1 GLU 33 N -0.0705 -0.1091 -0.0721 2 GLU 33 CA -0.0748 -0.1024 -0.0501 3 GLU 33 C -0.0631 -0.0904 -0.0500 4 GLU 33 O -0.0665 -0.0853 -0.0327 5 GLU 33 CB -0.0742 -0.0929 -0.0322 6 GLU 33 CG -0.0564 -0.0766 -0.0357 7 GLU 33 CD -0.0437 -0.0589 -0.0260 8 GLU 33 OE1 -0.0502 -0.0581 -0.0114 9 GLU 33 OE2 -0.0276 -0.0458 -0.0326 10 GLY 34 N -0.0532 -0.0838 -0.0605 11 GLY 34 CA -0.0402 -0.0679 -0.0582 12 GLY 34 C -0.0278 -0.0518 -0.0455 13 GLY 34 O -0.0261 -0.0498 -0.0464 14 LYS 35 N -0.0211 -0.0408 -0.0326 15 LYS 35 CA -0.0180 -0.0334 -0.0283 16 LYS 35 C -0.0191 -0.0311 -0.0208 17 LYS 35 O -0.0204 -0.0335 -0.0211 18 LYS 35 CB -0.0124 -0.0272 -0.0342 19 LYS 35 CG -0.0102 -0.0257 -0.0382 20 LYS 35 CD -0.0047 -0.0194 -0.0437 21 LYS 35 CE -0.0022 -0.0180 -0.0486 22 LYS 35 NZ 0.0032 -0.0117 -0.0537 23 PRO 36 N -0.0156 -0.0277 -0.0118 24 PRO 36 CA -0.0150 -0.0253 -0.0048 25 PRO 36 C -0.0101 -0.0174 -0.0041 26 PRO 36 O -0.0070 -0.0133 -0.0084 27 PRO 36 CB -0.0175 -0.0277 0.0026 28 PRO 36 CG -0.0168 -0.0272 -0.0004 29 PRO 36 CD -0.0170 -0.0293 -0.0092 30 TRP 37 N -0.0122 -0.0156 0.0003 31 TRP 37 CA -0.0115 -0.0103 0.0013 32 TRP 37 C -0.0099 -0.0033 0.0011 33 TRP 37 O -0.0081 0.0015 -0.0001 34 TRP 37 CB -0.0149 -0.0110 0.0074 35 TRP 37 CG -0.0174 -0.0097 0.0126 36 TRP 37 CD1 -0.0197 -0.0142 0.0149 37 TRP 37 CD2 -0.0180 -0.0034 0.0162 38 TRP 37 CE2 -0.0206 -0.0044 0.0207 39 TRP 37 CE3 -0.0165 0.0031 0.0162 40 TRP 37 NE1 -0.0216 -0.0111 0.0198 41 TRP 37 CZ2 -0.0218 0.0007 0.0251 42 TRP 37 CZ3 -0.0176 0.0081 0.0205 43 TRP 37 CH2 -0.0203 0.0070 0.0249 44 TRP 38 N -0.0104 -0.0024 0.0026 45 TRP 38 CA -0.0087 0.0033 0.0016 46 TRP 38 C -0.0048 0.0054 -0.0039 47 TRP 38 O -0.0035 0.0106 -0.0043 48 TRP 38 CB -0.0088 0.0019 0.0013 49 TRP 38 CG -0.0073 0.0073 0.0006 50 TRP 38 CD1 -0.0082 0.0130 0.0036 51 TRP 38 CD2 -0.0040 0.0085 -0.0043 52 TRP 38 CE2 -0.0033 0.0147 -0.0035 53 TRP 38 CE3 -0.0016 0.0048 -0.0091 54 TRP 38 NE1 -0.0060 0.0173 0.0014 55 TRP 38 CZ2 -0.0004 0.0173 -0.0073 56 TRP 38 CZ3 0.0012 0.0073 -0.0128 57 TRP 38 CH2 0.0018 0.0135 -0.0119 58 LEU 39 N -0.0048 0.0048 -0.0085 59 LEU 39 CA 0.0021 0.0057 -0.0124 60 LEU 39 C 0.0031 0.0035 -0.0131 61 LEU 39 O 0.0071 0.0071 -0.0152 62 LEU 39 CB 0.0063 0.0008 -0.0148 63 LEU 39 CG 0.0137 0.0018 -0.0190 64 LEU 39 CD1 0.0155 0.0003 -0.0201 65 LEU 39 CD2 0.0174 -0.0036 -0.0211 66 VAL 40 N -0.0010 0.0032 -0.0140 67 VAL 40 CA 0.0002 0.0066 -0.0158 68 VAL 40 C 0.0008 0.0138 -0.0126 69 VAL 40 O 0.0026 0.0186 -0.0159 70 VAL 40 CB -0.0012 0.0023 -0.0140 71 VAL 40 CG1 -0.0001 0.0061 -0.0151 72 VAL 40 CG2 -0.0014 -0.0041 -0.0183 73 VAL 41 N -0.0004 0.0119 -0.0084 74 VAL 41 CA -0.0013 0.0163 -0.0069 75 VAL 41 C -0.0007 0.0190 -0.0102 76 VAL 41 O -0.0009 0.0228 -0.0111 77 VAL 41 CB -0.0024 0.0160 -0.0026 78 VAL 41 CG1 -0.0032 0.0206 -0.0012 79 VAL 41 CG2 -0.0030 0.0136 0.0007 80 VAL 42 N -0.0008 0.0203 -0.0118 81 VAL 42 CA 0.0009 0.0234 -0.0142 82 VAL 42 C 0.0031 0.0235 -0.0166 83 VAL 42 O 0.0035 0.0266 -0.0177 84 VAL 42 CB 0.0021 0.0228 -0.0154 85 VAL 42 CG1 0.0045 0.0252 -0.0184 86 VAL 42 CG2 -0.0002 0.0241 -0.0133 87 GLY 43 N 0.0041 0.0211 -0.0159 88 GLY 43 CA 0.0040 0.0207 -0.0150 89 GLY 43 C 0.0016 0.0205 -0.0138 90 GLY 43 O 0.0007 0.0206 -0.0140 91 VAL 44 N -0.0000 0.0206 -0.0140 92 VAL 44 CA -0.0015 0.0197 -0.0135 93 VAL 44 C -0.0028 0.0191 -0.0147 94 VAL 44 O -0.0040 0.0183 -0.0142 95 VAL 44 CB -0.0016 0.0196 -0.0133 96 VAL 44 CG1 -0.0032 0.0186 -0.0133 97 VAL 44 CG2 -0.0008 0.0198 -0.0116 98 LEU 45 N -0.0042 0.0194 -0.0149 99 LEU 45 CA -0.0059 0.0201 -0.0169 100 LEU 45 C -0.0053 0.0205 -0.0175 101 LEU 45 O -0.0071 0.0205 -0.0181 102 LEU 45 CB -0.0059 0.0212 -0.0191 103 LEU 45 CG -0.0076 0.0211 -0.0194 104 LEU 45 CD1 -0.0105 0.0209 -0.0196 105 LEU 45 CD2 -0.0072 0.0202 -0.0174 106 VAL 46 N -0.0026 0.0222 -0.0168 107 VAL 46 CA -0.0018 0.0224 -0.0163 108 VAL 46 C -0.0021 0.0202 -0.0137 109 VAL 46 O -0.0029 0.0194 -0.0135 110 VAL 46 CB 0.0011 0.0248 -0.0162 111 VAL 46 CG1 0.0013 0.0271 -0.0191 112 VAL 46 CG2 0.0033 0.0248 -0.0139 113 VAL 46 H -0.0012 0.0233 -0.0168 114 VAL 46 HA -0.0032 0.0226 -0.0181 115 VAL 46 HB 0.0015 0.0249 -0.0159 116 VAL 46 1HG1 0.0033 0.0287 -0.0190 117 VAL 46 2HG1 -0.0003 0.0271 -0.0208 118 VAL 46 3HG1 0.0009 0.0270 -0.0194 119 VAL 46 1HG2 0.0054 0.0265 -0.0139 120 VAL 46 2HG2 0.0030 0.0248 -0.0142 121 VAL 46 3HG2 0.0033 0.0232 -0.0118 122 VAL 47 N -0.0020 0.0190 -0.0120 123 VAL 47 CA -0.0023 0.0167 -0.0095 124 VAL 47 C -0.0046 0.0141 -0.0105 125 VAL 47 O -0.0051 0.0124 -0.0093 126 VAL 47 CB -0.0015 0.0164 -0.0077 127 VAL 47 CG1 -0.0020 0.0137 -0.0052 128 VAL 47 CG2 0.0009 0.0188 -0.0063 129 VAL 47 H -0.0014 0.0202 -0.0125 130 VAL 47 HA -0.0014 0.0169 -0.0081 131 VAL 47 HB -0.0022 0.0164 -0.0091 132 VAL 47 1HG1 -0.0014 0.0135 -0.0039 133 VAL 47 2HG1 -0.0038 0.0119 -0.0062 134 VAL 47 3HG1 -0.0013 0.0136 -0.0038 135 VAL 47 1HG2 0.0016 0.0187 -0.0050 136 VAL 47 2HG2 0.0017 0.0188 -0.0049 137 VAL 47 3HG2 0.0013 0.0208 -0.0081 138 GLY 48 N -0.0063 0.0135 -0.0125 139 GLY 48 CA -0.0089 0.0104 -0.0136 140 GLY 48 C -0.0097 0.0099 -0.0146 141 GLY 48 O -0.0111 0.0071 -0.0138 142 GLY 48 H -0.0058 0.0153 -0.0137 143 GLY 48 1HA -0.0092 0.0082 -0.0115 144 GLY 48 2HA -0.0101 0.0105 -0.0159 145 LEU 49 N -0.0094 0.0127 -0.0160 146 LEU 49 CA -0.0100 0.0130 -0.0170 147 LEU 49 C -0.0083 0.0119 -0.0139 148 LEU 49 O -0.0096 0.0099 -0.0137 149 LEU 49 CB -0.0090 0.0169 -0.0190 150 LEU 49 CG -0.0106 0.0184 -0.0225 151 LEU 49 CD1 -0.0090 0.0225 -0.0239 152 LEU 49 CD2 -0.0136 0.0167 -0.0248 153 LEU 49 H -0.0085 0.0149 -0.0167 154 LEU 49 HA -0.0122 0.0113 -0.0184 155 LEU 49 1HB -0.0068 0.0186 -0.0176 156 LEU 49 2HB -0.0091 0.0171 -0.0193 157 LEU 49 HG -0.0109 0.0180 -0.0224 158 LEU 49 1HD1 -0.0102 0.0236 -0.0264 159 LEU 49 2HD1 -0.0069 0.0237 -0.0222 160 LEU 49 3HD1 -0.0088 0.0229 -0.0240 161 LEU 49 1HD2 -0.0148 0.0178 -0.0274 162 LEU 49 2HD2 -0.0134 0.0171 -0.0249 163 LEU 49 3HD2 -0.0148 0.0138 -0.0239 164 LEU 50 N -0.0053 0.0127 -0.0109 165 LEU 50 CA -0.0041 0.0119 -0.0080 166 LEU 50 C -0.0048 0.0084 -0.0067 167 LEU 50 O -0.0048 0.0067 -0.0054 168 LEU 50 CB -0.0020 0.0140 -0.0059 169 LEU 50 CG -0.0010 0.0176 -0.0068 170 LEU 50 CD1 0.0009 0.0196 -0.0049 171 LEU 50 CD2 -0.0006 0.0179 -0.0063 172 LEU 50 H -0.0048 0.0145 -0.0112 173 LEU 50 HA -0.0042 0.0122 -0.0084 174 LEU 50 1HB -0.0020 0.0140 -0.0058 175 LEU 50 2HB -0.0011 0.0131 -0.0036 176 LEU 50 HG -0.0020 0.0184 -0.0092 177 LEU 50 1HD1 0.0016 0.0221 -0.0056 178 LEU 50 2HD1 0.0006 0.0194 -0.0053 179 LEU 50 3HD1 0.0019 0.0188 -0.0025 180 LEU 50 1HD2 0.0001 0.0204 -0.0070 181 LEU 50 2HD2 0.0004 0.0171 -0.0039 182 LEU 50 3HD2 -0.0019 0.0165 -0.0077 183 VAL 51 N -0.0057 0.0062 -0.0067 184 VAL 51 CA -0.0065 0.0020 -0.0050 185 VAL 51 C -0.0089 -0.0008 -0.0070 186 VAL 51 O -0.0090 -0.0038 -0.0051 187 VAL 51 CB -0.0070 0.0009 -0.0051 188 VAL 51 CG1 -0.0082 -0.0037 -0.0039 189 VAL 51 CG2 -0.0046 0.0032 -0.0026 190 VAL 51 H -0.0058 0.0081 -0.0080 191 VAL 51 HA -0.0049 0.0015 -0.0020 192 VAL 51 HB -0.0084 0.0018 -0.0081 193 VAL 51 1HG1 -0.0086 -0.0044 -0.0040 194 VAL 51 2HG1 -0.0100 -0.0054 -0.0057 195 VAL 51 3HG1 -0.0069 -0.0047 -0.0009 196 VAL 51 1HG2 -0.0049 0.0026 -0.0027 197 VAL 51 2HG2 -0.0032 0.0023 0.0004 198 VAL 51 3HG2 -0.0038 0.0065 -0.0035 199 GLY 52 N -0.0112 -0.0001 -0.0100 200 GLY 52 CA -0.0140 -0.0027 -0.0122 201 GLY 52 C -0.0136 -0.0025 -0.0118 202 GLY 52 O -0.0149 -0.0058 -0.0111 203 GLY 52 H -0.0109 0.0024 -0.0115 204 GLY 52 1HA -0.0150 -0.0060 -0.0112 205 GLY 52 2HA -0.0155 -0.0015 -0.0154 206 MET 53 N -0.0113 0.0017 -0.0117 207 MET 53 CA -0.0108 0.0023 -0.0113 208 MET 53 C -0.0094 0.0001 -0.0080 209 MET 53 O -0.0099 -0.0014 -0.0077 210 MET 53 CB -0.0092 0.0065 -0.0119 211 MET 53 CG -0.0109 0.0088 -0.0156 212 MET 53 SD -0.0092 0.0137 -0.0165 213 MET 53 CE -0.0065 0.0158 -0.0141 214 MET 53 H -0.0105 0.0040 -0.0121 215 MET 53 HA -0.0127 0.0013 -0.0133 216 MET 53 1HB -0.0075 0.0077 -0.0103 217 MET 53 2HB -0.0085 0.0070 -0.0112 218 MET 53 1HG -0.0127 0.0075 -0.0172 219 MET 53 2HG -0.0115 0.0086 -0.0164 220 MET 53 1HE -0.0053 0.0188 -0.0145 221 MET 53 2HE -0.0073 0.0155 -0.0150 222 MET 53 3HE -0.0052 0.0144 -0.0115 223 VAL 54 N -0.0076 -0.0002 -0.0057 224 VAL 54 CA -0.0055 -0.0030 -0.0022 225 VAL 54 C -0.0072 -0.0079 -0.0027 226 VAL 54 O -0.0068 -0.0100 -0.0015 227 VAL 54 CB -0.0030 -0.0026 0.0006 228 VAL 54 CG1 -0.0011 -0.0060 0.0041 229 VAL 54 CG2 -0.0011 0.0023 0.0014 230 VAL 54 H -0.0075 0.0013 -0.0061 231 VAL 54 HA -0.0043 -0.0017 -0.0012 232 VAL 54 HB -0.0042 -0.0033 -0.0005 233 VAL 54 1HG1 0.0006 -0.0056 0.0061 234 VAL 54 2HG1 -0.0025 -0.0095 0.0035 235 VAL 54 3HG1 0.0000 -0.0053 0.0052 236 VAL 54 1HG2 0.0007 0.0027 0.0034 237 VAL 54 2HG2 0.0000 0.0030 0.0025 238 VAL 54 3HG2 -0.0025 0.0047 -0.0011 239 GLY 55 N -0.0098 -0.0107 -0.0033 240 GLY 55 CA -0.0124 -0.0162 -0.0035 241 GLY 55 C -0.0149 -0.0170 -0.0057 242 GLY 55 O -0.0156 -0.0212 -0.0045 243 GLY 55 H -0.0099 -0.0087 -0.0044 244 GLY 55 1HA -0.0104 -0.0190 -0.0003 245 GLY 55 2HA -0.0144 -0.0173 -0.0051 246 MET 56 N -0.0163 -0.0129 -0.0083 247 MET 56 CA -0.0188 -0.0129 -0.0105 248 MET 56 C -0.0169 -0.0138 -0.0084 249 MET 56 O -0.0189 -0.0165 -0.0089 250 MET 56 CB -0.0196 -0.0079 -0.0136 251 MET 56 CG -0.0225 -0.0067 -0.0166 252 MET 56 SD -0.0225 -0.0004 -0.0196 253 MET 56 CE -0.0248 0.0000 -0.0218 254 MET 56 H -0.0157 -0.0100 -0.0092 255 MET 56 HA -0.0217 -0.0158 -0.0117 256 MET 56 1HB -0.0168 -0.0050 -0.0124 257 MET 56 2HB -0.0208 -0.0077 -0.0147 258 MET 56 1HG -0.0255 -0.0090 -0.0182 259 MET 56 2HG -0.0216 -0.0075 -0.0155 260 MET 56 1HE -0.0250 0.0037 -0.0237 261 MET 56 2HE -0.0230 -0.0009 -0.0198 262 MET 56 3HE -0.0279 -0.0025 -0.0234 263 THR 57 N -0.0130 -0.0116 -0.0055 264 THR 57 CA -0.0106 -0.0119 -0.0035 265 THR 57 C -0.0082 -0.0168 -0.0002 266 THR 57 O -0.0071 -0.0190 0.0013 267 THR 57 CB -0.0073 -0.0064 -0.0028 268 THR 57 CG2 -0.0052 -0.0068 -0.0010 269 THR 57 OG1 -0.0100 -0.0021 -0.0062 270 THR 57 H -0.0115 -0.0097 -0.0049 271 THR 57 HA -0.0130 -0.0125 -0.0052 272 THR 57 HB -0.0048 -0.0055 -0.0011 273 THR 57 HG1 -0.0113 -0.0015 -0.0074 274 THR 57 1HG2 -0.0030 -0.0030 -0.0005 275 THR 57 2HG2 -0.0032 -0.0100 0.0015 276 THR 57 3HG2 -0.0079 -0.0077 -0.0028 277 VAL 58 N -0.0072 -0.0185 0.0012 278 VAL 58 CA -0.0051 -0.0235 0.0045 279 VAL 58 C -0.0087 -0.0286 0.0033 280 VAL 58 O -0.0074 -0.0323 0.0054 281 VAL 58 CB -0.0034 -0.0244 0.0060 282 VAL 58 CG1 -0.0018 -0.0302 0.0092 283 VAL 58 CG2 0.0007 -0.0196 0.0077 284 VAL 58 H -0.0079 -0.0163 -0.0001 285 VAL 58 HA -0.0019 -0.0230 0.0068 286 VAL 58 HB -0.0064 -0.0244 0.0037 287 VAL 58 1HG1 -0.0007 -0.0308 0.0103 288 VAL 58 2HG1 -0.0048 -0.0338 0.0080 289 VAL 58 3HG1 0.0011 -0.0303 0.0115 290 VAL 58 1HG2 0.0019 -0.0201 0.0088 291 VAL 58 2HG2 0.0036 -0.0197 0.0101 292 VAL 58 3HG2 -0.0004 -0.0154 0.0055 293 ALA 59 N -0.0130 -0.0288 0.0004 294 ALA 59 CA -0.0169 -0.0334 -0.0010 295 ALA 59 C -0.0181 -0.0336 -0.0019 296 ALA 59 O -0.0193 -0.0382 -0.0011 297 ALA 59 CB -0.0211 -0.0328 -0.0047 298 ALA 59 H -0.0135 -0.0258 -0.0012 299 ALA 59 HA -0.0160 -0.0374 0.0013 300 ALA 59 1HB -0.0241 -0.0363 -0.0058 301 ALA 59 2HB -0.0203 -0.0328 -0.0041 302 ALA 59 3HB -0.0220 -0.0288 -0.0070 303 SER 60 N -0.0177 -0.0284 -0.0035 304 SER 60 CA -0.0186 -0.0282 -0.0043 305 SER 60 C -0.0143 -0.0295 -0.0005 306 SER 60 O -0.0148 -0.0315 -0.0002 307 SER 60 CB -0.0196 -0.0224 -0.0071 308 SER 60 OG -0.0154 -0.0181 -0.0054 309 SER 60 H -0.0171 -0.0247 -0.0044 310 SER 60 HA -0.0218 -0.0316 -0.0056 311 SER 60 1HB -0.0211 -0.0226 -0.0082 312 SER 60 2HB -0.0224 -0.0213 -0.0096 313 SER 60 HG -0.0165 -0.0145 -0.0075 314 GLY 61 N -0.0099 -0.0283 0.0022 315 GLY 61 CA -0.0052 -0.0294 0.0059 316 GLY 61 C -0.0029 -0.0246 0.0060 317 GLY 61 O -0.0001 -0.0257 0.0083 318 GLY 61 H -0.0097 -0.0265 0.0018 319 GLY 61 1HA -0.0025 -0.0298 0.0079 320 GLY 61 2HA -0.0059 -0.0337 0.0067 321 SER 62 N -0.0035 -0.0193 0.0035 322 SER 62 CA -0.0014 -0.0149 0.0038 323 SER 62 C 0.0035 -0.0121 0.0064 324 SER 62 O 0.0038 -0.0082 0.0057 325 SER 62 CB -0.0048 -0.0104 0.0005 326 SER 62 OG -0.0024 -0.0059 0.0010 327 SER 62 H -0.0058 -0.0185 0.0018 328 SER 62 HA -0.0008 -0.0169 0.0047 329 SER 62 1HB -0.0082 -0.0124 -0.0012 330 SER 62 2HB -0.0060 -0.0087 -0.0006 331 SER 62 HG -0.0051 -0.0036 -0.0012 332 ARG 63 N 0.0071 -0.0139 0.0091 333 ARG 63 CA 0.0125 -0.0117 0.0121 334 ARG 63 C 0.0140 -0.0050 0.0110 335 ARG 63 O 0.0169 -0.0020 0.0121 336 ARG 63 CB 0.0162 -0.0148 0.0156 337 ARG 63 CG 0.0157 -0.0216 0.0174 338 ARG 63 CD 0.0181 -0.0231 0.0195 339 ARG 63 NE 0.0177 -0.0295 0.0213 340 ARG 63 CZ 0.0186 -0.0323 0.0228 341 ARG 63 NH1 0.0202 -0.0292 0.0229 342 ARG 63 NH2 0.0180 -0.0382 0.0242 343 ARG 63 H 0.0061 -0.0174 0.0095 344 ARG 63 HA 0.0130 -0.0127 0.0128 345 ARG 63 1HB 0.0154 -0.0141 0.0148 346 ARG 63 2HB 0.0201 -0.0127 0.0176 347 ARG 63 1HG 0.0117 -0.0236 0.0153 348 ARG 63 2HG 0.0177 -0.0235 0.0194 349 ARG 63 1HD 0.0222 -0.0211 0.0217 350 ARG 63 2HD 0.0162 -0.0213 0.0177 351 ARG 63 HE 0.0165 -0.0322 0.0212 352 ARG 63 1HH1 0.0208 -0.0247 0.0218 353 ARG 63 2HH1 0.0209 -0.0313 0.0240 354 ARG 63 1HH2 0.0168 -0.0406 0.0241 355 ARG 63 2HH2 0.0187 -0.0403 0.0253 356 LEU 64 N 0.0121 -0.0025 0.0093 357 LEU 64 CA 0.0132 0.0038 0.0086 358 LEU 64 C 0.0104 0.0068 0.0062 359 LEU 64 O 0.0124 0.0112 0.0064 360 LEU 64 CB 0.0117 0.0059 0.0072 361 LEU 64 CG 0.0148 0.0040 0.0095 362 LEU 64 CD1 0.0125 0.0060 0.0076 363 LEU 64 CD2 0.0205 0.0064 0.0124 364 LEU 64 H 0.0099 -0.0048 0.0085 365 LEU 64 HA 0.0173 0.0050 0.0107 366 LEU 64 1HB 0.0077 0.0044 0.0051 367 LEU 64 2HB 0.0121 0.0107 0.0064 368 LEU 64 HG 0.0146 -0.0008 0.0104 369 LEU 64 1HD1 0.0145 0.0046 0.0092 370 LEU 64 2HD1 0.0084 0.0041 0.0057 371 LEU 64 3HD1 0.0127 0.0107 0.0067 372 LEU 64 1HD2 0.0226 0.0050 0.0139 373 LEU 64 2HD2 0.0208 0.0111 0.0115 374 LEU 64 3HD2 0.0223 0.0049 0.0138 375 PHE 65 N 0.0059 0.0040 0.0041 376 PHE 65 CA 0.0031 0.0064 0.0019 377 PHE 65 C 0.0048 0.0049 0.0033 378 PHE 65 O 0.0043 0.0080 0.0023 379 PHE 65 CB -0.0023 0.0049 -0.0010 380 PHE 65 CG -0.0040 0.0087 -0.0028 381 PHE 65 CD1 -0.0031 0.0081 -0.0021 382 PHE 65 CD2 -0.0068 0.0129 -0.0053 383 PHE 65 CE1 -0.0048 0.0117 -0.0039 384 PHE 65 CE2 -0.0085 0.0164 -0.0071 385 PHE 65 CZ -0.0075 0.0158 -0.0064 386 PHE 65 H 0.0045 0.0005 0.0040 387 PHE 65 HA 0.0037 0.0108 0.0014 388 PHE 65 1HB -0.0030 0.0007 -0.0006 389 PHE 65 2HB -0.0043 0.0054 -0.0023 390 PHE 65 HD1 -0.0010 0.0049 -0.0002 391 PHE 65 HD2 -0.0076 0.0134 -0.0059 392 PHE 65 HE1 -0.0040 0.0112 -0.0033 393 PHE 65 HE2 -0.0107 0.0197 -0.0091 394 PHE 65 HZ -0.0089 0.0186 -0.0078 395 LEU 66 N 0.0068 0.0008 0.0051 396 LEU 66 CA 0.0092 -0.0004 0.0070 397 LEU 66 C 0.0134 0.0042 0.0084 398 LEU 66 O 0.0147 0.0062 0.0086 399 LEU 66 CB 0.0107 -0.0061 0.0097 400 LEU 66 CG 0.0064 -0.0110 0.0084 401 LEU 66 CD1 0.0081 -0.0165 0.0111 402 LEU 66 CD2 0.0040 -0.0111 0.0069 403 LEU 66 H 0.0065 -0.0019 0.0058 404 LEU 66 HA 0.0067 0.0000 0.0053 405 LEU 66 1HB 0.0127 -0.0066 0.0112 406 LEU 66 2HB 0.0130 -0.0064 0.0113 407 LEU 66 HG 0.0038 -0.0105 0.0066 408 LEU 66 1HD1 0.0049 -0.0198 0.0101 409 LEU 66 2HD1 0.0097 -0.0165 0.0122 410 LEU 66 3HD1 0.0107 -0.0172 0.0130 411 LEU 66 1HD2 0.0012 -0.0144 0.0060 412 LEU 66 2HD2 0.0067 -0.0117 0.0088 413 LEU 66 3HD2 0.0026 -0.0074 0.0049 414 GLY 67 N 0.0158 0.0052 0.0086 415 GLY 67 CA 0.0194 0.0096 0.0095 416 GLY 67 C 0.0169 0.0145 0.0076 417 GLY 67 O 0.0186 0.0171 0.0079 418 GLY 67 H 0.0152 0.0037 0.0086 419 GLY 67 1HA 0.0222 0.0084 0.0109 420 GLY 67 2HA 0.0214 0.0106 0.0101 421 ALA 68 N 0.0127 0.0159 0.0058 422 ALA 68 CA 0.0098 0.0200 0.0044 423 ALA 68 C 0.0082 0.0188 0.0040 424 ALA 68 O 0.0080 0.0222 0.0036 425 ALA 68 CB 0.0054 0.0209 0.0028 426 ALA 68 H 0.0118 0.0142 0.0057 427 ALA 68 HA 0.0121 0.0235 0.0048 428 ALA 68 1HB 0.0034 0.0241 0.0018 429 ALA 68 2HB 0.0066 0.0218 0.0031 430 ALA 68 3HB 0.0031 0.0176 0.0024 431 GLY 69 N 0.0085 0.0153 0.0030 432 GLY 69 CA 0.0071 0.0147 0.0020 433 GLY 69 C 0.0084 0.0161 0.0031 434 GLY 69 O 0.0072 0.0163 0.0024 435 GLY 69 H 0.0090 0.0134 0.0030 436 GLY 69 1HA 0.0050 0.0157 0.0009 437 GLY 69 2HA 0.0070 0.0122 0.0016 438 ALA 70 N 0.0102 0.0169 0.0035 439 ALA 70 CA 0.0099 0.0175 0.0041 440 ALA 70 C 0.0076 0.0191 0.0049 441 ALA 70 O 0.0068 0.0195 0.0052 442 ALA 70 CB 0.0122 0.0182 0.0057 443 ALA 70 H 0.0118 0.0170 0.0042 444 ALA 70 HA 0.0098 0.0165 0.0028 445 ALA 70 1HB 0.0119 0.0186 0.0061 446 ALA 70 2HB 0.0139 0.0171 0.0051 447 ALA 70 3HB 0.0123 0.0193 0.0070 448 ILE 71 N 0.0061 0.0201 0.0050 449 ILE 71 CA 0.0043 0.0205 0.0059 450 ILE 71 C 0.0026 0.0193 0.0049 451 ILE 71 O 0.0013 0.0194 0.0053 452 ILE 71 CB 0.0037 0.0214 0.0072 453 ILE 71 CG1 0.0052 0.0228 0.0085 454 ILE 71 CG2 0.0015 0.0216 0.0080 455 ILE 71 CD1 0.0053 0.0236 0.0095 456 ILE 71 H 0.0068 0.0204 0.0051 457 ILE 71 HA 0.0045 0.0210 0.0065 458 ILE 71 HB 0.0038 0.0210 0.0067 459 ILE 71 1HG1 0.0067 0.0226 0.0079 460 ILE 71 2HG1 0.0048 0.0234 0.0093 461 ILE 71 1HG2 0.0012 0.0222 0.0089 462 ILE 71 2HG2 0.0005 0.0207 0.0072 463 ILE 71 3HG2 0.0014 0.0220 0.0086 464 ILE 71 1HD1 0.0064 0.0245 0.0103 465 ILE 71 2HD1 0.0039 0.0238 0.0101 466 ILE 71 3HD1 0.0058 0.0230 0.0087 467 PHE 72 N 0.0029 0.0188 0.0030 468 PHE 72 CA 0.0016 0.0191 0.0020 469 PHE 72 C 0.0027 0.0197 0.0033 470 PHE 72 O 0.0019 0.0214 0.0033 471 PHE 72 CB 0.0009 0.0170 0.0003 472 PHE 72 CG -0.0000 0.0163 -0.0009 473 PHE 72 CD1 0.0000 0.0139 -0.0019 474 PHE 72 CD2 -0.0008 0.0177 -0.0010 475 PHE 72 CE1 -0.0007 0.0131 -0.0030 476 PHE 72 CE2 -0.0016 0.0169 -0.0021 477 PHE 72 CZ -0.0015 0.0145 -0.0031 478 PHE 72 H 0.0034 0.0173 0.0028 479 PHE 72 HA 0.0004 0.0206 0.0015 480 PHE 72 1HB 0.0019 0.0155 0.0006 481 PHE 72 2HB -0.0001 0.0175 -0.0004 482 PHE 72 HD1 0.0007 0.0128 -0.0018 483 PHE 72 HD2 -0.0009 0.0196 -0.0002 484 PHE 72 HE1 -0.0006 0.0112 -0.0038 485 PHE 72 HE2 -0.0023 0.0181 -0.0022 486 PHE 72 HZ -0.0021 0.0138 -0.0040 487 PRO 73 N 0.0021 0.0180 0.0007 488 PRO 73 CA 0.0014 0.0177 0.0001 489 PRO 73 C 0.0006 0.0177 0.0014 490 PRO 73 O -0.0007 0.0174 0.0012 491 PRO 73 CB 0.0029 0.0180 -0.0006 492 PRO 73 CG 0.0039 0.0181 -0.0012 493 PRO 73 CD 0.0038 0.0182 -0.0001 494 PRO 73 HA 0.0006 0.0174 -0.0009 495 PRO 73 1HB 0.0035 0.0182 0.0004 496 PRO 73 2HB 0.0026 0.0178 -0.0015 497 PRO 73 1HG 0.0052 0.0184 -0.0014 498 PRO 73 2HG 0.0035 0.0179 -0.0025 499 PRO 73 1HD 0.0047 0.0186 0.0008 500 PRO 73 2HD 0.0038 0.0182 -0.0008 501 ILE 74 N 0.0014 0.0183 0.0024 502 ILE 74 CA 0.0003 0.0176 0.0032 503 ILE 74 C -0.0017 0.0163 0.0044 504 ILE 74 O -0.0031 0.0152 0.0042 505 ILE 74 CB 0.0014 0.0186 0.0048 506 ILE 74 CG1 0.0004 0.0179 0.0050 507 ILE 74 CG2 0.0015 0.0190 0.0074 508 ILE 74 CD1 0.0003 0.0175 0.0026 509 ILE 74 H 0.0027 0.0194 0.0030 510 ILE 74 HA 0.0000 0.0172 0.0016 511 ILE 74 HB 0.0029 0.0196 0.0040 512 ILE 74 1HG1 0.0012 0.0187 0.0062 513 ILE 74 2HG1 -0.0011 0.0169 0.0058 514 ILE 74 1HG2 0.0023 0.0197 0.0084 515 ILE 74 2HG2 0.0022 0.0195 0.0074 516 ILE 74 3HG2 0.0000 0.0180 0.0083 517 ILE 74 1HD1 -0.0004 0.0171 0.0030 518 ILE 74 2HD1 -0.0006 0.0167 0.0014 519 ILE 74 3HD1 0.0017 0.0185 0.0018 520 PHE 75 N -0.0017 0.0163 0.0049 521 PHE 75 CA -0.0030 0.0147 0.0062 522 PHE 75 C -0.0036 0.0128 0.0051 523 PHE 75 O -0.0045 0.0111 0.0051 524 PHE 75 CB -0.0034 0.0154 0.0085 525 PHE 75 CG -0.0032 0.0167 0.0099 526 PHE 75 CD1 -0.0021 0.0187 0.0100 527 PHE 75 CD2 -0.0041 0.0157 0.0110 528 PHE 75 CE1 -0.0020 0.0198 0.0113 529 PHE 75 CE2 -0.0040 0.0168 0.0123 530 PHE 75 CZ -0.0029 0.0189 0.0125 531 PHE 75 H -0.0012 0.0175 0.0054 532 PHE 75 HA -0.0032 0.0143 0.0063 533 PHE 75 1HB -0.0028 0.0164 0.0083 534 PHE 75 2HB -0.0043 0.0142 0.0092 535 PHE 75 HD1 -0.0014 0.0195 0.0091 536 PHE 75 HD2 -0.0050 0.0141 0.0110 537 PHE 75 HE1 -0.0011 0.0214 0.0114 538 PHE 75 HE2 -0.0047 0.0161 0.0133 539 PHE 75 HZ -0.0028 0.0198 0.0135 540 MET 76 N -0.0020 0.0159 0.0028 541 MET 76 CA -0.0027 0.0158 0.0018 542 MET 76 C -0.0036 0.0154 0.0010 543 MET 76 O -0.0046 0.0150 0.0005 544 MET 76 CB -0.0019 0.0165 0.0008 545 MET 76 CG -0.0012 0.0167 0.0014 546 MET 76 SD -0.0004 0.0175 0.0002 547 MET 76 CE 0.0007 0.0182 -0.0001 548 MET 76 H -0.0012 0.0164 0.0028 549 MET 76 HA -0.0032 0.0154 0.0022 550 MET 76 1HB -0.0013 0.0169 0.0006 551 MET 76 2HB -0.0024 0.0164 -0.0001 552 MET 76 1HG -0.0018 0.0163 0.0018 553 MET 76 2HG -0.0006 0.0169 0.0022 554 MET 76 1HE 0.0012 0.0187 -0.0008 555 MET 76 2HE 0.0012 0.0183 0.0008 556 MET 76 3HE 0.0003 0.0181 -0.0005 557 ILE 77 N -0.0057 0.0131 -0.0019 558 ILE 77 CA -0.0079 0.0123 -0.0038 559 ILE 77 C -0.0100 0.0098 -0.0020 560 ILE 77 O -0.0124 0.0086 -0.0033 561 ILE 77 CB -0.0068 0.0136 -0.0046 562 ILE 77 CG1 -0.0049 0.0161 -0.0068 563 ILE 77 CG2 -0.0092 0.0125 -0.0062 564 ILE 77 CD1 -0.0032 0.0176 -0.0073 565 ILE 77 H -0.0039 0.0141 -0.0010 566 ILE 77 HA -0.0088 0.0126 -0.0059 567 ILE 77 HB -0.0056 0.0135 -0.0026 568 ILE 77 1HG1 -0.0061 0.0162 -0.0090 569 ILE 77 2HG1 -0.0036 0.0167 -0.0059 570 ILE 77 1HG2 -0.0084 0.0134 -0.0069 571 ILE 77 2HG2 -0.0104 0.0108 -0.0047 572 ILE 77 3HG2 -0.0104 0.0125 -0.0083 573 ILE 77 1HD1 -0.0020 0.0193 -0.0089 574 ILE 77 2HD1 -0.0019 0.0176 -0.0051 575 ILE 77 3HD1 -0.0045 0.0171 -0.0083 576 GLY 78 N -0.0094 0.0080 -0.0013 577 GLY 78 CA -0.0108 0.0015 -0.0002 578 GLY 78 C -0.0106 -0.0021 0.0021 579 GLY 78 O -0.0129 -0.0072 0.0007 580 GLY 78 H -0.0075 0.0110 0.0006 581 GLY 78 1HA -0.0133 -0.0001 -0.0040 582 GLY 78 2HA -0.0094 0.0008 0.0028 583 GLY 79 N -0.0041 0.0000 0.0024 584 GLY 79 CA -0.0001 -0.0004 0.0056 585 GLY 79 C -0.0039 0.0007 0.0026 586 GLY 79 O -0.0011 -0.0007 0.0048 587 GLY 79 H -0.0027 0.0042 0.0035 588 GLY 79 1HA 0.0024 -0.0062 0.0077 589 GLY 79 2HA 0.0036 0.0045 0.0084 590 VAL 80 N -0.0121 0.0032 -0.0020 591 VAL 80 CA -0.0177 0.0058 -0.0056 592 VAL 80 C -0.0222 -0.0026 -0.0060 593 VAL 80 O -0.0253 -0.0023 -0.0077 594 VAL 80 CB -0.0240 0.0120 -0.0103 595 VAL 80 CG1 -0.0194 0.0200 -0.0097 596 VAL 80 CG2 -0.0308 0.0070 -0.0127 597 VAL 80 H -0.0137 0.0035 -0.0029 598 VAL 80 HA -0.0141 0.0095 -0.0045 599 VAL 80 HB -0.0269 0.0147 -0.0124 600 VAL 80 1HG1 -0.0236 0.0247 -0.0130 601 VAL 80 2HG1 -0.0149 0.0233 -0.0081 602 VAL 80 3HG1 -0.0162 0.0179 -0.0075 603 VAL 80 1HG2 -0.0351 0.0118 -0.0161 604 VAL 80 2HG2 -0.0284 0.0042 -0.0108 605 VAL 80 3HG2 -0.0341 0.0016 -0.0132 606 ALA 81 N -0.0239 -0.0117 -0.0063 607 ALA 81 CA -0.0284 -0.0222 -0.0070 608 ALA 81 C -0.0204 -0.0269 -0.0014 609 ALA 81 O -0.0222 -0.0315 -0.0016 610 ALA 81 CB -0.0322 -0.0308 -0.0076 611 ALA 81 H -0.0214 -0.0117 -0.0049 612 ALA 81 HA -0.0345 -0.0203 -0.0110 613 ALA 81 1HB -0.0355 -0.0386 -0.0081 614 ALA 81 2HB -0.0379 -0.0271 -0.0117 615 ALA 81 3HB -0.0261 -0.0327 -0.0036 616 MET 82 N -0.0111 -0.0248 0.0024 617 MET 82 CA -0.0018 -0.0290 0.0081 618 MET 82 C 0.0017 -0.0220 0.0089 619 MET 82 O 0.0033 -0.0281 0.0108 620 MET 82 CB 0.0068 -0.0296 0.0129 621 MET 82 CG 0.0043 -0.0385 0.0130 622 MET 82 SD 0.0024 -0.0536 0.0143 623 MET 82 CE -0.0117 -0.0565 0.0072 624 MET 82 H -0.0106 -0.0208 0.0021 625 MET 82 HA -0.0037 -0.0378 0.0085 626 MET 82 1HB 0.0085 -0.0210 0.0125 627 MET 82 2HB 0.0138 -0.0320 0.0171 628 MET 82 1HG -0.0027 -0.0363 0.0088 629 MET 82 2HG 0.0107 -0.0380 0.0164 630 MET 82 1HE -0.0136 -0.0654 0.0076 631 MET 82 2HE -0.0151 -0.0505 0.0044 632 MET 82 3HE -0.0149 -0.0554 0.0053 633 MET 83 N -0.0036 -0.0138 0.0044 634 MET 83 CA 0.0010 -0.0048 0.0051 635 MET 83 C -0.0026 -0.0084 0.0041 636 MET 83 O 0.0021 -0.0047 0.0056 637 MET 83 CB -0.0026 0.0068 0.0016 638 MET 83 CG -0.0134 0.0091 -0.0037 639 MET 83 SD -0.0183 0.0215 -0.0079 640 MET 83 CE -0.0117 0.0324 -0.0067 641 MET 83 H -0.0111 -0.0159 0.0014 642 MET 83 HA 0.0096 -0.0047 0.0090 643 MET 83 1HB 0.0027 0.0135 0.0029 644 MET 83 2HB -0.0025 0.0075 0.0015 645 MET 83 1HG -0.0188 0.0020 -0.0050 646 MET 83 2HG -0.0129 0.0107 -0.0037 647 MET 83 1HE -0.0141 0.0406 -0.0091 648 MET 83 2HE -0.0138 0.0312 -0.0074 649 MET 83 3HE -0.0033 0.0321 -0.0028 650 MET 84 N -0.0119 -0.0150 0.0010 651 MET 84 CA -0.0169 -0.0195 -0.0006 652 MET 84 C -0.0149 -0.0326 0.0023 653 MET 84 O -0.0120 -0.0364 0.0042 654 MET 84 CB -0.0291 -0.0175 -0.0064 655 MET 84 CG -0.0326 -0.0049 -0.0100 656 MET 84 SD -0.0288 0.0026 -0.0094 657 MET 84 CE -0.0172 0.0114 -0.0055 658 MET 84 H -0.0153 -0.0181 -0.0001 659 MET 84 HA -0.0130 -0.0148 0.0004 660 MET 84 1HB -0.0328 -0.0214 -0.0075 661 MET 84 2HB -0.0326 -0.0218 -0.0074 662 MET 84 1HG -0.0291 0.0001 -0.0091 663 MET 84 2HG -0.0415 -0.0051 -0.0139 664 MET 84 1HE -0.0144 0.0164 -0.0050 665 MET 84 2HE -0.0110 0.0061 -0.0019 666 MET 84 3HE -0.0193 0.0173 -0.0074 667 PHE 85 N -0.0166 -0.0393 0.0026 668 PHE 85 CA -0.0149 -0.0531 0.0058 669 PHE 85 C -0.0026 -0.0549 0.0117 670 PHE 85 O -0.0009 -0.0627 0.0138 671 PHE 85 CB -0.0159 -0.0583 0.0063 672 PHE 85 CG -0.0139 -0.0720 0.0096 673 PHE 85 CD1 -0.0229 -0.0815 0.0071 674 PHE 85 CD2 -0.0027 -0.0755 0.0152 675 PHE 85 CE1 -0.0210 -0.0941 0.0102 676 PHE 85 CE2 -0.0007 -0.0881 0.0183 677 PHE 85 CZ -0.0099 -0.0974 0.0158 678 PHE 85 H -0.0192 -0.0356 0.0008 679 PHE 85 HA -0.0214 -0.0580 0.0037 680 PHE 85 1HB -0.0246 -0.0565 0.0020 681 PHE 85 2HB -0.0096 -0.0529 0.0082 682 PHE 85 HD1 -0.0316 -0.0789 0.0028 683 PHE 85 HD2 0.0045 -0.0682 0.0172 684 PHE 85 HE1 -0.0283 -0.1015 0.0082 685 PHE 85 HE2 0.0081 -0.0907 0.0227 686 PHE 85 HZ -0.0084 -0.1074 0.0182 687 GLY 86 N 0.0049 -0.0469 0.0138 688 GLY 86 CA 0.0166 -0.0456 0.0185 689 GLY 86 C 0.0191 -0.0344 0.0175 690 GLY 86 O 0.0280 -0.0283 0.0201 691 GLY 86 H 0.0026 -0.0416 0.0119 692 GLY 86 1HA 0.0189 -0.0534 0.0208 693 GLY 86 2HA 0.0214 -0.0451 0.0204 694 GLY 87 N 0.0115 -0.0310 0.0130 695 GLY 87 CA 0.0134 -0.0203 0.0122 696 GLY 87 C 0.0224 -0.0221 0.0161 697 GLY 87 O 0.0248 -0.0320 0.0185 698 GLY 87 H 0.0042 -0.0358 0.0108 699 GLY 87 1HA 0.0157 -0.0131 0.0121 700 GLY 87 2HA 0.0059 -0.0181 0.0088 701 ARG 88 N 0.0274 -0.0124 0.0168 702 ARG 88 CA 0.0362 -0.0121 0.0209 703 ARG 88 C 0.0463 -0.0139 0.0258 704 ARG 88 O 0.0544 -0.0141 0.0297 705 ARG 88 CB 0.0355 -0.0211 0.0216 706 ARG 88 CG 0.0265 -0.0207 0.0173 707 ARG 88 CD 0.0272 -0.0292 0.0185 708 ARG 88 NE 0.0183 -0.0294 0.0144 709 ARG 88 CZ 0.0172 -0.0226 0.0131 710 ARG 88 NH1 0.0244 -0.0149 0.0157 711 ARG 88 NH2 0.0089 -0.0238 0.0093 712 ARG 88 H 0.0246 -0.0050 0.0146 713 ARG 88 HA 0.0368 -0.0038 0.0202 714 ARG 88 1HB 0.0359 -0.0295 0.0227 715 ARG 88 2HB 0.0422 -0.0199 0.0246 716 ARG 88 1HG 0.0260 -0.0124 0.0161 717 ARG 88 2HG 0.0196 -0.0230 0.0143 718 ARG 88 1HD 0.0274 -0.0375 0.0196 719 ARG 88 2HD 0.0341 -0.0276 0.0216 720 ARG 88 HE 0.0126 -0.0352 0.0123 721 ARG 88 1HH1 0.0308 -0.0140 0.0186 722 ARG 88 2HH1 0.0235 -0.0099 0.0147 723 ARG 88 1HH2 0.0034 -0.0297 0.0074 724 ARG 88 2HH2 0.0080 -0.0188 0.0084 725 PHE 89 N 0.0460 -0.0142 0.0261 726 PHE 89 CA 0.0553 -0.0154 0.0312 727 PHE 89 C 0.0578 -0.0043 0.0318 728 PHE 89 O 0.0623 -0.0050 0.0342 729 PHE 89 CB 0.0537 -0.0263 0.0311 730 PHE 89 CG 0.0521 -0.0373 0.0310 731 PHE 89 CD1 0.0430 -0.0440 0.0266 732 PHE 89 CD2 0.0594 -0.0408 0.0352 733 PHE 89 CE1 0.0411 -0.0539 0.0263 734 PHE 89 CE2 0.0576 -0.0507 0.0349 735 PHE 89 CZ 0.0484 -0.0573 0.0304 736 PHE 89 H 0.0388 -0.0143 0.0223 737 PHE 89 HA 0.0621 -0.0167 0.0350 738 PHE 89 1HB 0.0466 -0.0253 0.0272 739 PHE 89 2HB 0.0602 -0.0275 0.0347 740 PHE 89 HD1 0.0374 -0.0414 0.0234 741 PHE 89 HD2 0.0665 -0.0357 0.0386 742 PHE 89 HE1 0.0336 -0.0590 0.0227 743 PHE 89 HE2 0.0635 -0.0533 0.0383 744 PHE 89 HZ 0.0469 -0.0652 0.0302 745 GLY 90 N 0.0563 0.0056 0.0265 746 GLY 90 CA 0.0593 0.0143 0.0255 747 GLY 90 C 0.0555 0.0222 0.0212 748 GLY 90 O 0.0523 0.0211 0.0198 749 GLY 90 H 0.0524 0.0057 0.0244 750 GLY 90 1HA 0.0663 0.0155 0.0288 751 GLY 90 2HA 0.0573 0.0138 0.0246 752 GLY 91 N 0.0571 0.0266 0.0154 753 GLY 91 CA 0.0528 0.0380 0.0119 754 GLY 91 C 0.0397 0.0377 0.0091 755 GLY 91 O 0.0347 0.0435 0.0067 756 GLY 91 H 0.0602 0.0250 0.0165 757 GLY 91 1HA 0.0556 0.0408 0.0119 758 GLY 91 2HA 0.0564 0.0441 0.0113 759 GLN 92 N 0.0343 0.0350 0.0122 760 GLN 92 CA 0.0226 0.0321 0.0080 761 GLN 92 C 0.0192 0.0303 0.0070 762 GLN 92 O 0.0257 0.0270 0.0100 763 GLN 92 CB 0.0190 0.0211 0.0083 764 GLN 92 CG 0.0196 0.0223 0.0083 765 GLN 92 CD 0.0305 0.0202 0.0129 766 GLN 92 NE2 0.0340 0.0278 0.0131 767 GLN 92 OE1 0.0359 0.0118 0.0163 768 GLN 92 H 0.0396 0.0303 0.0150 769 GLN 92 HA 0.0182 0.0394 0.0052 770 GLN 92 1HB 0.0242 0.0141 0.0114 771 GLN 92 2HB 0.0107 0.0183 0.0054 772 GLN 92 1HG 0.0138 0.0158 0.0070 773 GLN 92 2HG 0.0173 0.0309 0.0061 774 GLN 92 1HE2 0.0411 0.0269 0.0161 775 GLN 92 2HE2 0.0294 0.0345 0.0103 776 GLN 93 N 0.0084 0.0325 0.0027 777 GLN 93 CA 0.0031 0.0307 0.0008 778 GLN 93 C 0.0078 0.0394 0.0015 779 GLN 93 O 0.0060 0.0378 0.0010 780 GLN 93 CB 0.0041 0.0176 0.0029 781 GLN 93 CG -0.0016 0.0084 0.0018 782 GLN 93 CD -0.0006 -0.0039 0.0038 783 GLN 93 NE2 -0.0098 -0.0111 0.0011 784 GLN 93 OE1 0.0087 -0.0071 0.0079 785 GLN 93 H 0.0037 0.0356 0.0004 786 GLN 93 HA -0.0058 0.0323 -0.0029 787 GLN 93 1HB 0.0129 0.0155 0.0066 788 GLN 93 2HB 0.0004 0.0165 0.0016 789 GLN 93 1HG -0.0104 0.0101 -0.0019 790 GLN 93 2HG 0.0022 0.0091 0.0032 791 GLN 93 1HE2 -0.0094 -0.0196 0.0024 792 GLN 93 2HE2 -0.0173 -0.0081 -0.0022 793 GLN 94 N 0.0129 0.0525 0.0030 794 GLN 94 CA 0.0180 0.0641 0.0032 795 GLN 94 C 0.0067 0.0720 -0.0003 796 GLN 94 O 0.0080 0.0803 -0.0008 797 GLN 94 CB 0.0265 0.0721 0.0045 798 GLN 94 CG 0.0194 0.0798 0.0020 799 GLN 94 CD 0.0147 0.0716 0.0017 800 GLN 94 NE2 0.0150 0.0777 0.0012 801 GLN 94 OE1 0.0109 0.0601 0.0018 802 GLN 94 H 0.0138 0.0518 0.0033 803 GLN 94 HA 0.0237 0.0611 0.0048 804 GLN 94 1HB 0.0323 0.0792 0.0052 805 GLN 94 2HB 0.0331 0.0656 0.0067 806 GLN 94 1HG 0.0115 0.0847 -0.0003 807 GLN 94 2HG 0.0262 0.0872 0.0030 808 GLN 94 1HE2 0.0120 0.0729 0.0009 809 GLN 94 2HE2 0.0181 0.0870 0.0011