1 GLU 33 N 0.0701 0.1094 0.0720 2 GLU 33 CA 0.0745 0.1027 0.0502 3 GLU 33 C 0.0630 0.0909 0.0500 4 GLU 33 O 0.0667 0.0858 0.0329 5 GLU 33 CB 0.0739 0.0930 0.0325 6 GLU 33 CG 0.0562 0.0767 0.0360 7 GLU 33 CD 0.0438 0.0591 0.0264 8 GLU 33 OE1 0.0503 0.0583 0.0119 9 GLU 33 OE2 0.0277 0.0462 0.0329 10 GLY 34 N 0.0531 0.0844 0.0604 11 GLY 34 CA 0.0404 0.0687 0.0581 12 GLY 34 C 0.0282 0.0525 0.0456 13 GLY 34 O 0.0263 0.0504 0.0466 14 LYS 35 N 0.0218 0.0416 0.0328 15 LYS 35 CA 0.0187 0.0340 0.0285 16 LYS 35 C 0.0199 0.0317 0.0208 17 LYS 35 O 0.0212 0.0341 0.0211 18 LYS 35 CB 0.0130 0.0278 0.0345 19 LYS 35 CG 0.0108 0.0263 0.0385 20 LYS 35 CD 0.0052 0.0199 0.0440 21 LYS 35 CE 0.0027 0.0185 0.0490 22 LYS 35 NZ -0.0028 0.0120 0.0541 23 PRO 36 N 0.0166 0.0281 0.0119 24 PRO 36 CA 0.0162 0.0257 0.0047 25 PRO 36 C 0.0112 0.0176 0.0041 26 PRO 36 O 0.0080 0.0136 0.0084 27 PRO 36 CB 0.0187 0.0280 -0.0027 28 PRO 36 CG 0.0179 0.0274 0.0003 29 PRO 36 CD 0.0179 0.0296 0.0093 30 TRP 37 N 0.0133 0.0159 -0.0004 31 TRP 37 CA 0.0126 0.0105 -0.0014 32 TRP 37 C 0.0108 0.0033 -0.0014 33 TRP 37 O 0.0089 -0.0016 -0.0000 34 TRP 37 CB 0.0161 0.0112 -0.0076 35 TRP 37 CG 0.0187 0.0098 -0.0130 36 TRP 37 CD1 0.0211 0.0144 -0.0154 37 TRP 37 CD2 0.0192 0.0034 -0.0168 38 TRP 37 CE2 0.0220 0.0044 -0.0214 39 TRP 37 CE3 0.0176 -0.0032 -0.0167 40 TRP 37 NE1 0.0231 0.0112 -0.0205 41 TRP 37 CZ2 0.0231 -0.0009 -0.0259 42 TRP 37 CZ3 0.0188 -0.0084 -0.0212 43 TRP 37 CH2 0.0215 -0.0073 -0.0257 44 TRP 38 N 0.0114 0.0024 -0.0029 45 TRP 38 CA 0.0096 -0.0035 -0.0019 46 TRP 38 C 0.0055 -0.0057 0.0037 47 TRP 38 O 0.0041 -0.0111 0.0042 48 TRP 38 CB 0.0098 -0.0020 -0.0018 49 TRP 38 CG 0.0082 -0.0076 -0.0011 50 TRP 38 CD1 0.0090 -0.0134 -0.0043 51 TRP 38 CD2 0.0048 -0.0088 0.0038 52 TRP 38 CE2 0.0041 -0.0152 0.0029 53 TRP 38 CE3 0.0025 -0.0050 0.0088 54 TRP 38 NE1 0.0067 -0.0179 -0.0022 55 TRP 38 CZ2 0.0011 -0.0179 0.0068 56 TRP 38 CZ3 -0.0005 -0.0076 0.0126 57 TRP 38 CH2 -0.0011 -0.0139 0.0116 58 LEU 39 N 0.0056 -0.0048 0.0084 59 LEU 39 CA -0.0015 -0.0058 0.0125 60 LEU 39 C -0.0026 -0.0037 0.0132 61 LEU 39 O -0.0067 -0.0075 0.0155 62 LEU 39 CB -0.0056 -0.0006 0.0150 63 LEU 39 CG -0.0131 -0.0017 0.0195 64 LEU 39 CD1 -0.0148 0.0000 0.0205 65 LEU 39 CD2 -0.0168 0.0037 0.0218 66 VAL 40 N 0.0015 -0.0034 0.0142 67 VAL 40 CA 0.0003 -0.0068 0.0161 68 VAL 40 C -0.0004 -0.0141 0.0127 69 VAL 40 O -0.0024 -0.0191 0.0161 70 VAL 40 CB 0.0017 -0.0023 0.0143 71 VAL 40 CG1 0.0006 -0.0061 0.0154 72 VAL 40 CG2 0.0019 0.0044 0.0187 73 VAL 41 N 0.0009 -0.0123 0.0085 74 VAL 41 CA 0.0017 -0.0169 0.0068 75 VAL 41 C 0.0010 -0.0197 0.0102 76 VAL 41 O 0.0011 -0.0237 0.0111 77 VAL 41 CB 0.0029 -0.0166 0.0024 78 VAL 41 CG1 0.0037 -0.0214 0.0009 79 VAL 41 CG2 0.0036 -0.0141 -0.0009 80 VAL 42 N 0.0011 -0.0212 0.0117 81 VAL 42 CA -0.0007 -0.0244 0.0142 82 VAL 42 C -0.0032 -0.0245 0.0168 83 VAL 42 O -0.0037 -0.0278 0.0180 84 VAL 42 CB -0.0019 -0.0238 0.0153 85 VAL 42 CG1 -0.0044 -0.0263 0.0184 86 VAL 42 CG2 0.0005 -0.0252 0.0131 87 GLY 43 N -0.0043 -0.0220 0.0162 88 GLY 43 CA -0.0043 -0.0216 0.0153 89 GLY 43 C -0.0019 -0.0213 0.0141 90 GLY 43 O -0.0011 -0.0214 0.0143 91 VAL 44 N -0.0001 -0.0214 0.0143 92 VAL 44 CA 0.0013 -0.0204 0.0138 93 VAL 44 C 0.0026 -0.0199 0.0150 94 VAL 44 O 0.0037 -0.0191 0.0145 95 VAL 44 CB 0.0015 -0.0203 0.0136 96 VAL 44 CG1 0.0032 -0.0193 0.0137 97 VAL 44 CG2 0.0007 -0.0204 0.0120 98 LEU 45 N 0.0040 -0.0202 0.0151 99 LEU 45 CA 0.0058 -0.0211 0.0171 100 LEU 45 C 0.0051 -0.0215 0.0178 101 LEU 45 O 0.0069 -0.0216 0.0184 102 LEU 45 CB 0.0058 -0.0223 0.0194 103 LEU 45 CG 0.0077 -0.0222 0.0196 104 LEU 45 CD1 0.0106 -0.0220 0.0198 105 LEU 45 CD2 0.0074 -0.0212 0.0176 106 VAL 46 N 0.0022 -0.0233 0.0171 107 VAL 46 CA 0.0013 -0.0237 0.0165 108 VAL 46 C 0.0015 -0.0212 0.0138 109 VAL 46 O 0.0023 -0.0205 0.0137 110 VAL 46 CB -0.0017 -0.0261 0.0164 111 VAL 46 CG1 -0.0018 -0.0286 0.0193 112 VAL 46 CG2 -0.0040 -0.0261 0.0140 113 VAL 46 H 0.0009 -0.0245 0.0171 114 VAL 46 HA 0.0028 -0.0239 0.0184 115 VAL 46 HB -0.0022 -0.0263 0.0161 116 VAL 46 1HG1 -0.0039 -0.0303 0.0192 117 VAL 46 2HG1 -0.0002 -0.0287 0.0211 118 VAL 46 3HG1 -0.0014 -0.0285 0.0197 119 VAL 46 1HG2 -0.0061 -0.0279 0.0140 120 VAL 46 2HG2 -0.0036 -0.0260 0.0144 121 VAL 46 3HG2 -0.0041 -0.0244 0.0119 122 VAL 47 N 0.0015 -0.0200 0.0121 123 VAL 47 CA 0.0017 -0.0175 0.0095 124 VAL 47 C 0.0041 -0.0148 0.0105 125 VAL 47 O 0.0046 -0.0130 0.0093 126 VAL 47 CB 0.0008 -0.0171 0.0076 127 VAL 47 CG1 0.0014 -0.0142 0.0051 128 VAL 47 CG2 -0.0017 -0.0196 0.0063 129 VAL 47 H 0.0009 -0.0212 0.0127 130 VAL 47 HA 0.0007 -0.0178 0.0081 131 VAL 47 HB 0.0017 -0.0171 0.0091 132 VAL 47 1HG1 0.0007 -0.0140 0.0038 133 VAL 47 2HG1 0.0032 -0.0123 0.0061 134 VAL 47 3HG1 0.0005 -0.0141 0.0037 135 VAL 47 1HG2 -0.0023 -0.0194 0.0049 136 VAL 47 2HG2 -0.0025 -0.0196 0.0048 137 VAL 47 3HG2 -0.0020 -0.0217 0.0081 138 GLY 48 N 0.0059 -0.0142 0.0127 139 GLY 48 CA 0.0086 -0.0109 0.0138 140 GLY 48 C 0.0094 -0.0105 0.0148 141 GLY 48 O 0.0108 -0.0075 0.0140 142 GLY 48 H 0.0055 -0.0160 0.0139 143 GLY 48 1HA 0.0088 -0.0087 0.0116 144 GLY 48 2HA 0.0099 -0.0110 0.0162 145 LEU 49 N 0.0091 -0.0135 0.0163 146 LEU 49 CA 0.0096 -0.0138 0.0172 147 LEU 49 C 0.0078 -0.0127 0.0140 148 LEU 49 O 0.0091 -0.0106 0.0138 149 LEU 49 CB 0.0086 -0.0179 0.0193 150 LEU 49 CG 0.0104 -0.0195 0.0230 151 LEU 49 CD1 0.0087 -0.0238 0.0243 152 LEU 49 CD2 0.0135 -0.0177 0.0254 153 LEU 49 H 0.0082 -0.0158 0.0170 154 LEU 49 HA 0.0120 -0.0120 0.0187 155 LEU 49 1HB 0.0063 -0.0197 0.0178 156 LEU 49 2HB 0.0087 -0.0182 0.0196 157 LEU 49 HG 0.0107 -0.0191 0.0229 158 LEU 49 1HD1 0.0100 -0.0250 0.0269 159 LEU 49 2HD1 0.0066 -0.0251 0.0226 160 LEU 49 3HD1 0.0085 -0.0243 0.0244 161 LEU 49 1HD2 0.0148 -0.0189 0.0280 162 LEU 49 2HD2 0.0132 -0.0182 0.0254 163 LEU 49 3HD2 0.0147 -0.0147 0.0244 164 LEU 50 N 0.0047 -0.0136 0.0110 165 LEU 50 CA 0.0034 -0.0127 0.0080 166 LEU 50 C 0.0041 -0.0090 0.0065 167 LEU 50 O 0.0041 -0.0073 0.0052 168 LEU 50 CB 0.0012 -0.0150 0.0057 169 LEU 50 CG 0.0001 -0.0187 0.0067 170 LEU 50 CD1 -0.0019 -0.0209 0.0047 171 LEU 50 CD2 -0.0004 -0.0191 0.0061 172 LEU 50 H 0.0041 -0.0155 0.0113 173 LEU 50 HA 0.0035 -0.0130 0.0084 174 LEU 50 1HB 0.0012 -0.0149 0.0057 175 LEU 50 2HB 0.0002 -0.0140 0.0033 176 LEU 50 HG 0.0011 -0.0196 0.0092 177 LEU 50 1HD1 -0.0026 -0.0235 0.0054 178 LEU 50 2HD1 -0.0016 -0.0207 0.0051 179 LEU 50 3HD1 -0.0030 -0.0200 0.0022 180 LEU 50 1HD2 -0.0011 -0.0218 0.0068 181 LEU 50 2HD2 -0.0014 -0.0182 0.0036 182 LEU 50 3HD2 0.0010 -0.0177 0.0076 183 VAL 51 N 0.0051 -0.0066 0.0065 184 VAL 51 CA 0.0059 -0.0021 0.0048 185 VAL 51 C 0.0083 0.0008 0.0068 186 VAL 51 O 0.0084 0.0039 0.0049 187 VAL 51 CB 0.0065 -0.0010 0.0049 188 VAL 51 CG1 0.0077 0.0039 0.0036 189 VAL 51 CG2 0.0038 -0.0034 0.0023 190 VAL 51 H 0.0052 -0.0085 0.0079 191 VAL 51 HA 0.0042 -0.0016 0.0016 192 VAL 51 HB 0.0079 -0.0019 0.0080 193 VAL 51 1HG1 0.0081 0.0047 0.0038 194 VAL 51 2HG1 0.0096 0.0057 0.0055 195 VAL 51 3HG1 0.0062 0.0050 0.0006 196 VAL 51 1HG2 0.0042 -0.0026 0.0024 197 VAL 51 2HG2 0.0024 -0.0024 -0.0008 198 VAL 51 3HG2 0.0030 -0.0068 0.0033 199 GLY 52 N 0.0108 -0.0000 0.0100 200 GLY 52 CA 0.0137 0.0027 0.0123 201 GLY 52 C 0.0132 0.0024 0.0118 202 GLY 52 O 0.0145 0.0059 0.0111 203 GLY 52 H 0.0105 -0.0026 0.0115 204 GLY 52 1HA 0.0148 0.0061 0.0113 205 GLY 52 2HA 0.0153 0.0015 0.0156 206 MET 53 N 0.0109 -0.0020 0.0117 207 MET 53 CA 0.0103 -0.0026 0.0113 208 MET 53 C 0.0088 -0.0002 0.0078 209 MET 53 O 0.0093 0.0013 0.0075 210 MET 53 CB 0.0087 -0.0070 0.0119 211 MET 53 CG 0.0104 -0.0094 0.0158 212 MET 53 SD 0.0087 -0.0146 0.0167 213 MET 53 CE 0.0058 -0.0168 0.0143 214 MET 53 H 0.0101 -0.0043 0.0121 215 MET 53 HA 0.0123 -0.0016 0.0134 216 MET 53 1HB 0.0069 -0.0082 0.0102 217 MET 53 2HB 0.0079 -0.0075 0.0112 218 MET 53 1HG 0.0123 -0.0080 0.0175 219 MET 53 2HG 0.0111 -0.0092 0.0166 220 MET 53 1HE 0.0046 -0.0199 0.0146 221 MET 53 2HE 0.0067 -0.0164 0.0152 222 MET 53 3HE 0.0045 -0.0153 0.0115 223 VAL 54 N 0.0069 0.0003 0.0053 224 VAL 54 CA 0.0047 0.0031 0.0018 225 VAL 54 C 0.0067 0.0081 0.0022 226 VAL 54 O 0.0064 0.0103 0.0010 227 VAL 54 CB 0.0021 0.0028 -0.0012 228 VAL 54 CG1 0.0001 0.0063 -0.0048 229 VAL 54 CG2 -0.0001 -0.0023 -0.0019 230 VAL 54 H 0.0068 -0.0012 0.0057 231 VAL 54 HA 0.0036 0.0017 0.0009 232 VAL 54 HB 0.0033 0.0036 -0.0002 233 VAL 54 1HG1 -0.0018 0.0060 -0.0069 234 VAL 54 2HG1 0.0017 0.0099 -0.0043 235 VAL 54 3HG1 -0.0010 0.0055 -0.0059 236 VAL 54 1HG2 -0.0020 -0.0026 -0.0040 237 VAL 54 2HG2 -0.0012 -0.0031 -0.0029 238 VAL 54 3HG2 0.0014 -0.0047 0.0007 239 GLY 55 N 0.0093 0.0110 0.0029 240 GLY 55 CA 0.0120 0.0166 0.0030 241 GLY 55 C 0.0147 0.0174 0.0054 242 GLY 55 O 0.0155 0.0217 0.0042 243 GLY 55 H 0.0094 0.0089 0.0040 244 GLY 55 1HA 0.0100 0.0194 -0.0002 245 GLY 55 2HA 0.0141 0.0177 0.0047 246 MET 56 N 0.0161 0.0131 0.0081 247 MET 56 CA 0.0187 0.0131 0.0104 248 MET 56 C 0.0167 0.0141 0.0082 249 MET 56 O 0.0189 0.0169 0.0088 250 MET 56 CB 0.0195 0.0080 0.0136 251 MET 56 CG 0.0224 0.0068 0.0167 252 MET 56 SD 0.0224 0.0003 0.0199 253 MET 56 CE 0.0249 -0.0001 0.0222 254 MET 56 H 0.0155 0.0102 0.0090 255 MET 56 HA 0.0217 0.0161 0.0116 256 MET 56 1HB 0.0165 0.0051 0.0124 257 MET 56 2HB 0.0208 0.0078 0.0148 258 MET 56 1HG 0.0256 0.0092 0.0184 259 MET 56 2HG 0.0215 0.0076 0.0156 260 MET 56 1HE 0.0250 -0.0040 0.0242 261 MET 56 2HE 0.0230 0.0008 0.0201 262 MET 56 3HE 0.0280 0.0025 0.0237 263 THR 57 N 0.0128 0.0118 0.0053 264 THR 57 CA 0.0103 0.0121 0.0033 265 THR 57 C 0.0079 0.0171 -0.0002 266 THR 57 O 0.0069 0.0193 -0.0017 267 THR 57 CB 0.0070 0.0065 0.0026 268 THR 57 CG2 0.0049 0.0069 0.0008 269 THR 57 OG1 0.0097 0.0021 0.0061 270 THR 57 H 0.0112 0.0098 0.0047 271 THR 57 HA 0.0129 0.0128 0.0050 272 THR 57 HB 0.0043 0.0055 0.0008 273 THR 57 HG1 0.0110 0.0015 0.0073 274 THR 57 1HG2 0.0026 0.0030 0.0003 275 THR 57 2HG2 0.0029 0.0102 -0.0018 276 THR 57 3HG2 0.0076 0.0078 0.0026 277 VAL 58 N 0.0069 0.0188 -0.0016 278 VAL 58 CA 0.0047 0.0240 -0.0051 279 VAL 58 C 0.0085 0.0292 -0.0039 280 VAL 58 O 0.0073 0.0329 -0.0061 281 VAL 58 CB 0.0030 0.0249 -0.0067 282 VAL 58 CG1 0.0014 0.0308 -0.0100 283 VAL 58 CG2 -0.0013 0.0199 -0.0084 284 VAL 58 H 0.0076 0.0166 -0.0003 285 VAL 58 HA 0.0016 0.0235 -0.0074 286 VAL 58 HB 0.0060 0.0249 -0.0043 287 VAL 58 1HG1 0.0002 0.0314 -0.0112 288 VAL 58 2HG1 0.0045 0.0344 -0.0088 289 VAL 58 3HG1 -0.0016 0.0309 -0.0124 290 VAL 58 1HG2 -0.0025 0.0205 -0.0096 291 VAL 58 2HG2 -0.0042 0.0200 -0.0108 292 VAL 58 3HG2 -0.0001 0.0157 -0.0061 293 ALA 59 N 0.0129 0.0294 -0.0010 294 ALA 59 CA 0.0169 0.0341 0.0005 295 ALA 59 C 0.0182 0.0342 0.0015 296 ALA 59 O 0.0194 0.0389 0.0006 297 ALA 59 CB 0.0212 0.0335 0.0043 298 ALA 59 H 0.0134 0.0263 0.0007 299 ALA 59 HA 0.0160 0.0381 -0.0019 300 ALA 59 1HB 0.0243 0.0370 0.0053 301 ALA 59 2HB 0.0204 0.0335 0.0036 302 ALA 59 3HB 0.0221 0.0294 0.0067 303 SER 60 N 0.0178 0.0290 0.0032 304 SER 60 CA 0.0188 0.0288 0.0040 305 SER 60 C 0.0144 0.0300 0.0002 306 SER 60 O 0.0150 0.0321 -0.0001 307 SER 60 CB 0.0198 0.0228 0.0069 308 SER 60 OG 0.0154 0.0184 0.0052 309 SER 60 H 0.0171 0.0251 0.0040 310 SER 60 HA 0.0220 0.0321 0.0053 311 SER 60 1HB 0.0213 0.0230 0.0080 312 SER 60 2HB 0.0225 0.0217 0.0095 313 SER 60 HG 0.0165 0.0147 0.0074 314 GLY 61 N 0.0098 0.0288 -0.0026 315 GLY 61 CA 0.0050 0.0300 -0.0064 316 GLY 61 C 0.0027 0.0250 -0.0065 317 GLY 61 O -0.0002 0.0261 -0.0088 318 GLY 61 H 0.0096 0.0269 -0.0022 319 GLY 61 1HA 0.0023 0.0303 -0.0084 320 GLY 61 2HA 0.0058 0.0343 -0.0073 321 SER 62 N 0.0033 0.0196 -0.0038 322 SER 62 CA 0.0011 0.0151 -0.0042 323 SER 62 C -0.0039 0.0123 -0.0068 324 SER 62 O -0.0043 0.0083 -0.0060 325 SER 62 CB 0.0046 0.0105 -0.0007 326 SER 62 OG 0.0022 0.0060 -0.0012 327 SER 62 H 0.0056 0.0188 -0.0021 328 SER 62 HA 0.0006 0.0172 -0.0051 329 SER 62 1HB 0.0081 0.0126 0.0010 330 SER 62 2HB 0.0058 0.0088 0.0004 331 SER 62 HG 0.0049 0.0037 0.0011 332 ARG 63 N -0.0076 0.0141 -0.0095 333 ARG 63 CA -0.0131 0.0119 -0.0126 334 ARG 63 C -0.0146 0.0050 -0.0114 335 ARG 63 O -0.0176 0.0020 -0.0125 336 ARG 63 CB -0.0168 0.0150 -0.0161 337 ARG 63 CG -0.0163 0.0219 -0.0180 338 ARG 63 CD -0.0188 0.0234 -0.0202 339 ARG 63 NE -0.0183 0.0300 -0.0220 340 ARG 63 CZ -0.0193 0.0329 -0.0236 341 ARG 63 NH1 -0.0209 0.0297 -0.0237 342 ARG 63 NH2 -0.0186 0.0389 -0.0251 343 ARG 63 H -0.0065 0.0176 -0.0099 344 ARG 63 HA -0.0136 0.0129 -0.0133 345 ARG 63 1HB -0.0160 0.0143 -0.0153 346 ARG 63 2HB -0.0208 0.0129 -0.0182 347 ARG 63 1HG -0.0122 0.0240 -0.0159 348 ARG 63 2HG -0.0183 0.0239 -0.0200 349 ARG 63 1HD -0.0230 0.0214 -0.0224 350 ARG 63 2HD -0.0168 0.0217 -0.0183 351 ARG 63 HE -0.0170 0.0327 -0.0220 352 ARG 63 1HH1 -0.0215 0.0251 -0.0226 353 ARG 63 2HH1 -0.0216 0.0319 -0.0249 354 ARG 63 1HH2 -0.0173 0.0413 -0.0250 355 ARG 63 2HH2 -0.0193 0.0410 -0.0263 356 LEU 64 N -0.0126 0.0025 -0.0097 357 LEU 64 CA -0.0138 -0.0040 -0.0089 358 LEU 64 C -0.0110 -0.0069 -0.0065 359 LEU 64 O -0.0131 -0.0114 -0.0067 360 LEU 64 CB -0.0122 -0.0061 -0.0074 361 LEU 64 CG -0.0154 -0.0041 -0.0098 362 LEU 64 CD1 -0.0129 -0.0061 -0.0078 363 LEU 64 CD2 -0.0212 -0.0066 -0.0127 364 LEU 64 H -0.0104 0.0048 -0.0089 365 LEU 64 HA -0.0180 -0.0052 -0.0111 366 LEU 64 1HB -0.0081 -0.0045 -0.0053 367 LEU 64 2HB -0.0127 -0.0109 -0.0066 368 LEU 64 HG -0.0151 0.0008 -0.0107 369 LEU 64 1HD1 -0.0150 -0.0047 -0.0094 370 LEU 64 2HD1 -0.0089 -0.0042 -0.0058 371 LEU 64 3HD1 -0.0132 -0.0109 -0.0069 372 LEU 64 1HD2 -0.0233 -0.0051 -0.0143 373 LEU 64 2HD2 -0.0215 -0.0113 -0.0117 374 LEU 64 3HD2 -0.0230 -0.0051 -0.0141 375 PHE 65 N -0.0064 -0.0042 -0.0043 376 PHE 65 CA -0.0035 -0.0065 -0.0021 377 PHE 65 C -0.0053 -0.0050 -0.0035 378 PHE 65 O -0.0049 -0.0082 -0.0025 379 PHE 65 CB 0.0019 -0.0051 0.0009 380 PHE 65 CG 0.0037 -0.0089 0.0028 381 PHE 65 CD1 0.0028 -0.0083 0.0021 382 PHE 65 CD2 0.0065 -0.0132 0.0054 383 PHE 65 CE1 0.0045 -0.0119 0.0039 384 PHE 65 CE2 0.0082 -0.0168 0.0072 385 PHE 65 CZ 0.0073 -0.0161 0.0065 386 PHE 65 H -0.0049 -0.0006 -0.0042 387 PHE 65 HA -0.0041 -0.0111 -0.0015 388 PHE 65 1HB 0.0026 -0.0008 0.0005 389 PHE 65 2HB 0.0039 -0.0056 0.0022 390 PHE 65 HD1 0.0006 -0.0050 0.0001 391 PHE 65 HD2 0.0073 -0.0137 0.0059 392 PHE 65 HE1 0.0038 -0.0114 0.0034 393 PHE 65 HE2 0.0104 -0.0201 0.0092 394 PHE 65 HZ 0.0087 -0.0190 0.0079 395 LEU 66 N -0.0073 -0.0008 -0.0055 396 LEU 66 CA -0.0098 0.0003 -0.0074 397 LEU 66 C -0.0141 -0.0044 -0.0088 398 LEU 66 O -0.0154 -0.0064 -0.0091 399 LEU 66 CB -0.0113 0.0062 -0.0102 400 LEU 66 CG -0.0069 0.0112 -0.0089 401 LEU 66 CD1 -0.0086 0.0168 -0.0117 402 LEU 66 CD2 -0.0045 0.0113 -0.0073 403 LEU 66 H -0.0071 0.0020 -0.0062 404 LEU 66 HA -0.0073 -0.0001 -0.0057 405 LEU 66 1HB -0.0134 0.0067 -0.0117 406 LEU 66 2HB -0.0137 0.0065 -0.0118 407 LEU 66 HG -0.0043 0.0107 -0.0070 408 LEU 66 1HD1 -0.0054 0.0202 -0.0106 409 LEU 66 2HD1 -0.0103 0.0168 -0.0127 410 LEU 66 3HD1 -0.0113 0.0175 -0.0136 411 LEU 66 1HD2 -0.0016 0.0146 -0.0064 412 LEU 66 2HD2 -0.0072 0.0119 -0.0093 413 LEU 66 3HD2 -0.0031 0.0074 -0.0052 414 GLY 67 N -0.0165 -0.0054 -0.0089 415 GLY 67 CA -0.0203 -0.0098 -0.0097 416 GLY 67 C -0.0177 -0.0148 -0.0078 417 GLY 67 O -0.0195 -0.0175 -0.0081 418 GLY 67 H -0.0159 -0.0039 -0.0089 419 GLY 67 1HA -0.0231 -0.0086 -0.0112 420 GLY 67 2HA -0.0222 -0.0108 -0.0104 421 ALA 68 N -0.0134 -0.0163 -0.0061 422 ALA 68 CA -0.0105 -0.0205 -0.0046 423 ALA 68 C -0.0089 -0.0193 -0.0042 424 ALA 68 O -0.0087 -0.0227 -0.0038 425 ALA 68 CB -0.0060 -0.0214 -0.0030 426 ALA 68 H -0.0125 -0.0145 -0.0060 427 ALA 68 HA -0.0128 -0.0240 -0.0050 428 ALA 68 1HB -0.0040 -0.0246 -0.0020 429 ALA 68 2HB -0.0072 -0.0223 -0.0033 430 ALA 68 3HB -0.0036 -0.0180 -0.0026 431 GLY 69 N -0.0091 -0.0156 -0.0033 432 GLY 69 CA -0.0077 -0.0152 -0.0023 433 GLY 69 C -0.0090 -0.0166 -0.0034 434 GLY 69 O -0.0078 -0.0170 -0.0026 435 GLY 69 H -0.0097 -0.0137 -0.0033 436 GLY 69 1HA -0.0057 -0.0162 -0.0010 437 GLY 69 2HA -0.0077 -0.0127 -0.0018 438 ALA 70 N -0.0107 -0.0176 -0.0034 439 ALA 70 CA -0.0101 -0.0181 -0.0040 440 ALA 70 C -0.0077 -0.0195 -0.0050 441 ALA 70 O -0.0066 -0.0200 -0.0052 442 ALA 70 CB -0.0123 -0.0187 -0.0057 443 ALA 70 H -0.0124 -0.0176 -0.0042 444 ALA 70 HA -0.0099 -0.0172 -0.0025 445 ALA 70 1HB -0.0118 -0.0191 -0.0060 446 ALA 70 2HB -0.0141 -0.0177 -0.0050 447 ALA 70 3HB -0.0125 -0.0196 -0.0071 448 ILE 71 N -0.0063 -0.0206 -0.0051 449 ILE 71 CA -0.0045 -0.0208 -0.0062 450 ILE 71 C -0.0028 -0.0197 -0.0051 451 ILE 71 O -0.0014 -0.0196 -0.0055 452 ILE 71 CB -0.0042 -0.0215 -0.0076 453 ILE 71 CG1 -0.0057 -0.0227 -0.0090 454 ILE 71 CG2 -0.0021 -0.0215 -0.0085 455 ILE 71 CD1 -0.0056 -0.0232 -0.0100 456 ILE 71 H -0.0072 -0.0209 -0.0053 457 ILE 71 HA -0.0045 -0.0211 -0.0068 458 ILE 71 HB -0.0046 -0.0213 -0.0071 459 ILE 71 1HG1 -0.0072 -0.0227 -0.0083 460 ILE 71 2HG1 -0.0056 -0.0232 -0.0099 461 ILE 71 1HG2 -0.0020 -0.0221 -0.0096 462 ILE 71 2HG2 -0.0011 -0.0207 -0.0076 463 ILE 71 3HG2 -0.0018 -0.0218 -0.0091 464 ILE 71 1HD1 -0.0067 -0.0240 -0.0108 465 ILE 71 2HD1 -0.0042 -0.0233 -0.0107 466 ILE 71 3HD1 -0.0058 -0.0228 -0.0091 467 PHE 72 N -0.0034 -0.0195 -0.0034 468 PHE 72 CA -0.0022 -0.0199 -0.0023 469 PHE 72 C -0.0031 -0.0206 -0.0037 470 PHE 72 O -0.0024 -0.0224 -0.0037 471 PHE 72 CB -0.0015 -0.0179 -0.0006 472 PHE 72 CG -0.0007 -0.0171 0.0007 473 PHE 72 CD1 -0.0008 -0.0148 0.0018 474 PHE 72 CD2 0.0001 -0.0185 0.0009 475 PHE 72 CE1 -0.0001 -0.0138 0.0030 476 PHE 72 CE2 0.0008 -0.0175 0.0021 477 PHE 72 CZ 0.0007 -0.0152 0.0031 478 PHE 72 H -0.0039 -0.0179 -0.0032 479 PHE 72 HA -0.0010 -0.0215 -0.0018 480 PHE 72 1HB -0.0025 -0.0164 -0.0009 481 PHE 72 2HB -0.0005 -0.0185 0.0002 482 PHE 72 HD1 -0.0014 -0.0137 0.0017 483 PHE 72 HD2 0.0002 -0.0203 0.0001 484 PHE 72 HE1 -0.0002 -0.0120 0.0038 485 PHE 72 HE2 0.0014 -0.0186 0.0022 486 PHE 72 HZ 0.0012 -0.0144 0.0041 487 ALA 73 N -0.0018 -0.0199 -0.0006 488 ALA 73 CA -0.0004 -0.0196 0.0005 489 ALA 73 C 0.0008 -0.0185 -0.0008 490 ALA 73 O 0.0025 -0.0178 -0.0004 491 ALA 73 CB -0.0013 -0.0204 0.0017 492 ALA 73 H -0.0031 -0.0206 -0.0003 493 ALA 73 HA 0.0005 -0.0195 0.0015 494 ALA 73 1HB -0.0021 -0.0212 0.0027 495 ALA 73 2HB -0.0022 -0.0206 0.0008 496 ALA 73 3HB -0.0003 -0.0203 0.0026 497 ILE 74 N -0.0004 -0.0189 -0.0021 498 ILE 74 CA 0.0011 -0.0176 -0.0029 499 ILE 74 C 0.0028 -0.0160 -0.0043 500 ILE 74 O 0.0046 -0.0146 -0.0039 501 ILE 74 CB 0.0000 -0.0182 -0.0046 502 ILE 74 CG1 0.0016 -0.0169 -0.0047 503 ILE 74 CG2 -0.0006 -0.0183 -0.0075 504 ILE 74 CD1 0.0023 -0.0168 -0.0020 505 ILE 74 H -0.0019 -0.0201 -0.0027 506 ILE 74 HA 0.0018 -0.0173 -0.0011 507 ILE 74 HB -0.0013 -0.0195 -0.0037 508 ILE 74 1HG1 0.0007 -0.0174 -0.0059 509 ILE 74 2HG1 0.0029 -0.0157 -0.0056 510 ILE 74 1HG2 -0.0014 -0.0187 -0.0085 511 ILE 74 2HG2 -0.0016 -0.0191 -0.0075 512 ILE 74 3HG2 0.0008 -0.0170 -0.0084 513 ILE 74 1HD1 0.0033 -0.0159 -0.0023 514 ILE 74 2HD1 0.0032 -0.0163 -0.0007 515 ILE 74 3HD1 0.0009 -0.0180 -0.0010 516 PHE 75 N 0.0023 -0.0161 -0.0048 517 PHE 75 CA 0.0034 -0.0142 -0.0063 518 PHE 75 C 0.0041 -0.0126 -0.0051 519 PHE 75 O 0.0051 -0.0107 -0.0051 520 PHE 75 CB 0.0032 -0.0149 -0.0088 521 PHE 75 CG 0.0029 -0.0157 -0.0103 522 PHE 75 CD1 0.0019 -0.0178 -0.0105 523 PHE 75 CD2 0.0038 -0.0143 -0.0116 524 PHE 75 CE1 0.0016 -0.0185 -0.0119 525 PHE 75 CE2 0.0036 -0.0150 -0.0130 526 PHE 75 CZ 0.0025 -0.0171 -0.0132 527 PHE 75 H 0.0016 -0.0175 -0.0054 528 PHE 75 HA 0.0038 -0.0135 -0.0064 529 PHE 75 1HB 0.0025 -0.0162 -0.0087 530 PHE 75 2HB 0.0040 -0.0136 -0.0096 531 PHE 75 HD1 0.0012 -0.0189 -0.0095 532 PHE 75 HD2 0.0047 -0.0126 -0.0115 533 PHE 75 HE1 0.0007 -0.0201 -0.0120 534 PHE 75 HE2 0.0043 -0.0138 -0.0141 535 PHE 75 HZ 0.0023 -0.0176 -0.0143 536 MET 76 N 0.0025 -0.0163 -0.0030 537 MET 76 CA 0.0032 -0.0164 -0.0019 538 MET 76 C 0.0045 -0.0161 -0.0010 539 MET 76 O 0.0054 -0.0156 -0.0005 540 MET 76 CB 0.0023 -0.0176 -0.0010 541 MET 76 CG 0.0011 -0.0180 -0.0018 542 MET 76 SD 0.0003 -0.0194 -0.0007 543 MET 76 CE -0.0005 -0.0202 -0.0002 544 MET 76 H 0.0016 -0.0169 -0.0029 545 MET 76 HA 0.0034 -0.0160 -0.0024 546 MET 76 1HB 0.0019 -0.0181 -0.0007 547 MET 76 2HB 0.0029 -0.0178 -0.0001 548 MET 76 1HG 0.0015 -0.0175 -0.0023 549 MET 76 2HG 0.0004 -0.0180 -0.0026 550 MET 76 1HE -0.0011 -0.0211 0.0005 551 MET 76 2HE -0.0011 -0.0201 -0.0011 552 MET 76 3HE 0.0002 -0.0200 0.0003 553 ILE 77 N 0.0072 -0.0137 0.0023 554 ILE 77 CA 0.0100 -0.0128 0.0046 555 ILE 77 C 0.0122 -0.0095 0.0028 556 ILE 77 O 0.0148 -0.0082 0.0043 557 ILE 77 CB 0.0094 -0.0142 0.0057 558 ILE 77 CG1 0.0075 -0.0175 0.0079 559 ILE 77 CG2 0.0124 -0.0128 0.0077 560 ILE 77 CD1 0.0061 -0.0192 0.0086 561 ILE 77 H 0.0053 -0.0148 0.0014 562 ILE 77 HA 0.0110 -0.0134 0.0068 563 ILE 77 HB 0.0080 -0.0139 0.0036 564 ILE 77 1HG1 0.0090 -0.0179 0.0102 565 ILE 77 2HG1 0.0057 -0.0183 0.0068 566 ILE 77 1HG2 0.0120 -0.0138 0.0085 567 ILE 77 2HG2 0.0137 -0.0106 0.0061 568 ILE 77 3HG2 0.0138 -0.0132 0.0098 569 ILE 77 1HD1 0.0049 -0.0215 0.0101 570 ILE 77 2HD1 0.0046 -0.0190 0.0063 571 ILE 77 3HD1 0.0079 -0.0185 0.0098 572 GLY 78 N 0.0112 -0.0073 0.0020 573 GLY 78 CA 0.0125 -0.0004 0.0010 574 GLY 78 C 0.0119 0.0031 -0.0014 575 GLY 78 O 0.0143 0.0083 -0.0000 576 GLY 78 H 0.0092 -0.0103 0.0001 577 GLY 78 1HA 0.0154 0.0013 0.0049 578 GLY 78 2HA 0.0109 0.0006 -0.0020 579 GLY 79 N 0.0054 0.0005 -0.0019 580 GLY 79 CA 0.0013 0.0008 -0.0051 581 GLY 79 C 0.0051 -0.0003 -0.0022 582 GLY 79 O 0.0022 0.0011 -0.0045 583 GLY 79 H 0.0040 -0.0037 -0.0030 584 GLY 79 1HA -0.0013 0.0068 -0.0073 585 GLY 79 2HA -0.0025 -0.0041 -0.0080 586 VAL 80 N 0.0133 -0.0030 0.0025 587 VAL 80 CA 0.0188 -0.0055 0.0059 588 VAL 80 C 0.0232 0.0031 0.0065 589 VAL 80 O 0.0261 0.0027 0.0082 590 VAL 80 CB 0.0253 -0.0119 0.0106 591 VAL 80 CG1 0.0208 -0.0201 0.0099 592 VAL 80 CG2 0.0323 -0.0068 0.0133 593 VAL 80 H 0.0150 -0.0033 0.0034 594 VAL 80 HA 0.0151 -0.0093 0.0047 595 VAL 80 HB 0.0282 -0.0146 0.0127 596 VAL 80 1HG1 0.0252 -0.0248 0.0132 597 VAL 80 2HG1 0.0163 -0.0234 0.0081 598 VAL 80 3HG1 0.0177 -0.0179 0.0078 599 VAL 80 1HG2 0.0367 -0.0117 0.0167 600 VAL 80 2HG2 0.0300 -0.0040 0.0115 601 VAL 80 3HG2 0.0355 -0.0013 0.0140 602 ALA 81 N 0.0248 0.0122 0.0069 603 ALA 81 CA 0.0290 0.0226 0.0077 604 ALA 81 C 0.0208 0.0272 0.0022 605 ALA 81 O 0.0224 0.0317 0.0024 606 ALA 81 CB 0.0330 0.0311 0.0086 607 ALA 81 H 0.0225 0.0122 0.0056 608 ALA 81 HA 0.0351 0.0206 0.0115 609 ALA 81 1HB 0.0360 0.0389 0.0091 610 ALA 81 2HB 0.0388 0.0276 0.0125 611 ALA 81 3HB 0.0269 0.0331 0.0048 612 MET 82 N 0.0117 0.0251 -0.0015 613 MET 82 CA 0.0024 0.0293 -0.0071 614 MET 82 C -0.0013 0.0222 -0.0081 615 MET 82 O -0.0031 0.0283 -0.0099 616 MET 82 CB -0.0061 0.0299 -0.0117 617 MET 82 CG -0.0035 0.0388 -0.0115 618 MET 82 SD -0.0018 0.0538 -0.0126 619 MET 82 CE 0.0121 0.0566 -0.0056 620 MET 82 H 0.0114 0.0212 -0.0012 621 MET 82 HA 0.0041 0.0380 -0.0074 622 MET 82 1HB -0.0076 0.0214 -0.0114 623 MET 82 2HB -0.0131 0.0322 -0.0158 624 MET 82 1HG 0.0036 0.0367 -0.0074 625 MET 82 2HG -0.0097 0.0383 -0.0148 626 MET 82 1HE 0.0138 0.0655 -0.0058 627 MET 82 2HE 0.0154 0.0507 -0.0030 628 MET 82 3HE 0.0154 0.0556 -0.0036 629 MET 83 N 0.0041 0.0140 -0.0039 630 MET 83 CA -0.0005 0.0052 -0.0048 631 MET 83 C 0.0027 0.0087 -0.0039 632 MET 83 O -0.0021 0.0051 -0.0056 633 MET 83 CB 0.0033 -0.0063 -0.0017 634 MET 83 CG 0.0138 -0.0085 0.0033 635 MET 83 SD 0.0190 -0.0207 0.0072 636 MET 83 CE 0.0124 -0.0314 0.0057 637 MET 83 H 0.0113 0.0161 -0.0009 638 MET 83 HA -0.0089 0.0051 -0.0086 639 MET 83 1HB -0.0019 -0.0128 -0.0032 640 MET 83 2HB 0.0034 -0.0069 -0.0015 641 MET 83 1HG 0.0190 -0.0015 0.0048 642 MET 83 2HG 0.0131 -0.0101 0.0032 643 MET 83 1HE 0.0149 -0.0395 0.0078 644 MET 83 2HE 0.0142 -0.0303 0.0063 645 MET 83 3HE 0.0041 -0.0311 0.0019 646 MET 84 N 0.0117 0.0152 -0.0007 647 MET 84 CA 0.0163 0.0195 0.0008 648 MET 84 C 0.0141 0.0324 -0.0017 649 MET 84 O 0.0110 0.0360 -0.0035 650 MET 84 CB 0.0283 0.0176 0.0064 651 MET 84 CG 0.0319 0.0052 0.0095 652 MET 84 SD 0.0279 -0.0023 0.0086 653 MET 84 CE 0.0167 -0.0110 0.0047 654 MET 84 H 0.0153 0.0182 0.0005 655 MET 84 HA 0.0124 0.0148 -0.0004 656 MET 84 1HB 0.0321 0.0214 0.0077 657 MET 84 2HB 0.0315 0.0217 0.0073 658 MET 84 1HG 0.0287 0.0003 0.0087 659 MET 84 2HG 0.0406 0.0053 0.0134 660 MET 84 1HE 0.0138 -0.0159 0.0040 661 MET 84 2HE 0.0106 -0.0057 0.0013 662 MET 84 3HE 0.0190 -0.0167 0.0064 663 PHE 85 N 0.0161 0.0390 -0.0018 664 PHE 85 CA 0.0142 0.0526 -0.0047 665 PHE 85 C 0.0020 0.0544 -0.0103 666 PHE 85 O 0.0001 0.0619 -0.0123 667 PHE 85 CB 0.0154 0.0579 -0.0049 668 PHE 85 CG 0.0134 0.0714 -0.0078 669 PHE 85 CD1 0.0222 0.0807 -0.0053 670 PHE 85 CD2 0.0024 0.0749 -0.0131 671 PHE 85 CE1 0.0203 0.0932 -0.0080 672 PHE 85 CE2 0.0004 0.0873 -0.0159 673 PHE 85 CZ 0.0093 0.0965 -0.0133 674 PHE 85 H 0.0188 0.0355 -0.0001 675 PHE 85 HA 0.0205 0.0574 -0.0026 676 PHE 85 1HB 0.0241 0.0561 -0.0008 677 PHE 85 2HB 0.0094 0.0526 -0.0068 678 PHE 85 HD1 0.0307 0.0782 -0.0012 679 PHE 85 HD2 -0.0047 0.0677 -0.0152 680 PHE 85 HE1 0.0274 0.1004 -0.0060 681 PHE 85 HE2 -0.0083 0.0899 -0.0201 682 PHE 85 HZ 0.0077 0.1063 -0.0154 683 GLY 86 N -0.0052 0.0464 -0.0124 684 GLY 86 CA -0.0168 0.0452 -0.0168 685 GLY 86 C -0.0193 0.0341 -0.0162 686 GLY 86 O -0.0280 0.0282 -0.0188 687 GLY 86 H -0.0027 0.0414 -0.0106 688 GLY 86 1HA -0.0192 0.0527 -0.0190 689 GLY 86 2HA -0.0213 0.0448 -0.0186 690 GLY 87 N -0.0120 0.0307 -0.0120 691 GLY 87 CA -0.0139 0.0201 -0.0116 692 GLY 87 C -0.0231 0.0217 -0.0153 693 GLY 87 O -0.0256 0.0314 -0.0173 694 GLY 87 H -0.0049 0.0353 -0.0098 695 GLY 87 1HA -0.0160 0.0132 -0.0116 696 GLY 87 2HA -0.0066 0.0179 -0.0085 697 ARG 88 N -0.0279 0.0123 -0.0162 698 ARG 88 CA -0.0368 0.0118 -0.0203 699 ARG 88 C -0.0464 0.0137 -0.0248 700 ARG 88 O -0.0546 0.0139 -0.0286 701 ARG 88 CB -0.0366 0.0206 -0.0208 702 ARG 88 CG -0.0280 0.0201 -0.0168 703 ARG 88 CD -0.0291 0.0283 -0.0179 704 ARG 88 NE -0.0208 0.0284 -0.0141 705 ARG 88 CZ -0.0199 0.0217 -0.0132 706 ARG 88 NH1 -0.0269 0.0142 -0.0159 707 ARG 88 NH2 -0.0120 0.0228 -0.0097 708 ARG 88 H -0.0250 0.0050 -0.0144 709 ARG 88 HA -0.0373 0.0037 -0.0200 710 ARG 88 1HB -0.0370 0.0288 -0.0215 711 ARG 88 2HB -0.0433 0.0193 -0.0238 712 ARG 88 1HG -0.0275 0.0119 -0.0160 713 ARG 88 2HG -0.0211 0.0224 -0.0138 714 ARG 88 1HD -0.0294 0.0364 -0.0186 715 ARG 88 2HD -0.0361 0.0267 -0.0210 716 ARG 88 HE -0.0152 0.0340 -0.0119 717 ARG 88 1HH1 -0.0329 0.0133 -0.0186 718 ARG 88 2HH1 -0.0261 0.0092 -0.0152 719 ARG 88 1HH2 -0.0066 0.0286 -0.0076 720 ARG 88 2HH2 -0.0113 0.0179 -0.0090 721 PHE 89 N -0.0459 0.0142 -0.0250 722 PHE 89 CA -0.0548 0.0154 -0.0297 723 PHE 89 C -0.0569 0.0046 -0.0304 724 PHE 89 O -0.0609 0.0054 -0.0326 725 PHE 89 CB -0.0531 0.0262 -0.0291 726 PHE 89 CG -0.0520 0.0368 -0.0288 727 PHE 89 CD1 -0.0432 0.0433 -0.0244 728 PHE 89 CD2 -0.0594 0.0401 -0.0328 729 PHE 89 CE1 -0.0416 0.0529 -0.0239 730 PHE 89 CE2 -0.0581 0.0497 -0.0324 731 PHE 89 CZ -0.0491 0.0562 -0.0279 732 PHE 89 H -0.0386 0.0142 -0.0212 733 PHE 89 HA -0.0617 0.0166 -0.0333 734 PHE 89 1HB -0.0460 0.0252 -0.0254 735 PHE 89 2HB -0.0593 0.0273 -0.0324 736 PHE 89 HD1 -0.0374 0.0408 -0.0213 737 PHE 89 HD2 -0.0664 0.0351 -0.0363 738 PHE 89 HE1 -0.0344 0.0580 -0.0203 739 PHE 89 HE2 -0.0641 0.0522 -0.0356 740 PHE 89 HZ -0.0479 0.0639 -0.0275 741 GLY 90 N -0.0552 -0.0052 -0.0257 742 GLY 90 CA -0.0578 -0.0136 -0.0249 743 GLY 90 C -0.0542 -0.0214 -0.0212 744 GLY 90 O -0.0513 -0.0204 -0.0200 745 GLY 90 H -0.0516 -0.0054 -0.0238 746 GLY 90 1HA -0.0645 -0.0148 -0.0281 747 GLY 90 2HA -0.0556 -0.0131 -0.0239 748 GLY 91 N -0.0554 -0.0256 -0.0158 749 GLY 91 CA -0.0511 -0.0367 -0.0128 750 GLY 91 C -0.0384 -0.0365 -0.0102 751 GLY 91 O -0.0332 -0.0421 -0.0081 752 GLY 91 H -0.0581 -0.0239 -0.0167 753 GLY 91 1HA -0.0541 -0.0396 -0.0129 754 GLY 91 2HA -0.0544 -0.0427 -0.0124 755 GLN 92 N -0.0335 -0.0339 -0.0131 756 GLN 92 CA -0.0222 -0.0312 -0.0090 757 GLN 92 C -0.0193 -0.0295 -0.0081 758 GLN 92 O -0.0259 -0.0263 -0.0110 759 GLN 92 CB -0.0186 -0.0204 -0.0089 760 GLN 92 CG -0.0187 -0.0214 -0.0088 761 GLN 92 CD -0.0293 -0.0193 -0.0131 762 GLN 92 NE2 -0.0323 -0.0267 -0.0134 763 GLN 92 OE1 -0.0347 -0.0111 -0.0161 764 GLN 92 H -0.0389 -0.0294 -0.0157 765 GLN 92 HA -0.0177 -0.0383 -0.0065 766 GLN 92 1HB -0.0238 -0.0135 -0.0116 767 GLN 92 2HB -0.0105 -0.0176 -0.0061 768 GLN 92 1HG -0.0130 -0.0151 -0.0073 769 GLN 92 2HG -0.0163 -0.0299 -0.0069 770 GLN 92 1HE2 -0.0391 -0.0258 -0.0161 771 GLN 92 2HE2 -0.0276 -0.0332 -0.0109 772 GLN 93 N -0.0088 -0.0316 -0.0041 773 GLN 93 CA -0.0039 -0.0300 -0.0024 774 GLN 93 C -0.0087 -0.0386 -0.0034 775 GLN 93 O -0.0074 -0.0372 -0.0030 776 GLN 93 CB -0.0053 -0.0173 -0.0041 777 GLN 93 CG 0.0004 -0.0082 -0.0027 778 GLN 93 CD -0.0008 0.0039 -0.0043 779 GLN 93 NE2 0.0082 0.0109 -0.0016 780 GLN 93 OE1 -0.0100 0.0069 -0.0081 781 GLN 93 H -0.0039 -0.0347 -0.0019 782 GLN 93 HA 0.0048 -0.0316 0.0011 783 GLN 93 1HB -0.0139 -0.0152 -0.0076 784 GLN 93 2HB -0.0019 -0.0163 -0.0029 785 GLN 93 1HG 0.0092 -0.0099 0.0008 786 GLN 93 2HG -0.0030 -0.0087 -0.0040 787 GLN 93 1HE2 0.0076 0.0192 -0.0026 788 GLN 93 2HE2 0.0156 0.0080 0.0016 789 GLN 94 N -0.0136 -0.0513 -0.0052 790 GLN 94 CA -0.0186 -0.0627 -0.0057 791 GLN 94 C -0.0077 -0.0704 -0.0027 792 GLN 94 O -0.0092 -0.0786 -0.0026 793 GLN 94 CB -0.0265 -0.0705 -0.0071 794 GLN 94 CG -0.0192 -0.0779 -0.0049 795 GLN 94 CD -0.0143 -0.0698 -0.0043 796 GLN 94 NE2 -0.0142 -0.0757 -0.0039 797 GLN 94 OE1 -0.0107 -0.0586 -0.0041 798 GLN 94 H -0.0141 -0.0505 -0.0054 799 GLN 94 HA -0.0244 -0.0598 -0.0072 800 GLN 94 1HB -0.0323 -0.0774 -0.0080 801 GLN 94 2HB -0.0328 -0.0640 -0.0090 802 GLN 94 1HG -0.0116 -0.0827 -0.0029 803 GLN 94 2HG -0.0256 -0.0851 -0.0060 804 GLN 94 1HE2 -0.0111 -0.0709 -0.0035 805 GLN 94 2HE2 -0.0172 -0.0847 -0.0041