak 2344 #SUP 0.98 #QF 0.98 assign (resid 13 and name HA ) (resid 14 and name HA ) 3.71 1.91 1.91 !peak 2346 #SUP 0.83 #QF 0.83 assign (resid 59 and name HG2* ) (resid 62 and name HG2 ) 3.80 2.00 2.00 !peak 2349 #SUP 0.99 #QF 0.40 assign (resid 59 and name HG2* ) (resid 62 and name HG1 ) 3.84 2.04 2.04 !peak 2349 #SUP 0.99 #QF 0.40 assign (resid 41 and name HA ) (resid 43 and name HN ) 3.55 1.75 1.74 !peak 2351 #SUP 0.92 #QF 0.92 assign (resid 15 and name HG2* ) (resid 19 and name HB ) 3.55 1.75 1.75 !peak 2364 #SUP 0.96 #QF 0.96 assign (resid 8 and name HD2* ) (resid 29 and name HA ) 3.92 2.12 2.12 !peak 2365 #SUP 0.97 #QF 0.97 assign (resid 27 and name HA ) (resid 31 and name HN ) 3.56 1.76 1.76 !peak 2367 #SUP 0.94 #QF 0.94 assign (resid 17 and name HB2 ) (resid 18 and name HD* ) 3.56 1.76 1.76 !peak 2370 #SUP 0.97 #QF 0.97 assign (resid 8 and name HB2 ) (resid 32 and name HD1* ) 4.16 2.36 2.36 !peak 2375 #SUP 0.92 #QF 0.23 assign (resid 31 and name HB1 ) (resid 32 and name HD1* ) 4.35 2.55 2.55 !peak 2375 #SUP 0.92 #QF 0.23 assign (resid 25 and name HB1 ) (resid 57 and name HE* ) 4.06 2.26 2.26 !peak 2378 #SUP 0.68 #QF 0.68 assign (resid 50 and name HB2 ) (resid 61 and name HD1* ) 3.56 1.76 1.76 !peak 2380 #SUP 0.97 #QF 0.97 assign (resid 42 and name HB* ) (resid 46 and name HN ) 3.73 1.93 1.93 !peak 2382 #SUP 0.87 #QF 0.87 assign (resid 21 and name HB2 ) (resid 57 and name HE* ) 4.23 2.43 2.43 !peak 2385 #SUP 0.98 #QF 0.98 assign (resid 48 and name HG1 ) (resid 49 and name HN ) 3.56 1.76 1.76 !peak 2387 #SUP 0.98 #QF 0.98 assign (resid 50 and name HG2 ) (resid 58 and name HG2 ) 3.56 1.76 1.76 !peak 2390 #SUP 0.97 #QF 0.97 assign (resid 51 and name HN ) (resid 61 and name HG2* ) 3.90 2.10 2.10 !peak 2392 #SUP 1.00 assign (resid 36 and name HB ) (resid 37 and name HA ) 3.73 1.93 1.93 !peak 2394 #SUP 0.93 #QF 0.93 assign (resid 66 and name HA ) (resid 70 and name HN ) 3.57 1.77 1.77 !peak 2395 #SUP 0.84 #QF 0.84 assign (resid 45 and name HA ) (resid 49 and name HN ) 3.57 1.77 1.77 !peak 2397 #SUP 0.98 #QF 0.98 assign (resid 14 and name HB1 ) (resid 15 and name HB ) 4.35 2.55 2.55 !peak 2400 #SUP 0.70 #QF 0.32 assign (resid 39 and name HG ) (resid 40 and name HN ) 3.74 1.94 1.94 !peak 2403 #SUP 0.93 #QF 0.93 assign (resid 31 and name HB1 ) (resid 32 and name HA ) 3.98 2.18 2.18 !peak 2409 #SUP 0.98 #QF 0.87 assign (resid 22 and name HA ) (resid 22 and name HE* ) 3.74 1.94 1.94 !peak 2413 #SUP 0.93 #QF 0.93 assign (resid 31 and name HG2 ) (resid 32 and name HA ) 3.57 1.77 1.77 !peak 2416 #SUP 0.98 #QF 0.98 assign (resid 57 and name HZ ) (resid 61 and name HD1* ) 3.75 1.95 1.95 !peak 2419 #SUP 0.99 #QF 0.99 assign (resid 29 and name HG1* ) (resid 33 and name HA ) 3.75 1.95 1.95 !peak 2424 #SUP 0.46 #QF 0.46 assign (resid 12 and name HD1* ) (resid 29 and name HN ) 3.65 1.85 1.85 !peak 2426 #SUP 0.79 #QF 0.79 assign (resid 46 and name HB2 ) (resid 65 and name HB2 ) 3.92 2.12 2.12 !peak 2428 #SUP 0.80 #QF 0.80 assign (resid 12 and name HG ) (resid 13 and name HN ) 3.75 1.95 1.95 !peak 2435 #SUP 0.88 #QF 0.88 assign (resid 18 and name HA ) (resid 63 and name HG2* ) 4.02 2.22 2.22 !peak 2439 #SUP 0.92 #QF 0.39 assign (resid 18 and name HA ) (resid 63 and name HD1* ) 4.19 2.39 2.39 !peak 2439 #SUP 0.92 #QF 0.39 assign (resid 29 and name HG1* ) (resid 34 and name HN ) 4.26 2.46 2.46 !peak 2440 #SUP 0.56 #QF 0.56 assign (resid 62 and name HN ) (resid 63 and name HB ) 3.92 2.12 2.12 !peak 2441 #SUP 0.83 #QF 0.83 assign (resid 61 and name HN ) (resid 62 and name HA ) 4.09 2.29 2.29 !peak 2442 #SUP 0.60 #QF 0.60 assign (resid 3 and name HA ) (resid 4 and name HA ) 3.76 1.96 1.96 !peak 2444 #SUP 0.96 #QF 0.96 assign (resid 46 and name HB2 ) (resid 47 and name HG1 ) 3.59 1.79 1.79 !peak 2445 #SUP 0.88 #QF 0.88 assign (resid 17 and name HA ) (resid 19 and name HN ) 3.59 1.79 1.79 !peak 2450 #SUP 0.99 #QF 0.99 assign (resid 19 and name HB ) (resid 22 and name HD* ) 4.10 2.30 2.30 !peak 2451 #SUP 0.90 #QF 0.90 assign (resid 12 and name HG ) (resid 64 and name HG ) 4.27 2.47 2.47 !peak 2453 #SUP 0.40 #QF 0.40 assign (resid 16 and name HG2 ) (resid 22 and name HD* ) 3.76 1.96 1.96 !peak 2454 #SUP 0.99 #QF 0.99 assign (resid 13 and name HA ) (resid 16 and name HA ) 3.60 1.80 1.80 !peak 2455 #SUP 0.87 #QF 0.87 assign (resid 12 and name HB1 ) (resid 22 and name HE* ) 3.61 1.81 1.81 !peak 2463 #SUP 0.90 #QF 0.90 assign (resid 51 and name HA ) (resid 53 and name HN ) 3.60 1.80 1.80 !peak 2464 #SUP 0.95 #QF 0.95 assign (resid 62 and name HA ) (resid 64 and name HN ) 3.60 1.80 1.80 !peak 2466 #SUP 0.31 #QF 0.31 assign (resid 14 and name HB1 ) (resid 67 and name HD* ) 3.60 1.80 1.80 !peak 2468 #SUP 0.99 #QF 0.99 assign (resid 20 and name HB2 ) (resid 59 and name HG2* ) 3.76 1.96 1.96 !peak 2471 #SUP 0.77 #QF 0.61 assign (resid 55 and name HB2 ) (resid 59 and name HG2* ) 4.02 2.22 2.22 !peak 2471 #SUP 0.77 #QF 0.61 assign (resid 7 and name HE* ) (resid 68 and name HD2* ) 4.11 2.31 2.31 !peak 2473 #SUP 0.83 #QF 0.83 assign (resid 67 and name HD* ) (resid 68 and name HG ) 3.60 1.80 1.80 !peak 2474 #SUP 0.76 #QF 0.76 assign (resid 28 and name HB1 ) (resid 57 and name HZ ) 3.60 1.80 1.80 !peak 2477 #SUP 0.99 #QF 0.99 assign (resid 3 and name HG2* ) (resid 6 and name HA ) 4.35 2.55 2.55 !peak 2479 #SUP 0.99 #QF 0.96 assign (resid 31 and name HN ) (resid 31 and name HD2 ) 3.94 2.14 2.14 !peak 2480 #SUP 0.98 #QF 0.98 assign (resid 49 and name HA ) (resid 61 and name HD1* ) 3.60 1.80 1.80 !peak 2489 #SUP 1.00 assign (resid 50 and name HA ) (resid 58 and name HG1 ) 3.60 1.80 1.80 !peak 2491 #SUP 0.93 #QF 0.93 assign (resid 71 and name HN ) (resid 72 and name HD1 ) 3.95 2.15 2.15 !peak 2493 #SUP 0.99 #QF 0.99 assign (resid 15 and name HG2* ) (resid 22 and name HE* ) 3.60 1.80 1.80 !peak 2494 #SUP 0.99 #QF 0.99 assign (resid 36 and name HB ) (resid 42 and name HB* ) 3.60 1.80 1.80 !peak 2495 #SUP 0.99 #QF 0.99 assign (resid 23 and name HA ) (resid 27 and name HN ) 3.61 1.81 1.81 !peak 2506 #SUP 0.99 #QF 0.99 assign (resid 29 and name HG2* ) (resid 33 and name HN ) 3.95 2.15 2.15 !peak 2509 #SUP 0.67 #QF 0.67 assign (resid 27 and name HB* ) (resid 31 and name HB1 ) 4.25 2.45 2.45 !peak 2510 #SUP 0.87 #QF 0.83 assign (resid 52 and name HE* ) (resid 53 and name HA ) 3.61 1.81 1.81 !peak 2513 #SUP 0.25 #QF 0.25 assign (resid 71 and name HN ) (resid 72 and name HD2 ) 3.95 2.15 2.15 !peak 2514 #SUP 0.93 #QF 0.93 assign (resid 24 and name HB2 ) (resid 57 and name HE* ) 3.61 1.81 1.81 !peak 2515 #SUP 0.99 #QF 0.99 assign (resid 13 and name HG2* ) (resid 16 and name HD2 ) 3.78 1.98 1.98 !peak 2517 #SUP 0.97 #QF 0.97 assign (resid 32 and name HA ) (resid 33 and name HA ) 3.78 1.98 1.98 !peak 2519 #SUP 0.64 #QF 0.64 assign (resid 17 and name HB2 ) (resid 18 and name HE* ) 3.61 1.81 1.81 !peak 2521 #SUP 1.00 assign (resid 17 and name HG2 ) (resid 18 and name HE* ) 3.92 2.12 2.12 !peak 2522 #SUP 1.00 assign (resid 63 and name HG11 ) (resid 64 and name HN ) 3.61 1.81 1.81 !peak 2523 #SUP 0.99 #QF 0.99 assign (resid 32 and name HD1* ) (resid 45 and name HA ) 4.13 2.33 2.33 !peak 2526 #SUP 0.97 #QF 0.97 assign (resid 16 and name HG2 ) (resid 17 and name HD1 ) 3.62 1.82 1.82 !peak 2528 #SUP 0.98 #QF 0.98 assign (resid 39 and name HN ) (resid 39 and name HG ) 3.62 1.82 1.82 !peak 2531 #SUP 0.99 #QF 0.99 assign (resid 55 and name HN ) (resid 56 and name HA ) 3.62 1.82 1.82 !peak 2534 #SUP 0.98 #QF 0.98 assign (resid 13 and name HG2* ) (resid 16 and name HD1 ) 3.78 1.98 1.98 !peak 2535 #SUP 0.98 #QF 0.98 assign (resid 29 and name HG1* ) (resid 33 and name HB2 ) 3.63 1.83 1.83 !peak 2539 #SUP 0.91 #QF 0.91 assign (resid 12 and name HD1* ) (resid 26 and name HB2 ) 3.63 1.83 1.83 !peak 2543 #SUP 1.00 assign (resid 58 and name HA ) (resid 58 and name HD1 ) 3.82 2.02 2.02 !peak 2544 #SUP 0.80 #QF 0.80 assign (resid 38 and name HA ) (resid 39 and name HB2 ) 3.80 2.00 2.00 !peak 2545 #SUP 1.00 assign (resid 21 and name HB2 ) (resid 24 and name HG1 ) 3.63 1.83 1.83 !peak 2547 #SUP 0.95 #QF 0.95 assign (resid 28 and name HA ) (resid 29 and name HA ) 3.80 2.00 2.00 !peak 2548 #SUP 1.00 assign (resid 55 and name HA ) (resid 58 and name HB2 ) 3.63 1.83 1.83 !peak 2550 #SUP 0.96 #QF 0.96 assign (resid 16 and name HA ) (resid 22 and name HB2 ) 4.05 2.25 2.25 !peak 2565 #SUP 1.00 #QF 0.97 assign (resid 28 and name HD1* ) (resid 46 and name HA ) 3.71 1.91 1.91 !peak 2568 #SUP 0.97 #QF 0.97 assign (resid 19 and name HA ) (resid 63 and name HB ) 3.64 1.84 1.84 !peak 2569 #SUP 0.84 #QF 0.84 assign (resid 29 and name HG1* ) (resid 33 and name HN ) 3.64 1.84 1.84 !peak 2573 #SUP 0.99 #QF 0.99 assign (resid 55 and name HG2 ) (resid 58 and name HB1 ) 3.69 1.89 1.89 !peak 2575 #SUP 0.99 #QF 0.97 assign (resid 36 and name HA ) (resid 41 and name HB2 ) 3.64 1.84 1.84 !peak 2579 #SUP 0.80 #QF 0.80 assign (resid 58 and name HN ) (resid 58 and name HG1 ) 3.73 1.93 1.93 !peak 2583 #SUP 0.99 #QF 0.99 assign (resid 22 and name HN ) (resid 23 and name HA ) 4.15 2.35 2.35 !peak 2584 #SUP 0.86 #QF 0.86 assign (resid 42 and name HA ) (resid 46 and name HG ) 3.64 1.84 1.84 !peak 2590 #SUP 0.82 #QF 0.82 assign (resid 52 and name HA ) (resid 52 and name HE* ) 3.99 2.19 2.19 !peak 2594 #SUP 0.80 #QF 0.80 assign (resid 55 and name HB2 ) (resid 56 and name HG2 ) 3.99 2.19 2.19 !peak 2597 #SUP 0.72 #QF 0.72 assign (resid 55 and name HB1 ) (resid 59 and name HG2* ) 3.64 1.84 1.84 !peak 2598 #SUP 0.58 #QF 0.58 assign (resid 58 and name HA ) (resid 58 and name HD2 ) 3.82 2.02 2.02 !peak 2599 #SUP 0.98 #QF 0.98 assign (resid 31 and name HG1 ) (resid 32 and name HA ) 4.16 2.36 2.36 !peak 2600 #SUP 0.66 #QF 0.66 assign (resid 56 and name HA ) (resid 59 and name HB ) 3.64 1.84 1.84 !peak 2601 #SUP 0.91 #QF 0.91 assign (resid 50 and name HB1 ) (resid 51 and name HA ) 3.64 1.84 1.84 !peak 2603 #SUP 0.98 #QF 0.98 assign (resid 32 and name HB ) (resid 42 and name HA ) 3.65 1.85 1.85 !peak 2613 #SUP 0.76 #QF 0.76 assign (resid 71 and name HB1 ) (resid 72 and name HD2 ) 3.65 1.85 1.85 !peak 2614 #SUP 0.97 #QF 0.97 assign (resid 21 and name HB1 ) (resid 57 and name HE* ) 3.99 2.19 2.19 !peak 2615 #SUP 1.00 assign (resid 18 and name HN ) (resid 63 and name HD1* ) 4.34 2.54 2.54 !peak 2618 #SUP 0.96 #QF 0.96 assign (resid 36 and name HG1* ) (resid 43 and name HN ) 3.83 2.03 2.03 !peak 2621 #SUP 0.96 #QF 0.96 assign (resid 50 and name HB2 ) (resid 62 and name HD2 ) 4.13 2.33 2.33 !peak 2622 #SUP 0.79 #QF 0.65 assign (resid 62 and name HD2 ) (resid 63 and name HG11 ) 4.35 2.55 2.55 !peak 2622 #SUP 0.79 #QF 0.65 assign (resid 16 and name HB1 ) (resid 17 and name HB2 ) 4.34 2.54 2.54 !peak 2623 #SUP 0.99 #QF 0.99 assign (resid 16 and name HB1 ) (resid 22 and name HE* ) 3.65 1.85 1.85 !peak 2625 #SUP 1.00 assign (resid 26 and name HA ) (resid 27 and name HB* ) 3.83 2.03 2.03 !peak 2626 #SUP 0.91 #QF 0.91 assign (resid 32 and name HA ) (resid 34 and name HN ) 3.65 1.85 1.85 !peak 2627 #SUP 0.96 #QF 0.96 assign (resid 16 and name HA ) (resid 16 and name HD2 ) 3.66 1.86 1.86 !peak 2629 #SUP 0.99 #QF 0.99 assign (resid 28 and name HD2* ) (resid 61 and name HG12 ) 3.83 2.03 2.03 !peak 2637 #SUP 0.99 #QF 0.99 assign (resid 3 and name HG1* ) (resid 5 and name HN ) 3.66 1.86 1.86 !peak 2638 #SUP 0.47 #QF 0.47 assign (resid 63 and name HG2* ) (resid 66 and name HB1 ) 3.66 1.86 1.86 !peak 2639 #SUP 0.94 #QF 0.94 assign (resid 27 and name HA ) (resid 29 and name HN ) 3.83 2.03 2.03 !peak 2640 #SUP 0.95 #QF 0.95 assign (resid 15 and name HB ) (resid 18 and name HB2 ) 3.66 1.86 1.86 !peak 2647 #SUP 0.96 #QF 0.96 assign (resid 25 and name HB1 ) (resid 26 and name HB1 ) 4.35 2.55 2.55 !peak 2648 #SUP 0.54 #QF 0.34 assign (resid 31 and name HG1 ) (resid 32 and name HN ) 3.66 1.86 1.86 !peak 2649 #SUP 1.00 assign (resid 15 and name HG1* ) (resid 67 and name HE* ) 3.67 1.87 1.87 !peak 2652 #SUP 1.00 assign (resid 15 and name HG2* ) (resid 67 and name HB2 ) 3.73 1.93 1.93 !peak 2654 #SUP 1.00 #QF 0.93 assign (resid 20 and name HN ) (resid 63 and name HD1* ) 3.67 1.87 1.87 !peak 2657 #SUP 0.73 #QF 0.73 assign (resid 4 and name HB ) (resid 39 and name HB2 ) 3.83 2.03 2.03 !peak 2659 #SUP 0.91 #QF 0.67 assign (resid 63 and name HA ) (resid 67 and name HN ) 3.84 2.04 2.04 !peak 2661 #SUP 0.91 #QF 0.91 assign (resid 4 and name HA ) (resid 8 and name HD2* ) 4.18 2.38 2.38 !peak 2663 #SUP 0.70 #QF 0.36 assign (resid 21 and name HB1 ) (resid 24 and name HA ) 3.67 1.87 1.87 !peak 2664 #SUP 0.85 #QF 0.85 assign (resid 4 and name HA ) (resid 7 and name HD2 ) 3.68 1.88 1.88 !peak 2666 #SUP 0.91 #QF 0.68 assign (resid 13 and name HA ) (resid 16 and name HD1 ) 3.73 1.93 1.93 !peak 2670 #SUP 1.00 assign (resid 26 and name HN ) (resid 26 and name HD1 ) 3.84 2.04 2.04 !peak 2674 #SUP 0.78 #QF 0.78 assign (resid 26 and name HG* ) (resid 30 and name HN ) 3.67 1.87 1.87 !peak 2675 #SUP 0.93 #QF 0.93 assign (resid 49 and name HN ) (resid 61 and name HD1* ) 3.67 1.87 1.87 !peak 2678 #SUP 1.00 assign (resid 58 and name HA ) (resid 61 and name HG2* ) 3.67 1.87 1.87 !peak 2684 #SUP 0.96 #QF 0.96 assign (resid 55 and name HG1 ) (resid 58 and name HB1 ) 3.69 1.89 1.89 !peak 2686 #SUP 0.80 #QF 0.80 assign (resid 43 and name HD1* ) (resid 44 and name HN ) 3.68 1.88 1.88 !peak 2687 #SUP 0.99 #QF 0.99 assign (resid 31 and name HD2 ) (resid 32 and name HN ) 3.68 1.88 1.88 !peak 2691 #SUP 0.99 #QF 0.99 assign (resid 36 and name HB ) (resid 42 and name HA ) 3.68 1.88 1.88 !peak 2696 #SUP 0.95 #QF 0.95 assign (resid 28 and name HN ) (resid 28 and name HG ) 3.68 1.88 1.88 !peak 2698 #SUP 0.92 #QF 0.92 assign (resid 67 and name HA ) (resid 68 and name HB2 ) 4.35 2.55 2.55 !peak 2699 #SUP 0.96 #QF 0.55 assign (resid 67 and name HA ) (resid 68 and name HG ) 4.35 2.55 2.55 !peak 2699 #SUP 0.96 #QF 0.55 assign (resid 50 and name HB2 ) (resid 61 and name HB ) 3.68 1.88 1.88 !peak 2701 #SUP 1.00 assign (resid 59 and name HB ) (resid 63 and name HG11 ) 4.20 2.40 2.40 !peak 2702 #SUP 0.23 #QF 0.23 assign (resid 32 and name HB ) (resid 45 and name HB ) 3.68 1.88 1.88 !peak 2704 #SUP 0.63 #QF 0.63 assign (resid 50 and name HB2 ) (resid 58 and name HG2 ) 3.68 1.88 1.88 !peak 2706 #SUP 0.98 #QF 0.98 assign (resid 65 and name HD2* ) (resid 66 and name HN ) 3.86 2.06 2.06 !peak 2707 #SUP 0.87 #QF 0.87 assign (resid 45 and name HN ) (resid 46 and name HG ) 3.68 1.88 1.88 !peak 2713 #SUP 0.79 #QF 0.79 assign (resid 21 and name HB2 ) (resid 24 and name HN ) 3.68 1.88 1.88 !peak 2714 #SUP 1.00 assign (resid 52 and name HE* ) (resid 53 and name HB* ) 4.03 2.23 2.23 !peak 2717 #SUP 0.65 #QF 0.65 assign (resid 12 and name HG ) (resid 26 and name HG* ) 4.01 2.21 2.21 !peak 2721 #SUP 0.94 #QF 0.74 assign (resid 15 and name HG2* ) (resid 18 and name HN ) 3.69 1.89 1.89 !peak 2724 #SUP 0.77 #QF 0.77 assign (resid 24 and name HN ) (resid 27 and name HB* ) 4.03 2.23 2.23 !peak 2725 #SUP 0.91 #QF 0.91 assign (resid 47 and name HN ) (resid 48 and name HB1 ) 3.69 1.89 1.89 !peak 2726 #SUP 0.83 #QF 0.83 assign (resid 52 and name HN ) (resid 53 and name HA ) 4.09 2.29 2.29 !peak 2732 #SUP 0.96 #QF 0.90 assign (resid 53 and name HA ) (resid 57 and name HE* ) 4.32 2.52 2.52 !peak 2732 #SUP 0.96 #QF 0.90 assign (resid 24 and name HB1 ) (resid 57 and name HE* ) 3.69 1.89 1.89 !peak 2733 #SUP 0.99 #QF 0.99 assign (resid 20 and name HB1 ) (resid 21 and name HE* ) 3.69 1.89 1.89 !peak 2739 #SUP 0.99 #QF 0.99 assign (resid 10 and name HB2 ) (resid 13 and name HN ) 4.35 2.55 2.55 !peak 2743 #SUP 0.99 #QF 0.57 assign (resid 10 and name HB1 ) (resid 13 and name HN ) 4.35 2.55 2.55 !peak 2743 #SUP 0.99 #QF 0.57 assign (resid 31 and name HB1 ) (resid 34 and name HN ) 4.35 2.55 2.55 !peak 2743 #SUP 0.99 #QF 0.57 assign (resid 44 and name HB ) (resid 46 and name HN ) 4.35 2.55 2.55 !peak 2749 #SUP 0.98 #QF 0.80 assign (resid 44 and name HB ) (resid 47 and name HN ) 4.35 2.55 2.55 !peak 2749 #SUP 0.98 #QF 0.80 assign (resid 62 and name HN ) (resid 63 and name HD1* ) 4.05 2.25 2.25 !peak 2753 #SUP 0.88 #QF 0.88 assign (resid 32 and name HD1* ) (resid 49 and name HN ) 4.35 2.55 2.55 !peak 2756 #SUP 0.93 #QF 0.93 assign (resid 7 and name HD2 ) (resid 8 and name HN ) 3.80 2.00 2.00 !peak 2757 #SUP 0.97 #QF 0.97 assign (resid 9 and name HN ) (resid 10 and name HD* ) 4.21 2.41 2.41 !peak 2757 #SUP 0.97 #QF 0.97 assign (resid 15 and name HA ) (resid 16 and name HB2 ) 4.22 2.42 2.42 !peak 2759 #SUP 0.40 #QF 0.40 assign (resid 67 and name HN ) (resid 68 and name HD1* ) 3.88 2.08 2.08 !peak 2762 #SUP 0.71 #QF 0.71 assign (resid 12 and name HD1* ) (resid 22 and name HD* ) 4.05 2.25 2.25 !peak 2763 #SUP 0.91 #QF 0.91 assign (resid 39 and name HA ) (resid 43 and name HN ) 3.71 1.91 1.91 !peak 2768 #SUP 0.97 #QF 0.97 assign (resid 9 and name HA ) (resid 13 and name HN ) 3.71 1.91 1.91 !peak 2771 #SUP 0.95 #QF 0.95 assign (resid 7 and name HE* ) (resid 38 and name HA ) 4.24 2.44 2.43 !peak 2781 #SUP 0.67 #QF 0.67 assign (resid 16 and name HN ) (resid 16 and name HG2 ) 3.71 1.91 1.91 !peak 2782 #SUP 0.92 #QF 0.92 assign (resid 4 and name HA ) (resid 7 and name HG2 ) 3.71 1.91 1.91 !peak 2786 #SUP 0.99 #QF 0.99 assign (resid 42 and name HN ) (resid 45 and name HB ) 4.35 2.55 2.55 !peak 2789 #SUP 0.99 #QF 0.86 assign (resid 45 and name HB ) (resid 48 and name HN ) 4.35 2.55 2.55 !peak 2789 #SUP 0.99 #QF 0.86 assign (resid 42 and name HN ) (resid 43 and name HB ) 3.89 2.09 2.09 !peak 2794 #SUP 0.96 #QF 0.96 assign (resid 26 and name HG* ) (resid 30 and name HB2 ) 3.71 1.91 1.91 !peak 2797 #SUP 0.51 #QF 0.51 assign (resid 21 and name HA ) (resid 22 and name HB1 ) 3.71 1.91 1.91 !peak 2798 #SUP 0.97 #QF 0.97 assign (resid 13 and name HG2* ) (resid 22 and name HD* ) 4.35 2.55 2.55 !peak 2804 #SUP 0.87 #QF 0.57 assign (resid 54 and name HA ) (resid 58 and name HG2 ) 3.78 1.98 1.97 !peak 2805 #SUP 0.71 #QF 0.71 assign (resid 60 and name HN ) (resid 61 and name HB ) 3.72 1.92 1.92 !peak 2808 #SUP 0.95 #QF 0.95 assign (resid 10 and name HB1 ) (resid 14 and name HN ) 3.90 2.10 2.10 !peak 2809 #SUP 0.99 #QF 0.99 assign (resid 4 and name HA ) (resid 8 and name HD1* ) 4.18 2.38 2.38 !peak 2812 #SUP 0.95 #QF 0.95 assign (resid 53 and name HA ) (resid 58 and name HN ) 4.25 2.45 2.45 !peak 2815 #SUP 0.85 #QF 0.85 assign (resid 15 and name HN ) (resid 19 and name HG2* ) 3.90 2.10 2.10 !peak 2818 #SUP 0.99 #QF 0.99 assign (resid 4 and name HB ) (resid 7 and name HE* ) 3.72 1.92 1.92 !peak 2821 #SUP 0.27 #QF 0.27 assign (resid 62 and name HG2 ) (resid 63 and name HA ) 3.91 2.11 2.11 !peak 2823 #SUP 0.99 #QF 0.93 assign (resid 62 and name HG1 ) (resid 63 and name HA ) 4.16 2.36 2.36 !peak 2823 #SUP 0.99 #QF 0.93 assign (resid 32 and name HA ) (resid 36 and name HN ) 3.73 1.93 1.93 !peak 2825 #SUP 0.98 #QF 0.98 assign (resid 13 and name HA ) (resid 16 and name HD2 ) 3.73 1.93 1.93 !peak 2830 #SUP 0.98 #QF 0.98 assign (resid 15 and name HN ) (resid 16 and name HA ) 3.73 1.93 1.93 !peak 2834 #SUP 0.88 #QF 0.88 assign (resid 22 and name HE* ) (resid 26 and name HG* ) 3.73 1.93 1.93 !peak 2835 #SUP 0.94 #QF 0.94 assign (resid 67 and name HB2 ) (resid 68 and name HG ) 3.91 2.11 2.11 !peak 2837 #SUP 1.00 assign (resid 61 and name HG2* ) (resid 62 and name HD2 ) 3.73 1.93 1.93 !peak 2841 #SUP 0.92 #QF 0.92 assign (resid 63 and name HG12 ) (resid 64 and name HN ) 3.91 2.11 2.11 !peak 2842 #SUP 1.00 assign (resid 43 and name HG2* ) (resid 44 and name HB ) 4.09 2.29 2.29 !peak 2843 #SUP 0.93 #QF 0.93 assign (resid 58 and name HN ) (resid 58 and name HG2 ) 3.73 1.93 1.93 !peak 2845 #SUP 0.93 #QF 0.93 assign (resid 55 and name HB2 ) (resid 57 and name HN ) 3.94 2.14 2.14 !peak 2847 #SUP 0.95 #QF 0.59 assign (resid 11 and name HB* ) (resid 66 and name HN ) 4.35 2.55 2.55 !peak 2857 #SUP 0.88 #QF 0.88 assign (resid 3 and name HB ) (resid 4 and name HA ) 4.28 2.48 2.48 !peak 2858 #SUP 1.00 assign (resid 23 and name HB1 ) (resid 24 and name HA ) 3.76 1.96 1.96 !peak 2862 #SUP 0.94 #QF 0.94 assign (resid 51 and name HB2 ) (resid 53 and name HN ) 3.92 2.12 2.12 !peak 2863 #SUP 0.86 #QF 0.86 assign (resid 24 and name HG2 ) (resid 25 and name HN ) 3.75 1.95 1.95 !peak 2871 #SUP 0.94 #QF 0.94 assign (resid 3 and name HG1* ) (resid 39 and name HA ) 3.92 2.12 2.12 !peak 2872 #SUP 0.57 #QF 0.57 assign (resid 12 and name HN ) (resid 29 and name HG1* ) 3.92 2.12 2.12 !peak 2873 #SUP 0.46 #QF 0.46 assign (resid 53 and name HA ) (resid 61 and name HD1* ) 3.75 1.95 1.95 !peak 2877 #SUP 0.77 #QF 0.77 assign (resid 19 and name HB ) (resid 25 and name HB2 ) 3.75 1.95 1.95 !peak 2880 #SUP 0.50 #QF 0.50 assign (resid 66 and name HB1 ) (resid 67 and name HA ) 3.75 1.95 1.95 !peak 2882 #SUP 0.86 #QF 0.86 assign (resid 27 and name HB* ) (resid 28 and name HB1 ) 3.75 1.95 1.95 !peak 2884 #SUP 0.95 #QF 0.95 assign (resid 64 and name HA ) (resid 68 and name HG ) 3.75 1.95 1.95 !peak 2890 #SUP 0.93 #QF 0.93 assign (resid 5 and name HB2 ) (resid 33 and name HA ) 4.11 2.31 2.31 !peak 2891 #SUP 0.59 #QF 0.59 assign (resid 63 and name HB ) (resid 64 and name HA ) 3.75 1.95 1.95 !peak 2902 #SUP 0.46 #QF 0.46 assign (resid 13 and name HA ) (resid 15 and name HN ) 3.75 1.95 1.95 !peak 2904 #SUP 0.99 #QF 0.99 assign (resid 22 and name HA ) (resid 25 and name HG ) 4.11 2.31 2.31 !peak 2907 #SUP 0.93 #QF 0.93 assign (resid 64 and name HA ) (resid 68 and name HD1* ) 3.75 1.95 1.95 !peak 2909 #SUP 0.68 #QF 0.68 assign (resid 52 and name HN ) (resid 52 and name HE* ) 3.76 1.96 1.96 !peak 2912 #SUP 0.60 #QF 0.60 assign (resid 36 and name HA ) (resid 41 and name HB1 ) 3.76 1.96 1.96 !peak 2917 #SUP 0.94 #QF 0.94 assign (resid 22 and name HD* ) (resid 26 and name HD1 ) 3.76 1.96 1.96 !peak 2925 #SUP 0.66 #QF 0.66 assign (resid 69 and name HB2 ) (resid 70 and name HA ) 3.76 1.96 1.96 !peak 2926 #SUP 0.73 #QF 0.73 assign (resid 46 and name HA ) (resid 61 and name HD1* ) 3.76 1.96 1.96 !peak 2930 #SUP 0.99 #QF 0.99 assign (resid 20 and name HA ) (resid 63 and name HD1* ) 4.35 2.55 2.55 !peak 2931 #SUP 0.92 #QF 0.92 assign (resid 23 and name HB2 ) (resid 24 and name HA ) 3.76 1.96 1.96 !peak 2932 #SUP 0.97 #QF 0.97 assign (resid 27 and name HB* ) (resid 30 and name HB1 ) 3.76 1.96 1.96 !peak 2933 #SUP 0.89 #QF 0.89 assign (resid 62 and name HN ) (resid 63 and name HG11 ) 3.76 1.96 1.96 !peak 2937 #SUP 0.93 #QF 0.93 assign (resid 23 and name HA ) (resid 25 and name HN ) 3.76 1.96 1.96 !peak 2938 #SUP 0.64 #QF 0.64 assign (resid 61 and name HB ) (resid 62 and name HD2 ) 3.76 1.96 1.96 !peak 2942 #SUP 0.96 #QF 0.96 assign (resid 11 and name HB* ) (resid 14 and name HN ) 3.77 1.97 1.97 !peak 2944 #SUP 0.93 #QF 0.93 assign (resid 31 and name HB1 ) (resid 32 and name HG11 ) 4.13 2.33 2.33 !peak 2946 #SUP 0.74 #QF 0.74 assign (resid 20 and name HN ) (resid 63 and name HB ) 4.35 2.55 2.55 !peak 2953 #SUP 0.79 #QF 0.79 assign (resid 54 and name HA ) (resid 58 and name HG1 ) 3.78 1.98 1.97 !peak 2956 #SUP 0.98 #QF 0.98 assign (resid 46 and name HB2 ) (resid 47 and name HA ) 3.78 1.98 1.98 !peak 2963 #SUP 0.65 #QF 0.65 assign (resid 7 and name HN ) (resid 7 and name HD1 ) 3.78 1.98 1.98 !peak 2966 #SUP 0.97 #QF 0.97 assign (resid 19 and name HB ) (resid 22 and name HA ) 3.78 1.98 1.98 !peak 2967 #SUP 0.86 #QF 0.86 assign (resid 30 and name HB1 ) (resid 31 and name HB2 ) 3.78 1.98 1.98 !peak 2974 #SUP 0.95 #QF 0.95 assign (resid 45 and name HN ) (resid 46 and name HA ) 3.96 2.16 2.16 !peak 2976 #SUP 1.00 assign (resid 21 and name HA ) (resid 24 and name HB1 ) 4.33 2.53 2.53 !peak 2978 #SUP 0.96 #QF 0.96 assign (resid 46 and name HB1 ) (resid 61 and name HA ) 4.15 2.35 2.35 !peak 2979 #SUP 0.95 #QF 0.95 assign (resid 14 and name HG1 ) (resid 15 and name HG1* ) 3.79 1.99 1.99 !peak 2980 #SUP 0.54 #QF 0.54 assign (resid 60 and name HA ) (resid 63 and name HG12 ) 3.79 1.99 1.99 !peak 2981 #SUP 1.00 assign (resid 10 and name HA ) (resid 10 and name HE* ) 3.63 1.83 1.83 !peak 2983 #SUP 0.94 #QF 0.94 assign (resid 10 and name HA ) (resid 10 and name HD* ) 2.79 0.99 0.99 !peak 2984 #SUP 0.44 #QF 0.44 assign (resid 7 and name HA ) (resid 10 and name HD* ) 3.53 1.73 1.73 !peak 2986 #SUP 0.98 #QF 0.26 assign (resid 15 and name HB ) (resid 19 and name HG2* ) 3.19 1.39 1.39 !peak 2990 #SUP 1.00 assign (resid 16 and name HB2 ) (resid 17 and name HD1 ) 3.17 1.37 1.37 !peak 2996 #SUP 1.00 assign (resid 16 and name HB1 ) (resid 17 and name HD1 ) 2.94 1.14 1.14 !peak 2997 #SUP 1.00 assign (resid 16 and name HB2 ) (resid 17 and name HD2 ) 3.40 1.60 1.60 !peak 2998 #SUP 1.00 assign (resid 16 and name HB1 ) (resid 17 and name HD2 ) 3.10 1.30 1.30 !peak 2999 #SUP 1.00 assign (resid 15 and name HA ) (resid 18 and name HB2 ) 3.57 1.77 1.77 !peak 3000 #SUP 1.00 assign (resid 15 and name HA ) (resid 18 and name HB1 ) 3.81 2.01 2.01 !peak 3001 #SUP 1.00 #QF 0.97 assign (resid 18 and name HB1 ) (resid 19 and name HA ) 4.11 2.31 2.31 !peak 3001 #SUP 1.00 #QF 0.97 assign (resid 18 and name HB2 ) (resid 19 and name HG2* ) 3.57 1.77 1.77 !peak 3002 #SUP 1.00 assign (resid 18 and name HB2 ) (resid 19 and name HG1* ) 3.38 1.58 1.58 !peak 3003 #SUP 1.00 assign (resid 18 and name HB1 ) (resid 19 and name HG2* ) 3.95 2.15 2.15 !peak 3004 #SUP 1.00 assign (resid 18 and name HB1 ) (resid 19 and name HG1* ) 3.50 1.70 1.70 !peak 3005 #SUP 1.00 assign (resid 18 and name HA ) (resid 18 and name HD* ) 3.63 1.83 1.83 !peak 3006 #SUP 1.00 assign (resid 19 and name HB ) (resid 63 and name HD1* ) 3.52 1.72 1.72 !peak 3009 #SUP 1.00 assign (resid 21 and name HA ) (resid 21 and name HD* ) 3.76 1.96 1.96 !peak 3012 #SUP 0.73 #QF 0.73 assign (resid 25 and name HA ) (resid 28 and name HB2 ) 3.57 1.77 1.77 !peak 3023 #SUP 1.00 assign (resid 8 and name HB1 ) (resid 33 and name HB2 ) 4.35 2.55 2.55 !peak 3026 #SUP 0.77 #QF 0.77 assign (resid 33 and name HA ) (resid 36 and name HG1* ) 3.51 1.71 1.71 !peak 3028 #SUP 0.91 #QF 0.91 assign (resid 33 and name HA ) (resid 36 and name HG2* ) 3.33 1.53 1.53 !peak 3029 #SUP 0.92 #QF 0.92 assign (resid 40 and name HB2 ) (resid 41 and name HN ) 3.05 1.25 1.25 !peak 3031 #SUP 0.96 #QF 0.96 assign (resid 40 and name HB1 ) (resid 41 and name HN ) 3.05 1.25 1.25 !peak 3032 #SUP 0.97 #QF 0.97 assign (resid 36 and name HG2* ) (resid 42 and name HB* ) 2.60 0.80 0.80 !peak 3038 #SUP 1.00 assign (resid 39 and name HA ) (resid 42 and name HB* ) 2.75 0.95 0.95 !peak 3040 #SUP 0.92 #QF 0.92 assign (resid 4 and name HG2* ) (resid 42 and name HB* ) 2.96 1.16 1.16 !peak 3044 #SUP 0.95 #QF 0.50 assign (resid 43 and name HA ) (resid 47 and name HG1 ) 3.82 2.02 2.02 !peak 3049 #SUP 1.00 #QF 0.64 assign (resid 43 and name HA ) (resid 47 and name HG2 ) 4.35 2.55 2.55 !peak 3050 #SUP 1.00 #QF 0.26 assign (resid 44 and name HA ) (resid 47 and name HG2 ) 4.35 2.55 2.55 !peak 3050 #SUP 1.00 #QF 0.26 assign (resid 57 and name HA ) (resid 57 and name HD* ) 3.20 1.40 1.40 !peak 3073 #SUP 0.97 #QF 0.97 assign (resid 58 and name HA ) (resid 61 and name HB ) 3.33 1.53 1.53 !peak 3082 #SUP 1.00 assign (resid 58 and name HA ) (resid 61 and name HG11 ) 3.98 2.18 2.18 !peak 3083 #SUP 1.00 assign (resid 59 and name HA ) (resid 62 and name HG1 ) 3.94 2.14 2.14 !peak 3094 #SUP 1.00 #QF 0.99 assign (resid 20 and name HN ) (resid 59 and name HG2* ) 3.91 2.11 2.11 !peak 3095 #SUP 0.96 #QF 0.96 assign (resid 25 and name HG ) (resid 60 and name HB2 ) 4.35 2.55 2.55 !peak 3096 #SUP 0.95 #QF 0.95 assign (resid 25 and name HG ) (resid 60 and name HB1 ) 4.35 2.55 2.55 !peak 3097 #SUP 1.00 assign (resid 61 and name HB ) (resid 61 and name HD1* ) 2.81 1.01 1.01 !peak 3099 #SUP 1.00 assign (resid 58 and name HA ) (resid 61 and name HG12 ) 4.25 2.45 2.45 !peak 3100 #SUP 1.00 assign (resid 59 and name HA ) (resid 62 and name HG2 ) 3.05 1.25 1.25 !peak 3103 #SUP 1.00 #QF 0.91 assign (resid 19 and name HG2* ) (resid 63 and name HB ) 3.79 1.99 1.99 !peak 3105 #SUP 1.00 assign (resid 19 and name HG1* ) (resid 63 and name HB ) 3.07 1.27 1.27 !peak 3106 #SUP 0.98 #QF 0.98 assign (resid 7 and name HD1 ) (resid 39 and name HA ) 4.31 2.51 2.51 !peak 3114 #SUP 0.48 #QF 0.48 assign (resid 67 and name HB1 ) (resid 68 and name HD2* ) 3.86 2.06 2.06 !peak 3116 #SUP 1.00 assign (resid 67 and name HD* ) (resid 68 and name HD1* ) 3.99 2.19 2.19 !peak 3118 #SUP 1.00 assign (resid 67 and name HD* ) (resid 68 and name HD2* ) 3.04 1.24 1.24 !peak 3120 #SUP 0.83 #QF 0.83 assign (resid 8 and name HA ) (resid 68 and name HD1* ) 3.15 1.35 1.35 !peak 3121 #SUP 0.98 #QF 0.98 assign (resid 8 and name HA ) (resid 68 and name HD2* ) 2.67 0.87 0.87 !peak 3122 #SUP 0.91 #QF 0.91 assign (resid 1 and name HA* ) (resid 3 and name HG1* ) 4.35 2.55 2.55 !peak 3138 #SUP 0.34 #QF 0.34 assign (resid 2 and name HB2 ) (resid 3 and name HN ) 3.48 1.68 1.68 !peak 3141 #SUP 0.98 #QF 0.98 assign (resid 3 and name HG1* ) (resid 4 and name HA ) 3.44 1.64 1.64 !peak 3143 #SUP 0.91 #QF 0.91 assign (resid 4 and name HA ) (resid 7 and name HD1 ) 3.46 1.66 1.66 !peak 3144 #SUP 0.91 #QF 0.91 assign (resid 4 and name HG1* ) (resid 5 and name HA ) 3.41 1.61 1.61 !peak 3145 #SUP 0.84 #QF 0.84 assign (resid 5 and name HA ) (resid 29 and name HG2* ) 4.35 2.55 2.55 !peak 3149 #SUP 0.79 #QF 0.79 assign (resid 5 and name HA ) (resid 5 and name HG1 ) 2.96 1.16 1.16 !peak 3150 #SUP 1.00 assign (resid 5 and name HA ) (resid 5 and name HD* ) 3.34 1.54 1.54 !peak 3151 #SUP 0.99 #QF 0.99 assign (resid 5 and name HA ) (resid 8 and name HB2 ) 3.04 1.24 1.24 !peak 3152 #SUP 0.81 #QF 0.81 assign (resid 5 and name HA ) (resid 5 and name HE* ) 3.80 2.00 2.00 !peak 3154 #SUP 0.85 #QF 0.85 assign (resid 5 and name HG2 ) (resid 9 and name HN ) 4.07 2.27 2.27 !peak 3156 #SUP 0.84 #QF 0.84 assign (resid 5 and name HG1 ) (resid 9 and name HN ) 4.07 2.27 2.27 !peak 3157 #SUP 1.00 assign (resid 5 and name HG2 ) (resid 9 and name HG2 ) 3.62 1.82 1.82 !peak 3158 #SUP 0.79 #QF 0.79 assign (resid 5 and name HG2 ) (resid 9 and name HG1 ) 3.62 1.82 1.82 !peak 3160 #SUP 1.00 assign (resid 7 and name HE* ) (resid 39 and name HD1* ) 3.41 1.61 1.61 !peak 3169 #SUP 0.91 #QF 0.88 assign (resid 5 and name HG1 ) (resid 5 and name HE* ) 3.03 1.23 1.23 !peak 3170 #SUP 0.98 #QF 0.98 assign (resid 51 and name HD* ) (resid 51 and name HE* ) 2.60 0.80 0.80 !peak 3172 #SUP 1.00 #QF 0.70 assign (resid 7 and name HE* ) (resid 39 and name HB1 ) 2.96 1.16 1.16 !peak 3173 #SUP 0.51 #QF 0.51 assign (resid 5 and name HE* ) (resid 9 and name HG1 ) 3.40 1.60 1.60 !peak 3174 #SUP 0.85 #QF 0.85 assign (resid 3 and name HA ) (resid 7 and name HE* ) 3.67 1.87 1.87 !peak 3175 #SUP 0.53 #QF 0.53 assign (resid 7 and name HE* ) (resid 39 and name HA ) 3.92 2.12 2.12 !peak 3176 #SUP 0.94 #QF 0.24 assign (resid 6 and name HA ) (resid 6 and name HG1 ) 3.34 1.54 1.54 !peak 3188 #SUP 0.95 #QF 0.95 assign (resid 7 and name HA ) (resid 7 and name HG2 ) 3.20 1.40 1.40 !peak 3192 #SUP 0.99 #QF 0.99 assign (resid 4 and name HA ) (resid 7 and name HB2 ) 3.11 1.31 1.31 !peak 3197 #SUP 0.97 #QF 0.97 assign (resid 7 and name HB2 ) (resid 68 and name HD2* ) 3.04 1.24 1.24 !peak 3202 #SUP 0.85 #QF 0.52 assign (resid 14 and name HB1 ) (resid 15 and name HG1* ) 3.80 2.00 2.00 !peak 3204 #SUP 0.98 #QF 0.59 assign (resid 7 and name HN ) (resid 7 and name HD2 ) 3.96 2.16 2.16 !peak 3209 #SUP 0.98 #QF 0.97 assign (resid 3 and name HG2* ) (resid 7 and name HG2 ) 3.33 1.53 1.53 !peak 3214 #SUP 0.96 #QF 0.96 assign (resid 7 and name HG2 ) (resid 68 and name HD2* ) 3.80 2.00 2.00 !peak 3215 #SUP 0.92 #QF 0.92 assign (resid 8 and name HB1 ) (resid 11 and name HB* ) 3.60 1.80 1.80 !peak 3223 #SUP 1.00 assign (resid 8 and name HD2* ) (resid 42 and name HB* ) 2.99 1.19 1.19 !peak 3229 #SUP 0.87 #QF 0.72 assign (resid 8 and name HA ) (resid 8 and name HD2* ) 3.27 1.47 1.47 !peak 3232 #SUP 0.97 #QF 0.97 assign (resid 10 and name HB2 ) (resid 10 and name HD* ) 2.81 1.01 1.01 !peak 3247 #SUP 1.00 #QF 0.96 assign (resid 10 and name HB1 ) (resid 10 and name HD* ) 3.07 1.27 1.27 !peak 3247 #SUP 1.00 #QF 0.96 assign (resid 12 and name HB2 ) (resid 12 and name HD2* ) 2.94 1.14 1.14 !peak 3249 #SUP 1.00 assign (resid 12 and name HD1* ) (resid 26 and name HB1 ) 3.83 2.03 2.03 !peak 3256 #SUP 0.85 #QF 0.85 assign (resid 12 and name HD2* ) (resid 29 and name HG2* ) 2.88 1.08 1.08 !peak 3258 #SUP 0.91 #QF 0.86 assign (resid 12 and name HD2* ) (resid 25 and name HG ) 3.84 2.04 2.04 !peak 3259 #SUP 0.77 #QF 0.77 assign (resid 12 and name HD2* ) (resid 29 and name HB ) 3.40 1.60 1.60 !peak 3262 #SUP 0.94 #QF 0.90 assign (resid 12 and name HA ) (resid 12 and name HD2* ) 3.49 1.69 1.69 !peak 3263 #SUP 0.98 #QF 0.98 assign (resid 12 and name HN ) (resid 12 and name HD2* ) 3.49 1.69 1.69 !peak 3264 #SUP 0.98 #QF 0.98 assign (resid 13 and name HB ) (resid 14 and name HB2 ) 3.83 2.03 2.03 !peak 3265 #SUP 0.99 #QF 0.99 assign (resid 17 and name HD1 ) (resid 18 and name HN ) 3.52 1.72 1.72 !peak 3267 #SUP 0.94 #QF 0.94 assign (resid 17 and name HD1 ) (resid 18 and name HD* ) 3.74 1.94 1.94 !peak 3269 #SUP 0.82 #QF 0.82 assign (resid 17 and name HD1 ) (resid 18 and name HE* ) 3.85 2.05 2.05 !peak 3270 #SUP 0.81 #QF 0.81 assign (resid 17 and name HD2 ) (resid 18 and name HE* ) 3.52 1.72 1.72 !peak 3271 #SUP 1.00 assign (resid 17 and name HD2 ) (resid 18 and name HD* ) 3.39 1.59 1.59 !peak 3272 #SUP 0.97 #QF 0.97 assign (resid 15 and name HA ) (resid 17 and name HD1 ) 3.80 2.00 2.00 !peak 3273 #SUP 1.00 assign (resid 15 and name HA ) (resid 17 and name HD2 ) 3.31 1.51 1.51 !peak 3274 #SUP 0.98 #QF 0.98 assign (resid 15 and name HG2* ) (resid 17 and name HD2 ) 3.73 1.93 1.93 !peak 3281 #SUP 0.73 #QF 0.73 assign (resid 71 and name HB2 ) (resid 72 and name HD2 ) 3.65 1.85 1.85 !peak 3284 #SUP 0.99 #QF 0.99 assign (resid 13 and name HN ) (resid 22 and name HE* ) 3.73 1.93 1.93 !peak 3308 #SUP 0.96 #QF 0.58 assign (resid 21 and name HA ) (resid 21 and name HE* ) 3.73 1.93 1.93 !peak 3311 #SUP 0.87 #QF 0.87 assign (resid 18 and name HA ) (resid 18 and name HE* ) 3.71 1.91 1.91 !peak 3313 #SUP 0.81 #QF 0.81 assign (resid 12 and name HA ) (resid 22 and name HE* ) 3.40 1.60 1.60 !peak 3314 #SUP 0.98 #QF 0.58 assign (resid 13 and name HA ) (resid 22 and name HE* ) 3.65 1.85 1.85 !peak 3315 #SUP 0.99 #QF 0.99 assign (resid 21 and name HE* ) (resid 57 and name HB2 ) 4.28 2.48 2.48 !peak 3319 #SUP 0.87 #QF 0.87 assign (resid 20 and name HG2 ) (resid 21 and name HE* ) 4.25 2.45 2.45 !peak 3328 #SUP 0.93 #QF 0.43 assign (resid 20 and name HG1 ) (resid 21 and name HE* ) 4.25 2.45 2.45 !peak 3328 #SUP 0.93 #QF 0.43 assign (resid 17 and name HB1 ) (resid 18 and name HE* ) 4.10 2.30 2.30 !peak 3329 #SUP 0.54 #QF 0.54 assign (resid 16 and name HB2 ) (resid 22 and name HE* ) 3.02 1.22 1.22 !peak 3330 #SUP 0.92 #QF 0.28 assign (resid 22 and name HE* ) (resid 26 and name HD1 ) 3.14 1.34 1.34 !peak 3331 #SUP 0.92 #QF 0.92 assign (resid 13 and name HG12 ) (resid 22 and name HE* ) 3.96 2.16 2.16 !peak 3336 #SUP 0.97 #QF 0.77 assign (resid 22 and name HE* ) (resid 26 and name HB1 ) 4.22 2.42 2.42 !peak 3336 #SUP 0.97 #QF 0.77 assign (resid 19 and name HG2* ) (resid 22 and name HE* ) 3.38 1.58 1.58 !peak 3338 #SUP 0.91 #QF 0.91 assign (resid 15 and name HG2* ) (resid 18 and name HE* ) 4.35 2.55 2.55 !peak 3339 #SUP 0.96 #QF 0.57 assign (resid 18 and name HE* ) (resid 63 and name HG2* ) 4.35 2.55 2.55 !peak 3339 #SUP 0.96 #QF 0.57 assign (resid 13 and name HG2* ) (resid 22 and name HE* ) 3.76 1.96 1.96 !peak 3340 #SUP 0.91 #QF 0.42 assign (resid 12 and name HD1* ) (resid 22 and name HE* ) 3.27 1.47 1.47 !peak 3341 #SUP 0.85 #QF 0.85 assign (resid 15 and name HG1* ) (resid 18 and name HE* ) 3.65 1.85 1.85 !peak 3342 #SUP 0.97 #QF 0.97 assign (resid 12 and name HD2* ) (resid 22 and name HE* ) 3.27 1.47 1.47 !peak 3343 #SUP 0.96 #QF 0.96 assign (resid 15 and name HG2* ) (resid 18 and name HD* ) 4.14 2.34 2.34 !peak 3349 #SUP 0.99 #QF 0.85 assign (resid 57 and name HD* ) (resid 58 and name HA ) 3.90 2.10 2.10 !peak 3355 #SUP 0.99 #QF 0.95 assign (resid 57 and name HA ) (resid 57 and name HE* ) 3.82 2.02 2.02 !peak 3358 #SUP 0.85 #QF 0.85 assign (resid 57 and name HD* ) (resid 59 and name HN ) 4.19 2.39 2.39 !peak 3368 #SUP 0.56 #QF 0.56 assign (resid 16 and name HB2 ) (resid 22 and name HD* ) 3.87 2.07 2.07 !peak 3370 #SUP 0.99 #QF 0.99 assign (resid 18 and name HN ) (resid 18 and name HD* ) 3.79 1.99 1.99 !peak 3377 #SUP 0.82 #QF 0.82 assign (resid 24 and name HG2 ) (resid 57 and name HE* ) 4.02 2.22 2.22 !peak 3378 #SUP 0.98 #QF 0.98 assign (resid 24 and name HG1 ) (resid 57 and name HE* ) 3.80 2.00 2.00 !peak 3379 #SUP 0.99 #QF 0.99 assign (resid 24 and name HA ) (resid 24 and name HG1 ) 3.15 1.35 1.35 !peak 3382 #SUP 1.00 assign (resid 24 and name HA ) (resid 24 and name HG2 ) 2.92 1.12 1.12 !peak 3383 #SUP 0.99 #QF 0.99 assign (resid 32 and name HG2* ) (resid 49 and name HG1 ) 3.57 1.77 1.77 !peak 3387 #SUP 0.82 #QF 0.31 assign (resid 31 and name HD1 ) (resid 32 and name HG2* ) 3.34 1.54 1.54 !peak 3388 #SUP 0.87 #QF 0.87 assign (resid 36 and name HG2* ) (resid 41 and name HB2 ) 3.25 1.45 1.45 !peak 3389 #SUP 0.81 #QF 0.61 assign (resid 36 and name HG1* ) (resid 45 and name HB ) 3.15 1.35 1.35 !peak 3390 #SUP 0.99 #QF 0.99 assign (resid 36 and name HG1* ) (resid 42 and name HB* ) 2.98 1.18 1.18 !peak 3391 #SUP 0.99 #QF 0.99 assign (resid 53 and name HB* ) (resid 58 and name HN ) 3.07 1.27 1.27 !peak 3398 #SUP 0.79 #QF 0.79 assign (resid 53 and name HB* ) (resid 57 and name HD* ) 3.11 1.31 1.31 !peak 3399 #SUP 0.86 #QF 0.86 assign (resid 53 and name HB* ) (resid 57 and name HE* ) 3.28 1.48 1.48 !peak 3401 #SUP 0.86 #QF 0.60 assign (resid 49 and name HA ) (resid 53 and name HB* ) 3.90 2.10 2.10 !peak 3402 #SUP 0.88 #QF 0.83 assign (resid 53 and name HB* ) (resid 57 and name HB1 ) 3.24 1.44 1.44 !peak 3405 #SUP 0.78 #QF 0.78 assign (resid 24 and name HB1 ) (resid 57 and name HZ ) 3.82 2.02 2.02 !peak 3413 #SUP 0.72 #QF 0.72 assign (resid 28 and name HB2 ) (resid 57 and name HZ ) 3.49 1.69 1.69 !peak 3414 #SUP 0.76 #QF 0.76 assign (resid 24 and name HB2 ) (resid 57 and name HZ ) 4.33 2.53 2.53 !peak 3415 #SUP 0.58 #QF 0.31 assign (resid 27 and name HB* ) (resid 57 and name HZ ) 4.35 2.55 2.55 !peak 3415 #SUP 0.58 #QF 0.31 assign (resid 24 and name HB1 ) (resid 57 and name HD* ) 3.95 2.15 2.15 !peak 3419 #SUP 1.00 #QF 0.96 assign (resid 14 and name HB1 ) (resid 67 and name HE* ) 3.90 2.10 2.10 !peak 3424 #SUP 0.66 #QF 0.66 assign (resid 59 and name HA ) (resid 62 and name HN ) 3.38 1.58 1.58 !peak 3430 #SUP 0.97 #QF 0.97 assign (resid 59 and name HA ) (resid 63 and name HN ) 3.75 1.95 1.95 !peak 3433 #SUP 0.98 #QF 0.98 assign (resid 49 and name HB1 ) (resid 61 and name HD1* ) 3.09 1.29 1.29 !peak 3434 #SUP 0.98 #QF 0.95 assign (resid 50 and name HG1 ) (resid 61 and name HD1* ) 3.48 1.68 1.68 !peak 3434 #SUP 0.98 #QF 0.95 assign (resid 57 and name HD* ) (resid 61 and name HD1* ) 3.25 1.45 1.45 !peak 3436 #SUP 0.93 #QF 0.93 assign (resid 12 and name HG ) (resid 64 and name HD1* ) 3.73 1.93 1.93 !peak 3439 #SUP 0.48 #QF 0.48 assign (resid 25 and name HB1 ) (resid 26 and name HG* ) 4.10 2.30 2.30 !peak 3441 #SUP 0.98 #QF 0.38 assign (resid 46 and name HB2 ) (resid 65 and name HB1 ) 3.92 2.12 2.12 !peak 3442 #SUP 0.73 #QF 0.73 assign (resid 11 and name HB* ) (resid 67 and name HZ ) 4.25 2.45 2.45 !peak 3446 #SUP 0.96 #QF 0.65 assign (resid 14 and name HB2 ) (resid 67 and name HZ ) 4.35 2.55 2.55 !peak 3446 #SUP 0.96 #QF 0.65 assign (resid 67 and name HD* ) (resid 67 and name HZ ) 3.11 1.31 1.31 !peak 3448 #SUP 0.78 #QF 0.78 assign (resid 15 and name HB ) (resid 18 and name HE* ) 4.29 2.49 2.49 !peak 3453 #SUP 0.97 #QF 0.97 assign (resid 16 and name HN ) (resid 17 and name HG1 ) 3.84 2.04 2.04 !peak 3457 #SUP 0.96 #QF 0.96 assign (resid 17 and name HG1 ) (resid 18 and name HE* ) 3.92 2.12 2.12 !peak 3458 #SUP 1.00 assign (resid 17 and name HG1 ) (resid 18 and name HN ) 3.82 2.02 2.02 !peak 3459 #SUP 1.00 assign (resid 2 and name HB* ) (resid 3 and name HN ) 3.12 1.32 1.32 !peak 3141 assign (resid 2 and name HB* ) (resid 4 and name HN ) 3.09 1.29 1.29 !peak 22 assign (resid 2 and name HB* ) (resid 4 and name HG* ) 3.12 1.32 1.32 !peak 3146 assign (resid 2 and name HB* ) (resid 5 and name HB2 ) 2.91 1.11 1.11 !peak 1173 assign (resid 2 and name HB* ) (resid 5 and name HG* ) 4.13 2.33 2.33 !peak 2764 assign (resid 2 and name HB* ) (resid 5 and name HD* ) 3.53 1.73 1.73 !peak 2472 assign (resid 3 and name HN ) (resid 4 and name HG* ) 3.41 1.61 1.61 !peak 11 assign (resid 3 and name HB ) (resid 4 and name HG* ) 4.03 2.23 2.23 !peak 2097 assign (resid 3 and name HG1* ) (resid 7 and name HG* ) 3.27 1.47 1.47 !peak 1845 assign (resid 3 and name HG2* ) (resid 7 and name HG* ) 2.91 1.11 1.11 !peak 1257 assign (resid 4 and name HN ) (resid 4 and name HG* ) 2.48 0.68 0.68 !peak 35 assign (resid 4 and name HN ) (resid 39 and name HD* ) 4.30 2.50 2.50 !peak 34 assign (resid 4 and name HA ) (resid 4 and name HG* ) 2.45 0.65 0.65 !peak 286 assign (resid 4 and name HA ) (resid 7 and name HG* ) 3.23 1.43 1.43 !peak 2008 assign (resid 4 and name HA ) (resid 8 and name HD* ) 3.57 1.77 1.77 !peak 2812 assign (resid 4 and name HA ) (resid 39 and name HD* ) 3.10 1.30 1.30 !peak 1100 assign (resid 4 and name HB ) (resid 8 and name HD* ) 4.05 2.25 2.25 !peak 3225 assign (resid 4 and name HB ) (resid 39 and name HD* ) 3.30 1.50 1.50 !peak 1159 assign (resid 4 and name HG* ) (resid 5 and name HN ) 2.68 0.88 0.88 !peak 66 assign (resid 4 and name HG* ) (resid 5 and name HA ) 3.03 1.23 1.23 !peak 954 assign (resid 4 and name HG* ) (resid 5 and name HB2 ) 2.96 1.16 1.16 !peak 1061 assign (resid 4 and name HG* ) (resid 6 and name HN ) 3.73 1.93 1.93 !peak 81 assign (resid 4 and name HG* ) (resid 7 and name HN ) 3.50 1.70 1.70 !peak 97 assign (resid 4 and name HG* ) (resid 7 and name HB2 ) 3.51 1.71 1.71 !peak 3203 assign (resid 4 and name HG* ) (resid 7 and name HD2 ) 3.47 1.67 1.67 !peak 3204 assign (resid 4 and name HG* ) (resid 7 and name HD1 ) 3.62 1.82 1.82 !peak 2595 assign (resid 4 and name HG* ) (resid 7 and name HE* ) 3.68 1.88 1.88 !peak 2325 assign (resid 4 and name HG* ) (resid 8 and name HN ) 3.27 1.47 1.47 !peak 1911 assign (resid 4 and name HG* ) (resid 8 and name HA ) 4.30 2.50 2.50 !peak 3148 assign (resid 4 and name HG* ) (resid 8 and name HG ) 3.17 1.37 1.37 !peak 982 assign (resid 4 and name HG* ) (resid 33 and name HN ) 4.26 2.46 2.46 !peak 2945 assign (resid 4 and name HG* ) (resid 33 and name HA ) 3.58 1.78 1.78 !peak 2490 assign (resid 4 and name HG* ) (resid 33 and name HB* ) 3.46 1.66 1.66 !peak 1630 assign (resid 4 and name HG* ) (resid 37 and name HA ) 3.88 2.08 2.08 !peak 2103 assign (resid 4 and name HG* ) (resid 38 and name HN ) 3.25 1.45 1.45 !peak 1734 assign (resid 4 and name HG* ) (resid 38 and name HA ) 2.71 0.91 0.91 !peak 578 assign (resid 4 and name HG* ) (resid 38 and name HB* ) 3.34 1.54 1.54 !peak 2354 assign (resid 4 and name HG* ) (resid 39 and name HN ) 2.99 1.19 1.19 !peak 1465 assign (resid 4 and name HG* ) (resid 39 and name HA ) 2.58 0.78 0.78 !peak 484 assign (resid 4 and name HG* ) (resid 39 and name HB2 ) 2.98 1.18 1.18 !peak 1131 assign (resid 4 and name HG* ) (resid 39 and name HD* ) 2.64 0.84 0.84 !peak 176 assign (resid 4 and name HG* ) (resid 40 and name HN ) 4.30 2.50 2.50 !peak 2138 assign (resid 4 and name HG* ) (resid 42 and name HN ) 3.33 1.53 1.53 !peak 900 assign (resid 4 and name HG* ) (resid 42 and name HA ) 3.20 1.40 1.40 !peak 788 assign (resid 4 and name HG* ) (resid 42 and name HB* ) 2.47 0.67 0.67 !peak 3044 assign (resid 5 and name HN ) (resid 5 and name HG* ) 3.45 1.65 1.65 !peak 62 assign (resid 5 and name HN ) (resid 8 and name HD* ) 4.30 2.50 2.50 !peak 2865 assign (resid 5 and name HN ) (resid 33 and name HB* ) 3.67 1.87 1.87 !peak 1051 assign (resid 5 and name HA ) (resid 8 and name HD* ) 2.76 0.96 0.96 !peak 645 assign (resid 5 and name HA ) (resid 9 and name HG* ) 3.26 1.46 1.46 !peak 3153 assign (resid 5 and name HB2 ) (resid 33 and name HB* ) 3.92 2.12 2.12 !peak 1987 assign (resid 5 and name HB1 ) (resid 9 and name HG* ) 3.86 2.06 2.06 !peak 2198 assign (resid 5 and name HG* ) (resid 6 and name HN ) 3.22 1.42 1.42 !peak 1856 assign (resid 5 and name HG* ) (resid 6 and name HA ) 4.24 2.44 2.44 !peak 2764 assign (resid 5 and name HG* ) (resid 7 and name HN ) 4.07 2.27 2.27 !peak 95 assign (resid 5 and name HG* ) (resid 9 and name HN ) 3.58 1.78 1.78 !peak 3157 assign (resid 5 and name HG* ) (resid 9 and name HB* ) 3.71 1.91 1.91 !peak 2022 assign (resid 5 and name HG* ) (resid 9 and name HG* ) 2.90 1.10 1.10 !peak 1549 assign (resid 5 and name HG* ) (resid 33 and name HB* ) 3.26 1.46 1.46 !peak 2192 assign (resid 5 and name HD* ) (resid 9 and name HG* ) 3.55 1.75 1.74 !peak 2660 assign (resid 5 and name HE* ) (resid 9 and name HG* ) 3.07 1.27 1.27 !peak 1777 assign (resid 5 and name HE* ) (resid 33 and name HB* ) 3.68 1.88 1.88 !peak 3176 assign (resid 6 and name HN ) (resid 6 and name HG* ) 2.84 1.04 1.04 !peak 928 assign (resid 6 and name HN ) (resid 7 and name HG* ) 3.68 1.88 1.88 !peak 77 assign (resid 6 and name HN ) (resid 8 and name HD* ) 4.30 2.50 2.50 !peak 3288 assign (resid 6 and name HA ) (resid 6 and name HG* ) 2.94 1.14 1.14 !peak 3188 assign (resid 6 and name HA ) (resid 9 and name HB* ) 3.61 1.81 1.81 !peak 1322 assign (resid 6 and name HB1 ) (resid 6 and name HG* ) 2.41 0.61 0.61 !peak 335 assign (resid 6 and name HG* ) (resid 7 and name HN ) 3.20 1.40 1.40 !peak 90 assign (resid 6 and name HG* ) (resid 7 and name HA ) 3.45 1.65 1.65 !peak 829 assign (resid 6 and name HG* ) (resid 7 and name HB1 ) 3.61 1.81 1.81 !peak 2695 assign (resid 7 and name HN ) (resid 7 and name HG* ) 2.68 0.88 0.88 !peak 94 assign (resid 7 and name HN ) (resid 39 and name HD* ) 4.22 2.42 2.42 !peak 2849 assign (resid 7 and name HA ) (resid 7 and name HG* ) 2.75 0.95 0.95 !peak 3192 assign (resid 7 and name HA ) (resid 8 and name HD* ) 3.82 2.02 2.02 !peak 3180 assign (resid 7 and name HB2 ) (resid 8 and name HD* ) 3.68 1.88 1.88 !peak 3203 assign (resid 7 and name HB1 ) (resid 8 and name HD* ) 3.46 1.66 1.66 !peak 1883 assign (resid 7 and name HG* ) (resid 7 and name HE* ) 2.66 0.86 0.86 !peak 3171 assign (resid 7 and name HG* ) (resid 8 and name HN ) 3.33 1.53 1.53 !peak 1046 assign (resid 7 and name HG* ) (resid 8 and name HD* ) 3.94 2.14 2.14 !peak 2386 assign (resid 7 and name HG* ) (resid 68 and name HD2* ) 3.45 1.65 1.65 !peak 3215 assign (resid 7 and name HD2 ) (resid 8 and name HD* ) 3.43 1.63 1.63 !peak 3226 assign (resid 7 and name HD2 ) (resid 39 and name HD* ) 4.06 2.26 2.26 !peak 1663 assign (resid 7 and name HE* ) (resid 39 and name HD* ) 3.07 1.27 1.27 !peak 3169 assign (resid 8 and name HN ) (resid 8 and name HD* ) 2.70 0.90 0.90 !peak 1050 assign (resid 8 and name HA ) (resid 8 and name HD* ) 2.49 0.69 0.69 !peak 275 assign (resid 8 and name HA ) (resid 12 and name HB* ) 4.01 2.21 2.20 !peak 2867 assign (resid 8 and name HA ) (resid 12 and name HD* ) 4.26 2.46 2.46 !peak 2940 assign (resid 8 and name HA ) (resid 64 and name HD* ) 3.11 1.31 1.31 !peak 3216 assign (resid 8 and name HB2 ) (resid 8 and name HD* ) 2.61 0.81 0.81 !peak 467 assign (resid 8 and name HB2 ) (resid 9 and name HG* ) 3.53 1.73 1.73 !peak 2481 assign (resid 8 and name HB1 ) (resid 8 and name HD* ) 2.61 0.81 0.81 !peak 604 assign (resid 8 and name HB1 ) (resid 9 and name HG* ) 3.59 1.79 1.79 !peak 2606 assign (resid 8 and name HD* ) (resid 9 and name HN ) 3.71 1.91 1.91 !peak 113 assign (resid 8 and name HD* ) (resid 9 and name HG* ) 3.89 2.09 2.09 !peak 2120 assign (resid 8 and name HD* ) (resid 10 and name HN ) 4.30 2.50 2.50 !peak 2671 assign (resid 8 and name HD* ) (resid 11 and name HN ) 3.97 2.17 2.17 !peak 2643 assign (resid 8 and name HD* ) (resid 11 and name HB* ) 3.30 1.50 1.50 !peak 2081 assign (resid 8 and name HD* ) (resid 29 and name HA ) 3.49 1.69 1.69 !peak 2365 assign (resid 8 and name HD* ) (resid 29 and name HG2* ) 3.14 1.34 1.34 !peak 3227 assign (resid 8 and name HD* ) (resid 33 and name HN ) 3.31 1.51 1.51 !peak 481 assign (resid 8 and name HD* ) (resid 33 and name HB* ) 3.11 1.31 1.31 !peak 1459 assign (resid 8 and name HD* ) (resid 34 and name HN ) 4.16 2.36 2.36 !peak 494 assign (resid 8 and name HD* ) (resid 42 and name HN ) 4.30 2.50 2.50 !peak 2865 assign (resid 8 and name HD* ) (resid 42 and name HA ) 4.25 2.45 2.45 !peak 1793 assign (resid 8 and name HD* ) (resid 42 and name HB* ) 2.58 0.78 0.78 !peak 473 assign (resid 8 and name HD* ) (resid 68 and name HG ) 3.20 1.40 1.40 !peak 793 assign (resid 8 and name HD* ) (resid 68 and name HD2* ) 2.34 0.54 0.54 !peak 170 assign (resid 9 and name HN ) (resid 9 and name HB* ) 2.69 0.89 0.89 !peak 106 assign (resid 9 and name HN ) (resid 10 and name HG* ) 4.05 2.25 2.25 !peak 110 assign (resid 9 and name HN ) (resid 12 and name HB* ) 4.17 2.37 2.37 !peak 108 assign (resid 9 and name HN ) (resid 12 and name HD* ) 4.30 2.50 2.50 !peak 113 assign (resid 9 and name HA ) (resid 9 and name HG* ) 2.72 0.92 0.92 !peak 737 assign (resid 9 and name HA ) (resid 12 and name HB* ) 2.81 1.01 1.01 !peak 770 assign (resid 9 and name HA ) (resid 12 and name HD* ) 2.75 0.95 0.95 !peak 617 assign (resid 9 and name HB* ) (resid 10 and name HN ) 2.71 0.91 0.91 !peak 616 assign (resid 9 and name HB* ) (resid 10 and name HA ) 3.79 1.99 1.99 !peak 1322 assign (resid 9 and name HB* ) (resid 12 and name HN ) 4.24 2.44 2.44 !peak 154 assign (resid 9 and name HB* ) (resid 13 and name HD1* ) 3.07 1.27 1.27 !peak 1813 assign (resid 9 and name HG* ) (resid 10 and name HN ) 3.31 1.51 1.51 !peak 1994 assign (resid 9 and name HG* ) (resid 11 and name HN ) 4.24 2.44 2.44 !peak 137 assign (resid 9 and name HG* ) (resid 12 and name HN ) 4.24 2.44 2.44 !peak 154 assign (resid 9 and name HG* ) (resid 12 and name HD* ) 4.06 2.26 2.26 !peak 2120 assign (resid 9 and name HG* ) (resid 29 and name HG1* ) 3.11 1.31 1.31 !peak 1609 assign (resid 10 and name HN ) (resid 10 and name HG* ) 3.10 1.30 1.30 !peak 1420 assign (resid 10 and name HN ) (resid 12 and name HD* ) 4.30 2.50 2.50 !peak 128 assign (resid 10 and name HA ) (resid 10 and name HG* ) 2.75 0.95 0.95 !peak 525 assign (resid 10 and name HG* ) (resid 10 and name HE* ) 2.75 0.95 0.95 !peak 881 assign (resid 10 and name HG* ) (resid 11 and name HN ) 3.68 1.88 1.88 !peak 141 assign (resid 10 and name HG* ) (resid 14 and name HN ) 4.10 2.30 2.30 !peak 188 assign (resid 10 and name HG* ) (resid 14 and name HG2 ) 3.79 1.99 1.99 !peak 2017 assign (resid 10 and name HG* ) (resid 14 and name HG1 ) 4.02 2.22 2.22 !peak 1851 assign (resid 11 and name HN ) (resid 12 and name HB* ) 3.61 1.81 1.81 !peak 2689 assign (resid 11 and name HN ) (resid 64 and name HD* ) 3.42 1.62 1.62 !peak 144 assign (resid 11 and name HA ) (resid 64 and name HD* ) 3.43 1.63 1.63 !peak 1653 assign (resid 11 and name HB* ) (resid 12 and name HB* ) 3.67 1.87 1.87 !peak 1747 assign (resid 11 and name HB* ) (resid 64 and name HD* ) 2.42 0.62 0.62 !peak 218 assign (resid 12 and name HN ) (resid 12 and name HB* ) 2.51 0.71 0.71 !peak 156 assign (resid 12 and name HN ) (resid 64 and name HD* ) 2.99 1.19 1.19 !peak 158 assign (resid 12 and name HA ) (resid 12 and name HD* ) 2.75 0.95 0.95 !peak 3263 assign (resid 12 and name HA ) (resid 25 and name HD* ) 3.47 1.67 1.67 !peak 1897 assign (resid 12 and name HA ) (resid 64 and name HD* ) 3.60 1.80 1.80 !peak 864 assign (resid 12 and name HB* ) (resid 12 and name HD* ) 2.48 0.68 0.68 !peak 3249 assign (resid 12 and name HB* ) (resid 13 and name HN ) 2.77 0.97 0.97 !peak 169 assign (resid 12 and name HB* ) (resid 13 and name HG12 ) 4.24 2.44 2.44 !peak 2648 assign (resid 12 and name HB* ) (resid 15 and name HG2* ) 3.57 1.77 1.77 !peak 2561 assign (resid 12 and name HB* ) (resid 29 and name HG2* ) 3.61 1.81 1.81 !peak 1761 assign (resid 12 and name HB* ) (resid 64 and name HD* ) 3.98 2.18 2.18 !peak 3438 assign (resid 12 and name HG ) (resid 64 and name HD* ) 3.30 1.50 1.50 !peak 3439 assign (resid 12 and name HD* ) (resid 13 and name HG11 ) 3.68 1.88 1.88 !peak 2005 assign (resid 12 and name HD* ) (resid 22 and name HD* ) 3.28 1.48 1.48 !peak 1928 assign (resid 12 and name HD* ) (resid 22 and name HE* ) 2.92 1.12 1.12 !peak 3343 assign (resid 12 and name HD* ) (resid 25 and name HN ) 3.65 1.85 1.85 !peak 359 assign (resid 12 and name HD* ) (resid 25 and name HA ) 3.65 1.85 1.85 !peak 2679 assign (resid 12 and name HD* ) (resid 25 and name HB2 ) 3.42 1.62 1.62 !peak 2112 assign (resid 12 and name HD* ) (resid 25 and name HB1 ) 2.92 1.12 1.12 !peak 614 assign (resid 12 and name HD* ) (resid 25 and name HG ) 2.98 1.18 1.18 !peak 3259 assign (resid 12 and name HD* ) (resid 25 and name HD* ) 2.48 0.68 0.68 !peak 244 assign (resid 12 and name HD* ) (resid 26 and name HN ) 3.10 1.30 1.30 !peak 378 assign (resid 12 and name HD* ) (resid 26 and name HA ) 2.58 0.78 0.78 !peak 598 assign (resid 12 and name HD* ) (resid 26 and name HB2 ) 3.22 1.42 1.42 !peak 2038 assign (resid 12 and name HD* ) (resid 26 and name HB1 ) 3.47 1.67 1.67 !peak 3256 assign (resid 12 and name HD* ) (resid 26 and name HD2 ) 4.24 2.44 2.44 !peak 1620 assign (resid 12 and name HD* ) (resid 26 and name HE* ) 4.21 2.41 2.41 !peak 2418 assign (resid 12 and name HD* ) (resid 27 and name HN ) 4.07 2.27 2.27 !peak 392 assign (resid 12 and name HD* ) (resid 29 and name HN ) 3.32 1.52 1.52 !peak 2426 assign (resid 12 and name HD* ) (resid 29 and name HB ) 2.84 1.04 1.04 !peak 973 assign (resid 12 and name HD* ) (resid 29 and name HG1* ) 2.76 0.96 0.96 !peak 326 assign (resid 12 and name HD* ) (resid 29 and name HG2* ) 2.50 0.70 0.70 !peak 225 assign (resid 12 and name HD* ) (resid 30 and name HN ) 3.56 1.76 1.76 !peak 436 assign (resid 12 and name HD* ) (resid 64 and name HB* ) 3.90 2.10 2.10 !peak 1632 assign (resid 13 and name HA ) (resid 16 and name HD* ) 3.39 1.59 1.59 !peak 2670 assign (resid 13 and name HG2* ) (resid 16 and name HD* ) 3.39 1.59 1.59 !peak 2535 assign (resid 13 and name HG11 ) (resid 16 and name HD* ) 4.24 2.44 2.44 !peak 2400 assign (resid 15 and name HA ) (resid 17 and name HG* ) 3.96 2.16 2.16 !peak 2066 assign (resid 15 and name HG1* ) (resid 64 and name HB* ) 4.24 2.44 2.44 !peak 2943 assign (resid 15 and name HG2* ) (resid 64 and name HB* ) 3.32 1.52 1.51 !peak 2332 assign (resid 16 and name HN ) (resid 16 and name HG* ) 3.30 1.50 1.50 !peak 227 assign (resid 16 and name HN ) (resid 16 and name HD* ) 3.72 1.92 1.92 !peak 2866 assign (resid 16 and name HN ) (resid 17 and name HG* ) 3.44 1.64 1.64 !peak 223 assign (resid 16 and name HA ) (resid 16 and name HG* ) 2.79 0.99 0.99 !peak 997 assign (resid 16 and name HA ) (resid 16 and name HD* ) 3.26 1.46 1.46 !peak 2168 assign (resid 16 and name HB2 ) (resid 16 and name HD* ) 2.94 1.14 1.14 !peak 1406 assign (resid 16 and name HB1 ) (resid 16 and name HD* ) 2.95 1.15 1.15 !peak 1416 assign (resid 16 and name HB1 ) (resid 17 and name HG* ) 3.33 1.53 1.53 !peak 845 assign (resid 16 and name HG* ) (resid 17 and name HA ) 3.81 2.01 2.01 !peak 3372 assign (resid 16 and name HG* ) (resid 17 and name HD2 ) 3.70 1.90 1.90 !peak 3282 assign (resid 16 and name HG* ) (resid 17 and name HD1 ) 3.21 1.41 1.41 !peak 1804 assign (resid 16 and name HG* ) (resid 19 and name HN ) 4.18 2.38 2.38 !peak 259 assign (resid 16 and name HG* ) (resid 22 and name HB2 ) 3.94 2.14 2.14 !peak 3015 assign (resid 16 and name HG* ) (resid 22 and name HB1 ) 3.98 2.18 2.18 !peak 3016 assign (resid 16 and name HG* ) (resid 22 and name HD* ) 3.27 1.47 1.47 !peak 2084 assign (resid 16 and name HG* ) (resid 22 and name HE* ) 3.42 1.62 1.62 !peak 3345 assign (resid 16 and name HD* ) (resid 22 and name HD* ) 3.69 1.89 1.89 !peak 2922 assign (resid 16 and name HD* ) (resid 22 and name HE* ) 3.18 1.38 1.38 !peak 1906 assign (resid 17 and name HG* ) (resid 18 and name HN ) 3.38 1.58 1.58 !peak 242 assign (resid 17 and name HG* ) (resid 18 and name HD* ) 3.73 1.93 1.93 !peak 3455 assign (resid 17 and name HG* ) (resid 18 and name HE* ) 3.43 1.63 1.63 !peak 2522 assign (resid 19 and name HB ) (resid 25 and name HD* ) 3.29 1.49 1.49 !peak 1810 assign (resid 19 and name HB ) (resid 60 and name HB* ) 3.22 1.42 1.42 !peak 1815 assign (resid 19 and name HG1* ) (resid 25 and name HD* ) 3.06 1.26 1.26 !peak 556 assign (resid 19 and name HG1* ) (resid 60 and name HB* ) 3.07 1.27 1.27 !peak 1809 assign (resid 19 and name HG2* ) (resid 25 and name HD* ) 2.68 0.88 0.88 !peak 495 assign (resid 19 and name HG2* ) (resid 60 and name HB* ) 3.50 1.70 1.70 !peak 1524 assign (resid 20 and name HN ) (resid 60 and name HB* ) 3.74 1.94 1.94 !peak 266 assign (resid 20 and name HA ) (resid 20 and name HG* ) 2.76 0.96 0.96 !peak 736 assign (resid 20 and name HG* ) (resid 21 and name HN ) 3.07 1.27 1.27 !peak 1500 assign (resid 20 and name HG* ) (resid 21 and name HA ) 3.61 1.81 1.81 !peak 2715 assign (resid 20 and name HG* ) (resid 21 and name HD* ) 3.38 1.58 1.58 !peak 1784 assign (resid 20 and name HG* ) (resid 21 and name HE* ) 3.82 2.02 2.02 !peak 3328 assign (resid 20 and name HG* ) (resid 59 and name HG2* ) 4.24 2.44 2.44 !peak 3010 assign (resid 21 and name HA ) (resid 23 and name HB* ) 3.96 2.16 2.16 !peak 1617 assign (resid 21 and name HE* ) (resid 56 and name HB* ) 3.64 1.84 1.84 !peak 3327 assign (resid 21 and name HE* ) (resid 56 and name HD* ) 3.31 1.51 1.51 !peak 1912 assign (resid 22 and name HA ) (resid 25 and name HD* ) 3.52 1.72 1.72 !peak 1897 assign (resid 23 and name HN ) (resid 23 and name HB* ) 2.70 0.90 0.90 !peak 314 assign (resid 23 and name HN ) (resid 23 and name HD2* ) 3.30 1.50 1.50 !peak 1101 assign (resid 23 and name HA ) (resid 23 and name HD2* ) 3.49 1.69 1.69 !peak 1097 assign (resid 23 and name HB* ) (resid 23 and name HD2* ) 2.61 0.81 0.81 !peak 1095 assign (resid 23 and name HB* ) (resid 24 and name HN ) 2.87 1.07 1.07 !peak 327 assign (resid 23 and name HB* ) (resid 25 and name HN ) 4.24 2.44 2.44 !peak 348 assign (resid 24 and name HB2 ) (resid 25 and name HD* ) 3.99 2.19 2.19 !peak 3021 assign (resid 25 and name HN ) (resid 25 and name HD* ) 3.10 1.30 1.30 !peak 1772 assign (resid 25 and name HN ) (resid 28 and name HD* ) 4.30 2.50 2.50 !peak 2810 assign (resid 25 and name HA ) (resid 25 and name HD* ) 2.58 0.78 0.78 !peak 367 assign (resid 25 and name HD* ) (resid 26 and name HN ) 3.96 2.16 2.16 !peak 377 assign (resid 25 and name HD* ) (resid 29 and name HN ) 3.35 1.55 1.55 !peak 1944 assign (resid 25 and name HD* ) (resid 29 and name HA ) 4.20 2.40 2.40 !peak 3022 assign (resid 25 and name HD* ) (resid 29 and name HG2* ) 3.25 1.45 1.45 !peak 556 assign (resid 25 and name HD* ) (resid 57 and name HD* ) 3.80 2.00 2.00 !peak 3072 assign (resid 25 and name HD* ) (resid 57 and name HE* ) 3.07 1.27 1.27 !peak 1361 assign (resid 25 and name HD* ) (resid 57 and name HZ ) 3.11 1.31 1.31 !peak 1472 assign (resid 25 and name HD* ) (resid 58 and name HA ) 4.30 2.50 2.50 !peak 3022 assign (resid 25 and name HD* ) (resid 60 and name HN ) 3.71 1.91 1.91 !peak 872 assign (resid 25 and name HD* ) (resid 60 and name HB* ) 2.81 1.01 1.01 !peak 1525 assign (resid 25 and name HD* ) (resid 61 and name HN ) 3.18 1.38 1.38 !peak 890 assign (resid 25 and name HD* ) (resid 61 and name HA ) 2.71 0.91 0.91 !peak 631 assign (resid 25 and name HD* ) (resid 61 and name HB ) 3.75 1.95 1.95 !peak 2505 assign (resid 25 and name HD* ) (resid 61 and name HG2* ) 3.23 1.43 1.43 !peak 647 assign (resid 25 and name HD* ) (resid 61 and name HG12 ) 3.03 1.23 1.23 !peak 1251 assign (resid 25 and name HD* ) (resid 61 and name HG11 ) 3.12 1.32 1.32 !peak 1485 assign (resid 25 and name HD* ) (resid 61 and name HD1* ) 3.36 1.56 1.56 !peak 1685 assign (resid 25 and name HD* ) (resid 64 and name HN ) 3.57 1.77 1.77 !peak 927 assign (resid 28 and name HA ) (resid 28 and name HD* ) 2.51 0.71 0.71 !peak 297 assign (resid 28 and name HB2 ) (resid 28 and name HD* ) 2.50 0.70 0.70 !peak 421 assign (resid 28 and name HB1 ) (resid 28 and name HD* ) 2.67 0.87 0.87 !peak 485 assign (resid 28 and name HG ) (resid 45 and name HG* ) 4.10 2.30 2.30 !peak 2214 assign (resid 28 and name HG ) (resid 46 and name HD* ) 3.10 1.30 1.30 !peak 876 assign (resid 28 and name HD* ) (resid 31 and name HN ) 3.48 1.68 1.68 !peak 455 assign (resid 28 and name HD* ) (resid 31 and name HB2 ) 3.56 1.76 1.76 !peak 971 assign (resid 28 and name HD* ) (resid 31 and name HB1 ) 3.16 1.36 1.36 !peak 1567 assign (resid 28 and name HD* ) (resid 31 and name HD2 ) 3.12 1.32 1.32 !peak 1002 assign (resid 28 and name HD* ) (resid 31 and name HD1 ) 3.04 1.24 1.24 !peak 1279 assign (resid 28 and name HD* ) (resid 32 and name HN ) 3.14 1.34 1.34 !peak 593 assign (resid 28 and name HD* ) (resid 32 and name HA ) 3.56 1.76 1.76 !peak 2436 assign (resid 28 and name HD* ) (resid 32 and name HB ) 3.48 1.68 1.68 !peak 1645 assign (resid 28 and name HD* ) (resid 32 and name HG2* ) 2.53 0.73 0.73 !peak 159 assign (resid 28 and name HD* ) (resid 32 and name HG12 ) 3.26 1.46 1.46 !peak 1190 assign (resid 28 and name HD* ) (resid 32 and name HD1* ) 2.81 1.01 1.01 !peak 522 assign (resid 28 and name HD* ) (resid 33 and name HN ) 4.08 2.28 2.28 !peak 2492 assign (resid 28 and name HD* ) (resid 46 and name HA ) 3.37 1.57 1.57 !peak 2568 assign (resid 28 and name HD* ) (resid 46 and name HD* ) 2.70 0.90 0.90 !peak 386 assign (resid 28 and name HD* ) (resid 49 and name HN ) 4.30 2.50 2.50 !peak 2810 assign (resid 28 and name HD* ) (resid 49 and name HA ) 3.77 1.97 1.97 !peak 2204 assign (resid 28 and name HD* ) (resid 49 and name HB* ) 3.19 1.39 1.39 !peak 1917 assign (resid 28 and name HD* ) (resid 49 and name HG* ) 2.56 0.76 0.76 !peak 419 assign (resid 28 and name HD* ) (resid 50 and name HN ) 4.18 2.38 2.38 !peak 743 assign (resid 28 and name HD* ) (resid 57 and name HD* ) 4.26 2.46 2.46 !peak 2935 assign (resid 28 and name HD* ) (resid 57 and name HE* ) 3.05 1.25 1.25 !peak 1730 assign (resid 28 and name HD* ) (resid 57 and name HZ ) 2.95 1.15 1.15 !peak 1241 assign (resid 28 and name HD* ) (resid 61 and name HG12 ) 3.04 1.24 1.24 !peak 1423 assign (resid 28 and name HD* ) (resid 61 and name HD1* ) 2.71 0.91 0.91 !peak 589 assign (resid 29 and name HN ) (resid 64 and name HD* ) 3.75 1.95 1.95 !peak 2960 assign (resid 29 and name HA ) (resid 46 and name HD* ) 3.35 1.55 1.55 !peak 1956 assign (resid 29 and name HG1* ) (resid 33 and name HB* ) 3.13 1.33 1.33 !peak 1671 assign (resid 29 and name HG2* ) (resid 46 and name HD* ) 3.09 1.29 1.29 !peak 3258 assign (resid 29 and name HG2* ) (resid 64 and name HD* ) 2.65 0.85 0.85 !peak 468 assign (resid 30 and name HA ) (resid 33 and name HB* ) 3.48 1.68 1.68 !peak 2329 assign (resid 32 and name HA ) (resid 45 and name HG* ) 3.30 1.50 1.50 !peak 1836 assign (resid 32 and name HB ) (resid 45 and name HG* ) 2.88 1.08 1.08 !peak 1111 assign (resid 32 and name HG2* ) (resid 45 and name HG* ) 3.07 1.27 1.27 !peak 504 assign (resid 32 and name HG2* ) (resid 49 and name HB* ) 3.72 1.92 1.92 !peak 1034 assign (resid 32 and name HG2* ) (resid 49 and name HG* ) 3.16 1.36 1.36 !peak 1885 assign (resid 32 and name HG12 ) (resid 33 and name HB* ) 4.18 2.38 2.38 !peak 1987 assign (resid 32 and name HD1* ) (resid 45 and name HG* ) 2.65 0.85 0.85 !peak 376 assign (resid 32 and name HD1* ) (resid 49 and name HG* ) 3.25 1.45 1.45 !peak 1319 assign (resid 33 and name HN ) (resid 33 and name HB* ) 2.63 0.83 0.83 !peak 1070 assign (resid 34 and name HN ) (resid 34 and name HB* ) 2.61 0.81 0.81 !peak 491 assign (resid 34 and name HB* ) (resid 35 and name HN ) 3.42 1.62 1.62 !peak 1965 assign (resid 35 and name HN ) (resid 35 and name HB* ) 2.73 0.93 0.93 !peak 501 assign (resid 35 and name HB* ) (resid 36 and name HN ) 2.98 1.18 1.18 !peak 513 assign (resid 35 and name HB* ) (resid 36 and name HG1* ) 3.22 1.42 1.42 !peak 1756 assign (resid 35 and name HB* ) (resid 36 and name HG2* ) 3.61 1.81 1.81 !peak 2694 assign (resid 36 and name HN ) (resid 45 and name HG* ) 4.30 2.50 2.50 !peak 516 assign (resid 36 and name HA ) (resid 37 and name HB* ) 3.43 1.63 1.63 !peak 1886 assign (resid 36 and name HA ) (resid 41 and name HG* ) 3.19 1.39 1.39 !peak 1409 assign (resid 36 and name HB ) (resid 37 and name HB* ) 3.61 1.81 1.81 !peak 2279 assign (resid 36 and name HG1* ) (resid 41 and name HG* ) 3.23 1.43 1.43 !peak 856 assign (resid 37 and name HN ) (resid 37 and name HB* ) 2.60 0.80 0.80 !peak 527 assign (resid 37 and name HN ) (resid 41 and name HG* ) 3.46 1.66 1.66 !peak 529 assign (resid 37 and name HN ) (resid 45 and name HG* ) 4.30 2.50 2.50 !peak 2881 assign (resid 37 and name HB* ) (resid 37 and name HD21 ) 2.61 0.81 0.81 !peak 1116 assign (resid 37 and name HB* ) (resid 37 and name HD22 ) 2.83 1.03 1.03 !peak 1108 assign (resid 37 and name HB* ) (resid 38 and name HN ) 2.87 1.07 1.07 !peak 545 assign (resid 37 and name HB* ) (resid 38 and name HB* ) 3.50 1.70 1.70 !peak 1387 assign (resid 37 and name HB* ) (resid 41 and name HG* ) 3.27 1.47 1.47 !peak 1519 assign (resid 38 and name HN ) (resid 41 and name HG* ) 3.26 1.46 1.46 !peak 546 assign (resid 38 and name HB* ) (resid 39 and name HN ) 2.65 0.85 0.85 !peak 558 assign (resid 38 and name HB* ) (resid 39 and name HB2 ) 3.60 1.80 1.80 !peak 2669 assign (resid 38 and name HB* ) (resid 40 and name HN ) 2.99 1.19 1.19 !peak 1040 assign (resid 38 and name HB* ) (resid 41 and name HN ) 3.59 1.79 1.79 !peak 2617 assign (resid 39 and name HN ) (resid 39 and name HD* ) 3.36 1.56 1.56 !peak 565 assign (resid 39 and name HN ) (resid 40 and name HB* ) 3.69 1.89 1.89 !peak 560 assign (resid 39 and name HA ) (resid 39 and name HD* ) 2.57 0.77 0.77 !peak 279 assign (resid 39 and name HB1 ) (resid 39 and name HD* ) 2.56 0.76 0.76 !peak 353 assign (resid 39 and name HB1 ) (resid 40 and name HB* ) 3.71 1.91 1.91 !peak 1640 assign (resid 39 and name HD* ) (resid 40 and name HN ) 3.12 1.32 1.32 !peak 1049 assign (resid 39 and name HD* ) (resid 40 and name HA ) 3.48 1.68 1.68 !peak 1496 assign (resid 39 and name HD* ) (resid 41 and name HN ) 4.30 2.50 2.50 !peak 594 assign (resid 39 and name HD* ) (resid 42 and name HN ) 3.33 1.53 1.53 !peak 1900 assign (resid 39 and name HD* ) (resid 42 and name HB* ) 2.71 0.91 0.91 !peak 3039 assign (resid 39 and name HD* ) (resid 43 and name HN ) 2.98 1.18 1.18 !peak 628 assign (resid 39 and name HD* ) (resid 43 and name HG1* ) 2.73 0.93 0.93 !peak 319 assign (resid 39 and name HD* ) (resid 43 and name HD1* ) 2.54 0.74 0.74 !peak 192 assign (resid 40 and name HN ) (resid 40 and name HB* ) 2.52 0.72 0.72 !peak 1043 assign (resid 40 and name HN ) (resid 40 and name HG* ) 2.72 0.92 0.92 !peak 1042 assign (resid 40 and name HA ) (resid 40 and name HG* ) 2.76 0.96 0.96 !peak 695 assign (resid 40 and name HA ) (resid 43 and name HG1* ) 4.18 2.38 2.38 !peak 2896 assign (resid 40 and name HB* ) (resid 40 and name HG* ) 2.25 0.45 0.45 !peak 307 assign (resid 40 and name HB* ) (resid 41 and name HG* ) 3.67 1.87 1.87 !peak 3037 assign (resid 40 and name HB* ) (resid 42 and name HN ) 4.24 2.44 2.44 !peak 1077 assign (resid 40 and name HB* ) (resid 44 and name HG* ) 3.61 1.81 1.81 !peak 2761 assign (resid 40 and name HG* ) (resid 43 and name HD1* ) 3.90 2.10 2.10 !peak 1961 assign (resid 41 and name HN ) (resid 41 and name HG* ) 2.83 1.03 1.03 !peak 582 assign (resid 41 and name HN ) (resid 44 and name HG* ) 3.43 1.63 1.63 !peak 2139 assign (resid 41 and name HA ) (resid 41 and name HG* ) 2.83 1.03 1.03 !peak 1072 assign (resid 41 and name HA ) (resid 44 and name HG* ) 2.69 0.89 0.89 !peak 571 assign (resid 41 and name HB1 ) (resid 44 and name HG* ) 3.36 1.56 1.56 !peak 1959 assign (resid 41 and name HG* ) (resid 42 and name HN ) 3.72 1.92 1.92 !peak 606 assign (resid 41 and name HG* ) (resid 44 and name HG* ) 3.42 1.62 1.62 !peak 2249 assign (resid 42 and name HN ) (resid 43 and name HG1* ) 4.11 2.31 2.31 !peak 2716 assign (resid 42 and name HN ) (resid 44 and name HG* ) 3.91 2.11 2.11 !peak 2729 assign (resid 42 and name HN ) (resid 45 and name HG* ) 4.09 2.29 2.29 !peak 2729 assign (resid 42 and name HA ) (resid 45 and name HG* ) 2.99 1.19 1.19 !peak 1148 assign (resid 42 and name HB* ) (resid 43 and name HG1* ) 3.64 1.84 1.84 !peak 2334 assign (resid 42 and name HB* ) (resid 45 and name HG* ) 3.37 1.57 1.57 !peak 2093 assign (resid 42 and name HB* ) (resid 46 and name HD* ) 3.10 1.30 1.30 !peak 723 assign (resid 43 and name HN ) (resid 43 and name HG1* ) 2.72 0.92 0.92 !peak 625 assign (resid 43 and name HN ) (resid 44 and name HG* ) 3.35 1.55 1.55 !peak 1949 assign (resid 43 and name HN ) (resid 45 and name HG* ) 3.92 2.12 2.12 !peak 627 assign (resid 43 and name HN ) (resid 46 and name HD* ) 3.56 1.76 1.76 !peak 2437 assign (resid 43 and name HA ) (resid 46 and name HD* ) 2.88 1.08 1.08 !peak 871 assign (resid 43 and name HA ) (resid 65 and name HD* ) 2.73 0.93 0.93 !peak 567 assign (resid 43 and name HB ) (resid 44 and name HG* ) 3.40 1.60 1.60 !peak 2065 assign (resid 43 and name HG2* ) (resid 43 and name HG1* ) 2.81 1.01 1.01 !peak 899 assign (resid 43 and name HG2* ) (resid 47 and name HD* ) 3.01 1.21 1.21 !peak 1615 assign (resid 43 and name HG2* ) (resid 69 and name HG* ) 3.27 1.47 1.47 !peak 1850 assign (resid 43 and name HG1* ) (resid 44 and name HN ) 3.63 1.83 1.83 !peak 640 assign (resid 43 and name HG1* ) (resid 46 and name HD* ) 3.29 1.49 1.49 !peak 1801 assign (resid 43 and name HG1* ) (resid 68 and name HB2 ) 3.61 1.81 1.81 !peak 2280 assign (resid 43 and name HG1* ) (resid 68 and name HD1* ) 3.51 1.71 1.71 !peak 1801 assign (resid 43 and name HG1* ) (resid 69 and name HG* ) 3.80 2.00 2.00 !peak 1938 assign (resid 43 and name HD1* ) (resid 69 and name HG* ) 2.99 1.19 1.19 !peak 1505 assign (resid 44 and name HN ) (resid 44 and name HG* ) 2.44 0.64 0.64 !peak 246 assign (resid 44 and name HA ) (resid 44 and name HG* ) 2.54 0.74 0.74 !peak 451 assign (resid 44 and name HA ) (resid 47 and name HD* ) 2.97 1.17 1.17 !peak 1476 assign (resid 44 and name HA ) (resid 65 and name HD* ) 4.30 2.50 2.50 !peak 2663 assign (resid 44 and name HG* ) (resid 45 and name HN ) 3.12 1.32 1.32 !peak 866 assign (resid 44 and name HG* ) (resid 45 and name HA ) 3.22 1.42 1.42 !peak 1680 assign (resid 44 and name HG* ) (resid 46 and name HN ) 4.11 2.31 2.31 !peak 2270 assign (resid 44 and name HG* ) (resid 47 and name HN ) 4.26 2.46 2.46 !peak 2270 assign (resid 44 and name HG* ) (resid 47 and name HD* ) 3.44 1.64 1.64 !peak 2217 assign (resid 44 and name HG* ) (resid 48 and name HN ) 3.52 1.72 1.72 !peak 65 assign (resid 44 and name HG* ) (resid 48 and name HA ) 4.30 2.50 2.50 !peak 2479 assign (resid 44 and name HG* ) (resid 48 and name HB2 ) 3.86 2.06 2.06 !peak 2056 assign (resid 44 and name HG* ) (resid 48 and name HB1 ) 3.76 1.96 1.96 !peak 2036 assign (resid 45 and name HN ) (resid 45 and name HG* ) 2.50 0.70 0.70 !peak 660 assign (resid 45 and name HN ) (resid 65 and name HD* ) 4.22 2.42 2.42 !peak 2828 assign (resid 45 and name HA ) (resid 45 and name HG* ) 2.49 0.69 0.69 !peak 402 assign (resid 45 and name HG* ) (resid 46 and name HN ) 2.84 1.04 1.04 !peak 681 assign (resid 45 and name HG* ) (resid 46 and name HG ) 3.91 2.11 2.11 !peak 2470 assign (resid 45 and name HG* ) (resid 48 and name HN ) 3.73 1.93 1.93 !peak 65 assign (resid 45 and name HG* ) (resid 48 and name HG1 ) 3.14 1.34 1.34 !peak 1527 assign (resid 45 and name HG* ) (resid 49 and name HN ) 3.32 1.52 1.52 !peak 723 assign (resid 45 and name HG* ) (resid 49 and name HG* ) 2.87 1.07 1.07 !peak 1230 assign (resid 45 and name HG* ) (resid 50 and name HN ) 4.30 2.50 2.50 !peak 742 assign (resid 46 and name HN ) (resid 46 and name HD* ) 2.88 1.08 1.08 !peak 1378 assign (resid 46 and name HN ) (resid 65 and name HD* ) 3.46 1.66 1.66 !peak 682 assign (resid 46 and name HA ) (resid 46 and name HD* ) 2.49 0.69 0.69 !peak 263 assign (resid 46 and name HA ) (resid 49 and name HB* ) 3.25 1.45 1.45 !peak 1796 assign (resid 46 and name HA ) (resid 49 and name HG* ) 3.09 1.29 1.28 !peak 1780 assign (resid 46 and name HB2 ) (resid 46 and name HD* ) 2.67 0.87 0.87 !peak 562 assign (resid 46 and name HB2 ) (resid 65 and name HD* ) 2.75 0.95 0.95 !peak 880 assign (resid 46 and name HB1 ) (resid 65 and name HB* ) 3.27 1.47 1.47 !peak 2246 assign (resid 46 and name HB1 ) (resid 65 and name HD* ) 2.69 0.89 0.89 !peak 771 assign (resid 46 and name HG ) (resid 65 and name HD* ) 3.56 1.76 1.76 !peak 1781 assign (resid 46 and name HD* ) (resid 49 and name HN ) 4.01 2.21 2.20 !peak 725 assign (resid 46 and name HD* ) (resid 49 and name HG* ) 3.44 1.64 1.64 !peak 3262 assign (resid 46 and name HD* ) (resid 61 and name HA ) 3.61 1.81 1.81 !peak 2559 assign (resid 46 and name HD* ) (resid 61 and name HG12 ) 3.65 1.85 1.85 !peak 2680 assign (resid 46 and name HD* ) (resid 61 and name HD1* ) 3.44 1.64 1.64 !peak 1808 assign (resid 46 and name HD* ) (resid 64 and name HB* ) 3.50 1.70 1.70 !peak 3048 assign (resid 46 and name HD* ) (resid 65 and name HN ) 3.67 1.87 1.87 !peak 2722 assign (resid 46 and name HD* ) (resid 65 and name HA ) 2.96 1.16 1.16 !peak 1079 assign (resid 46 and name HD* ) (resid 65 and name HB* ) 2.99 1.19 1.19 !peak 723 assign (resid 46 and name HD1* ) (resid 65 and name HB2 ) 4.36 2.56 2.56 !peak 723 assign (resid 46 and name HD2* ) (resid 65 and name HB2 ) 4.36 2.56 2.56 !peak 723 assign (resid 46 and name HD* ) (resid 65 and name HD* ) 2.57 0.77 0.77 !peak 343 assign (resid 46 and name HD* ) (resid 68 and name HB2 ) 3.59 1.79 1.79 !peak 2085 assign (resid 46 and name HD* ) (resid 68 and name HG ) 3.79 1.99 1.99 !peak 2085 assign (resid 47 and name HN ) (resid 47 and name HD* ) 3.18 1.38 1.38 !peak 692 assign (resid 47 and name HN ) (resid 65 and name HD* ) 2.88 1.08 1.08 !peak 701 assign (resid 47 and name HA ) (resid 47 and name HD* ) 3.35 1.55 1.55 !peak 1992 assign (resid 47 and name HA ) (resid 51 and name HG* ) 3.67 1.87 1.87 !peak 2846 assign (resid 47 and name HA ) (resid 65 and name HD* ) 2.76 0.96 0.96 !peak 636 assign (resid 47 and name HB2 ) (resid 65 and name HD* ) 3.53 1.73 1.73 !peak 2360 assign (resid 47 and name HB1 ) (resid 47 and name HD* ) 2.85 1.05 1.05 !peak 1147 assign (resid 47 and name HB1 ) (resid 65 and name HD* ) 3.53 1.73 1.73 !peak 2356 assign (resid 47 and name HG2 ) (resid 65 and name HD* ) 2.92 1.12 1.12 !peak 1224 assign (resid 47 and name HG1 ) (resid 65 and name HD* ) 3.17 1.37 1.37 !peak 836 assign (resid 47 and name HD* ) (resid 65 and name HD* ) 3.21 1.41 1.41 !peak 2275 assign (resid 48 and name HN ) (resid 49 and name HG* ) 3.62 1.82 1.82 !peak 704 assign (resid 48 and name HN ) (resid 51 and name HG* ) 4.11 2.31 2.31 !peak 705 assign (resid 48 and name HN ) (resid 65 and name HD* ) 3.80 2.00 2.00 !peak 707 assign (resid 48 and name HA ) (resid 51 and name HG* ) 3.65 1.85 1.85 !peak 2363 assign (resid 48 and name HB2 ) (resid 52 and name HG* ) 4.14 2.34 2.34 !peak 2263 assign (resid 48 and name HG2 ) (resid 52 and name HD* ) 4.24 2.44 2.44 !peak 1851 assign (resid 48 and name HG1 ) (resid 52 and name HG* ) 3.61 1.81 1.81 !peak 2723 assign (resid 48 and name HG1 ) (resid 52 and name HD* ) 3.53 1.73 1.73 !peak 2114 assign (resid 49 and name HN ) (resid 49 and name HB* ) 3.00 1.20 1.20 !peak 1627 assign (resid 49 and name HN ) (resid 49 and name HG* ) 2.71 0.91 0.91 !peak 717 assign (resid 49 and name HN ) (resid 51 and name HG* ) 4.24 2.44 2.44 !peak 721 assign (resid 49 and name HN ) (resid 52 and name HG* ) 4.04 2.24 2.24 !peak 722 assign (resid 49 and name HN ) (resid 52 and name HD* ) 4.24 2.44 2.44 !peak 721 assign (resid 49 and name HA ) (resid 49 and name HG* ) 2.95 1.15 1.15 !peak 1402 assign (resid 49 and name HA ) (resid 52 and name HB* ) 3.68 1.88 1.88 !peak 1596 assign (resid 49 and name HA ) (resid 52 and name HG* ) 3.03 1.23 1.23 !peak 677 assign (resid 49 and name HA ) (resid 52 and name HD* ) 3.03 1.23 1.23 !peak 1260 assign (resid 49 and name HB* ) (resid 50 and name HN ) 2.84 1.04 1.04 !peak 737 assign (resid 49 and name HB* ) (resid 52 and name HN ) 3.92 2.12 2.12 !peak 787 assign (resid 49 and name HB* ) (resid 52 and name HD* ) 4.13 2.33 2.33 !peak 2230 assign (resid 49 and name HB* ) (resid 53 and name HB* ) 3.59 1.79 1.79 !peak 3407 assign (resid 49 and name HB* ) (resid 61 and name HG2* ) 3.03 1.23 1.23 !peak 949 assign (resid 49 and name HB* ) (resid 61 and name HD1* ) 2.75 0.95 0.95 !peak 897 assign (resid 49 and name HG* ) (resid 50 and name HN ) 3.68 1.88 1.88 !peak 735 assign (resid 49 and name HG* ) (resid 52 and name HD* ) 4.13 2.33 2.33 !peak 2230 assign (resid 49 and name HG* ) (resid 53 and name HB* ) 4.24 2.44 2.44 !peak 2241 assign (resid 50 and name HN ) (resid 51 and name HG* ) 3.55 1.75 1.74 !peak 739 assign (resid 50 and name HN ) (resid 52 and name HG* ) 4.24 2.44 2.44 !peak 740 assign (resid 50 and name HA ) (resid 50 and name HG* ) 2.78 0.98 0.98 !peak 1075 assign (resid 50 and name HA ) (resid 58 and name HG* ) 3.26 1.46 1.46 !peak 1968 assign (resid 50 and name HA ) (resid 58 and name HD* ) 3.69 1.89 1.89 !peak 1968 assign (resid 50 and name HB2 ) (resid 58 and name HG* ) 3.31 1.51 1.51 !peak 2337 assign (resid 50 and name HB2 ) (resid 58 and name HD* ) 4.24 2.44 2.44 !peak 1343 assign (resid 50 and name HB1 ) (resid 51 and name HG* ) 3.36 1.56 1.56 !peak 1832 assign (resid 50 and name HB1 ) (resid 58 and name HG* ) 3.99 2.19 2.19 !peak 1876 assign (resid 50 and name HB1 ) (resid 58 and name HD* ) 4.14 2.34 2.34 !peak 1876 assign (resid 50 and name HB1 ) (resid 65 and name HD* ) 3.86 2.06 2.06 !peak 2057 assign (resid 50 and name HG* ) (resid 51 and name HN ) 3.30 1.50 1.50 !peak 760 assign (resid 50 and name HG* ) (resid 51 and name HA ) 3.45 1.65 1.65 !peak 2268 assign (resid 50 and name HG* ) (resid 52 and name HN ) 4.24 2.44 2.44 !peak 788 assign (resid 50 and name HG* ) (resid 53 and name HN ) 3.94 2.14 2.14 !peak 802 assign (resid 50 and name HG* ) (resid 53 and name HB* ) 4.24 2.44 2.44 !peak 2241 assign (resid 50 and name HG* ) (resid 58 and name HA ) 3.75 1.95 1.95 !peak 2609 assign (resid 50 and name HG* ) (resid 58 and name HG* ) 2.88 1.08 1.08 !peak 1771 assign (resid 50 and name HG* ) (resid 58 and name HD* ) 2.85 1.05 1.05 !peak 1454 assign (resid 50 and name HG* ) (resid 58 and name HE* ) 3.23 1.43 1.43 !peak 2610 assign (resid 50 and name HG* ) (resid 61 and name HB ) 3.29 1.49 1.49 !peak 2188 assign (resid 50 and name HG* ) (resid 61 and name HG2* ) 2.86 1.06 1.06 !peak 962 assign (resid 50 and name HG* ) (resid 61 and name HD1* ) 3.17 1.37 1.37 !peak 3434 assign (resid 50 and name HG* ) (resid 62 and name HN ) 3.52 1.72 1.72 !peak 2430 assign (resid 51 and name HN ) (resid 51 and name HG* ) 2.65 0.85 0.85 !peak 763 assign (resid 51 and name HA ) (resid 51 and name HG* ) 2.69 0.89 0.89 !peak 800 assign (resid 51 and name HB2 ) (resid 52 and name HG* ) 3.43 1.63 1.63 !peak 1635 assign (resid 51 and name HG* ) (resid 52 and name HN ) 3.68 1.88 1.88 !peak 790 assign (resid 52 and name HN ) (resid 52 and name HB* ) 2.70 0.90 0.90 !peak 789 assign (resid 52 and name HN ) (resid 52 and name HG* ) 2.68 0.88 0.88 !peak 791 assign (resid 52 and name HN ) (resid 52 and name HD* ) 3.93 2.13 2.13 !peak 790 assign (resid 52 and name HA ) (resid 52 and name HG* ) 3.04 1.24 1.24 !peak 1101 assign (resid 52 and name HB* ) (resid 52 and name HE* ) 3.18 1.38 1.38 !peak 1811 assign (resid 52 and name HB* ) (resid 53 and name HN ) 3.24 1.44 1.44 !peak 1783 assign (resid 52 and name HG* ) (resid 52 and name HE* ) 2.95 1.15 1.15 !peak 1049 assign (resid 52 and name HG* ) (resid 53 and name HN ) 3.29 1.49 1.49 !peak 805 assign (resid 52 and name HD* ) (resid 53 and name HN ) 3.73 1.93 1.93 !peak 804 assign (resid 53 and name HN ) (resid 58 and name HG* ) 3.71 1.91 1.91 !peak 807 assign (resid 53 and name HA ) (resid 54 and name HB* ) 3.62 1.82 1.82 !peak 2290 assign (resid 53 and name HB* ) (resid 58 and name HG* ) 2.92 1.12 1.12 !peak 1094 assign (resid 53 and name HB* ) (resid 58 and name HD* ) 3.93 2.13 2.13 !peak 3406 assign (resid 54 and name HN ) (resid 54 and name HB* ) 2.78 0.98 0.98 !peak 966 assign (resid 54 and name HA ) (resid 55 and name HG* ) 3.55 1.75 1.74 !peak 2795 assign (resid 54 and name HA ) (resid 58 and name HD* ) 3.15 1.35 1.35 !peak 1866 assign (resid 54 and name HA ) (resid 58 and name HE* ) 3.11 1.31 1.31 !peak 1701 assign (resid 55 and name HN ) (resid 55 and name HG* ) 2.75 0.95 0.95 !peak 819 assign (resid 55 and name HN ) (resid 58 and name HD* ) 3.68 1.88 1.88 !peak 822 assign (resid 55 and name HN ) (resid 58 and name HE* ) 3.80 2.00 2.00 !peak 817 assign (resid 55 and name HB2 ) (resid 56 and name HD* ) 3.73 1.93 1.93 !peak 3068 assign (resid 55 and name HB1 ) (resid 56 and name HD* ) 3.98 2.18 2.18 !peak 3069 assign (resid 55 and name HG* ) (resid 56 and name HA ) 3.42 1.62 1.62 !peak 2223 assign (resid 55 and name HG* ) (resid 58 and name HD* ) 3.42 1.62 1.62 !peak 2343 assign (resid 55 and name HG* ) (resid 59 and name HN ) 4.15 2.35 2.35 !peak 1119 assign (resid 56 and name HB* ) (resid 59 and name HN ) 4.24 2.44 2.44 !peak 1119 assign (resid 56 and name HB* ) (resid 59 and name HB ) 3.51 1.71 1.71 !peak 2398 assign (resid 56 and name HD* ) (resid 57 and name HN ) 3.14 1.34 1.34 !peak 832 assign (resid 57 and name HA ) (resid 60 and name HB* ) 3.26 1.46 1.46 !peak 1862 assign (resid 58 and name HN ) (resid 58 and name HG* ) 3.38 1.58 1.58 !peak 2583 assign (resid 58 and name HN ) (resid 58 and name HD* ) 3.68 1.88 1.88 !peak 852 assign (resid 58 and name HN ) (resid 58 and name HE* ) 3.91 2.11 2.11 !peak 849 assign (resid 58 and name HA ) (resid 58 and name HG* ) 2.88 1.08 1.08 !peak 1284 assign (resid 58 and name HA ) (resid 58 and name HD* ) 3.40 1.60 1.60 !peak 2544 assign (resid 58 and name HB2 ) (resid 58 and name HD* ) 2.99 1.19 1.19 !peak 1600 assign (resid 58 and name HB2 ) (resid 58 and name HE* ) 3.26 1.46 1.46 !peak 1829 assign (resid 58 and name HB1 ) (resid 58 and name HD* ) 2.94 1.14 1.14 !peak 429 assign (resid 58 and name HG* ) (resid 61 and name HN ) 4.24 2.44 2.44 !peak 887 assign (resid 58 and name HG* ) (resid 61 and name HB ) 3.55 1.75 1.75 !peak 2516 assign (resid 58 and name HG* ) (resid 61 and name HG2* ) 4.20 2.40 2.40 !peak 1960 assign (resid 58 and name HG* ) (resid 61 and name HD1* ) 3.50 1.70 1.70 !peak 2646 assign (resid 58 and name HG* ) (resid 62 and name HN ) 4.09 2.29 2.29 !peak 32 assign (resid 58 and name HG* ) (resid 62 and name HD1 ) 4.24 2.44 2.44 !peak 3088 assign (resid 58 and name HE* ) (resid 59 and name HN ) 3.88 2.08 2.08 !peak 2968 assign (resid 59 and name HN ) (resid 60 and name HB* ) 4.05 2.25 2.25 !peak 2962 assign (resid 60 and name HN ) (resid 60 and name HB* ) 2.67 0.87 0.87 !peak 866 assign (resid 60 and name HB* ) (resid 61 and name HN ) 3.04 1.24 1.24 !peak 1757 assign (resid 60 and name HB* ) (resid 63 and name HD1* ) 3.86 2.06 2.06 !peak 2333 assign (resid 61 and name HA ) (resid 64 and name HB* ) 3.02 1.22 1.22 !peak 1616 assign (resid 61 and name HA ) (resid 64 and name HD* ) 3.59 1.79 1.79 !peak 2496 assign (resid 62 and name HN ) (resid 65 and name HD* ) 4.08 2.28 2.28 !peak 2500 assign (resid 62 and name HA ) (resid 65 and name HB* ) 2.84 1.04 1.04 !peak 649 assign (resid 63 and name HN ) (resid 64 and name HB* ) 3.57 1.77 1.77 !peak 2892 assign (resid 64 and name HN ) (resid 65 and name HB* ) 3.68 1.88 1.88 !peak 2895 assign (resid 64 and name HA ) (resid 64 and name HD* ) 2.55 0.75 0.75 !peak 337 assign (resid 64 and name HB* ) (resid 64 and name HD* ) 2.42 0.62 0.62 !peak 576 assign (resid 64 and name HB* ) (resid 65 and name HN ) 2.75 0.95 0.95 !peak 937 assign (resid 64 and name HB* ) (resid 67 and name HN ) 4.24 2.44 2.44 !peak 976 assign (resid 64 and name HD* ) (resid 66 and name HN ) 4.30 2.50 2.50 !peak 961 assign (resid 64 and name HD* ) (resid 67 and name HN ) 3.49 1.69 1.69 !peak 1920 assign (resid 64 and name HD* ) (resid 67 and name HB2 ) 3.72 1.92 1.92 !peak 2851 assign (resid 64 and name HD* ) (resid 67 and name HB1 ) 3.21 1.41 1.41 !peak 1570 assign (resid 64 and name HD* ) (resid 67 and name HD* ) 3.44 1.64 1.64 !peak 2144 assign (resid 64 and name HD* ) (resid 68 and name HN ) 3.19 1.39 1.39 !peak 1028 assign (resid 64 and name HD* ) (resid 68 and name HG ) 2.96 1.16 1.16 !peak 559 assign (resid 64 and name HD* ) (resid 68 and name HD1* ) 2.56 0.76 0.76 !peak 333 assign (resid 65 and name HN ) (resid 65 and name HB* ) 2.57 0.77 0.77 !peak 940 assign (resid 65 and name HN ) (resid 65 and name HD* ) 3.06 1.26 1.26 !peak 1727 assign (resid 65 and name HA ) (resid 65 and name HD* ) 2.69 0.89 0.89 !peak 513 assign (resid 65 and name HA ) (resid 69 and name HG* ) 3.68 1.88 1.88 !peak 2874 assign (resid 65 and name HB* ) (resid 65 and name HD* ) 2.38 0.58 0.58 !peak 407 assign (resid 65 and name HB* ) (resid 66 and name HN ) 2.82 1.02 1.02 !peak 958 assign (resid 65 and name HB* ) (resid 68 and name HB2 ) 4.19 2.39 2.39 !peak 1931 assign (resid 65 and name HB* ) (resid 69 and name HN ) 4.24 2.44 2.44 !peak 988 assign (resid 65 and name HB* ) (resid 69 and name HG* ) 4.06 2.26 2.26 !peak 2198 assign (resid 65 and name HD* ) (resid 66 and name HN ) 3.45 1.65 1.65 !peak 2707 assign (resid 65 and name HD* ) (resid 68 and name HB2 ) 3.05 1.25 1.25 !peak 922 assign (resid 65 and name HD* ) (resid 68 and name HB1 ) 3.34 1.54 1.54 !peak 1921 assign (resid 65 and name HD* ) (resid 68 and name HD1* ) 2.52 0.72 0.72 !peak 163 assign (resid 65 and name HD* ) (resid 69 and name HN ) 3.25 1.45 1.45 !peak 990 assign (resid 65 and name HD* ) (resid 69 and name HG* ) 2.98 1.18 1.18 !peak 1495 assign (resid 66 and name HA ) (resid 69 and name HG* ) 3.53 1.73 1.73 !peak 2667 assign (resid 67 and name HN ) (resid 70 and name HB* ) 3.59 1.79 1.79 !peak 970 assign (resid 67 and name HA ) (resid 70 and name HB* ) 3.29 1.49 1.49 !peak 1834 assign (resid 68 and name HN ) (resid 70 and name HB* ) 3.89 2.09 2.09 !peak 2655 assign (resid 68 and name HB1 ) (resid 69 and name HG* ) 4.12 2.32 2.32 !peak 3242 assign (resid 69 and name HN ) (resid 69 and name HG* ) 2.73 0.93 0.93 !peak 986 assign (resid 69 and name HN ) (resid 70 and name HB* ) 3.87 2.07 2.07 !peak 985 assign (resid 69 and name HA ) (resid 69 and name HG* ) 2.64 0.84 0.84 !peak 347 assign (resid 69 and name HG* ) (resid 70 and name HN ) 3.59 1.79 1.79 !peak 999 assign (resid 70 and name HN ) (resid 70 and name HB* ) 2.65 0.85 0.85 !peak 998 assign (resid 70 and name HB* ) (resid 71 and name HN ) 3.07 1.27 1.27 !peak 1007 assign (resid 71 and name HN ) (resid 71 and name HB* ) 2.64 0.84 0.84 !peak 1012 assign (resid 71 and name HN ) (resid 71 and name HG* ) 2.94 1.14 1.14 !peak 1013 assign (resid 71 and name HN ) (resid 72 and name HD* ) 3.53 1.73 1.73 !peak 2493 assign (resid 71 and name HA ) (resid 71 and name HG* ) 2.90 1.10 1.10 !peak 1213 assign (resid 71 and name HA ) (resid 71 and name HD* ) 3.45 1.65 1.65 !peak 1670 assign (resid 71 and name HA ) (resid 71 and name HE* ) 3.59 1.79 1.79 !peak 2624 assign (resid 71 and name HB* ) (resid 71 and name HE* ) 3.66 1.86 1.86 !peak 2075 assign (resid 71 and name HB* ) (resid 72 and name HD* ) 2.75 0.95 0.95 !peak 1068 assign (resid 71 and name HG* ) (resid 71 and name HE* ) 2.72 0.92 0.92 !peak 1015 assign (resid 71 and name HG* ) (resid 72 and name HD* ) 3.58 1.78 1.78 !peak 2361 assign (resid 71 and name HD* ) (resid 72 and name HD* ) 3.64 1.84 1.84 !peak 3452
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