1 GLU 33 N -0.0156 -0.0311 -0.0052 2 GLU 33 CA -0.0259 -0.0261 -0.0002 3 GLU 33 C -0.0294 -0.0263 0.0013 4 GLU 33 O -0.0384 -0.0232 0.0056 5 GLU 33 CB -0.0255 -0.0138 0.0011 6 GLU 33 CG -0.0172 -0.0050 -0.0016 7 GLU 33 CD -0.0208 0.0011 0.0007 8 GLU 33 OE1 -0.0306 0.0012 0.0050 9 GLU 33 OE2 -0.0139 0.0063 -0.0017 10 GLY 34 N -0.0266 -0.0245 0.0021 11 GLY 34 CA -0.0293 -0.0249 0.0031 12 GLY 34 C -0.0290 -0.0162 0.0041 13 GLY 34 O -0.0241 -0.0106 0.0028 14 LYS 35 N -0.0360 -0.0144 0.0046 15 LYS 35 CA -0.0351 -0.0084 0.0066 16 LYS 35 C -0.0426 -0.0088 0.0069 17 LYS 35 O -0.0462 -0.0151 0.0049 18 LYS 35 CB -0.0272 -0.0092 0.0059 19 LYS 35 CG -0.0262 -0.0168 0.0033 20 LYS 35 CD -0.0182 -0.0165 0.0030 21 LYS 35 CE -0.0162 -0.0241 0.0004 22 LYS 35 NZ -0.0085 -0.0236 0.0002 23 PRO 36 N -0.0462 -0.0008 0.0088 24 PRO 36 CA -0.0541 -0.0016 0.0074 25 PRO 36 C -0.0500 -0.0028 0.0074 26 PRO 36 O -0.0411 -0.0019 0.0090 27 PRO 36 CB -0.0603 0.0074 0.0109 28 PRO 36 CG -0.0526 0.0135 0.0148 29 PRO 36 CD -0.0454 0.0087 0.0134 30 TRP 37 N -0.0561 -0.0048 0.0049 31 TRP 37 CA -0.0533 -0.0091 0.0033 32 TRP 37 C -0.0482 -0.0028 0.0075 33 TRP 37 O -0.0425 -0.0061 0.0071 34 TRP 37 CB -0.0628 -0.0121 -0.0002 35 TRP 37 CG -0.0699 -0.0044 0.0023 36 TRP 37 CD1 -0.0771 -0.0000 0.0030 37 TRP 37 CD2 -0.0709 -0.0000 0.0043 38 TRP 37 CE2 -0.0787 0.0070 0.0063 39 TRP 37 CE3 -0.0659 -0.0014 0.0046 40 TRP 37 NE1 -0.0823 0.0069 0.0055 41 TRP 37 CZ2 -0.0816 0.0127 0.0086 42 TRP 37 CZ3 -0.0688 0.0042 0.0069 43 TRP 37 CH2 -0.0766 0.0112 0.0088 44 TRP 38 N -0.0499 0.0056 0.0106 45 TRP 38 CA -0.0448 0.0121 0.0150 46 TRP 38 C -0.0345 0.0095 0.0162 47 TRP 38 O -0.0299 0.0086 0.0168 48 TRP 38 CB -0.0464 0.0203 0.0187 49 TRP 38 CG -0.0419 0.0269 0.0230 50 TRP 38 CD1 -0.0429 0.0296 0.0241 51 TRP 38 CD2 -0.0340 0.0306 0.0267 52 TRP 38 CE2 -0.0313 0.0362 0.0302 53 TRP 38 CE3 -0.0292 0.0299 0.0275 54 TRP 38 NE1 -0.0370 0.0357 0.0285 55 TRP 38 CZ2 -0.0241 0.0413 0.0344 56 TRP 38 CZ3 -0.0221 0.0349 0.0317 57 TRP 38 CH2 -0.0196 0.0405 0.0351 58 LEU 39 N -0.0289 0.0091 0.0163 59 LEU 39 CA -0.0206 0.0085 0.0172 60 LEU 39 C -0.0173 0.0022 0.0151 61 LEU 39 O -0.0111 0.0026 0.0161 62 LEU 39 CB -0.0187 0.0079 0.0172 63 LEU 39 CG -0.0107 0.0091 0.0188 64 LEU 39 CD1 -0.0117 0.0126 0.0200 65 LEU 39 CD2 -0.0062 0.0020 0.0166 66 VAL 40 N -0.0220 -0.0068 0.0120 67 VAL 40 CA -0.0181 -0.0133 0.0087 68 VAL 40 C -0.0169 -0.0121 0.0096 69 VAL 40 O -0.0102 -0.0141 0.0094 70 VAL 40 CB -0.0232 -0.0200 0.0041 71 VAL 40 CG1 -0.0198 -0.0266 0.0008 72 VAL 40 CG2 -0.0227 -0.0216 0.0032 73 VAL 41 N -0.0212 -0.0097 0.0087 74 VAL 41 CA -0.0191 -0.0095 0.0097 75 VAL 41 C -0.0122 -0.0057 0.0154 76 VAL 41 O -0.0063 -0.0081 0.0158 77 VAL 41 CB -0.0267 -0.0062 0.0093 78 VAL 41 CG1 -0.0244 -0.0057 0.0106 79 VAL 41 CG2 -0.0331 -0.0103 0.0036 80 VAL 42 N -0.0128 -0.0037 0.0174 81 VAL 42 CA -0.0079 -0.0002 0.0215 82 VAL 42 C -0.0011 -0.0036 0.0219 83 VAL 42 O 0.0035 -0.0034 0.0238 84 VAL 42 CB -0.0096 0.0055 0.0245 85 VAL 42 CG1 -0.0039 0.0086 0.0286 86 VAL 42 CG2 -0.0152 0.0096 0.0249 87 GLY 43 N 0.0017 -0.0051 0.0211 88 GLY 43 CA 0.0061 -0.0081 0.0224 89 GLY 43 C 0.0063 -0.0126 0.0215 90 GLY 43 O 0.0099 -0.0139 0.0229 91 VAL 44 N 0.0003 -0.0133 0.0184 92 VAL 44 CA 0.0023 -0.0160 0.0167 93 VAL 44 C 0.0045 -0.0138 0.0190 94 VAL 44 O 0.0085 -0.0151 0.0189 95 VAL 44 CB -0.0015 -0.0185 0.0138 96 VAL 44 CG1 -0.0001 -0.0203 0.0127 97 VAL 44 CG2 -0.0020 -0.0216 0.0112 98 LEU 45 N 0.0041 -0.0118 0.0201 99 LEU 45 CA 0.0055 -0.0110 0.0217 100 LEU 45 C 0.0084 -0.0104 0.0240 101 LEU 45 O 0.0106 -0.0110 0.0249 102 LEU 45 CB 0.0033 -0.0085 0.0225 103 LEU 45 CG 0.0010 -0.0088 0.0209 104 LEU 45 CD1 0.0029 -0.0103 0.0207 105 LEU 45 CD2 -0.0011 -0.0102 0.0183 106 VAL 46 N 0.0082 -0.0095 0.0234 107 VAL 46 CA 0.0106 -0.0085 0.0246 108 VAL 46 C 0.0126 -0.0107 0.0247 109 VAL 46 O 0.0142 -0.0106 0.0254 110 VAL 46 CB 0.0115 -0.0066 0.0255 111 VAL 46 CG1 0.0095 -0.0042 0.0254 112 VAL 46 CG2 0.0119 -0.0078 0.0253 113 VAL 46 H 0.0072 -0.0091 0.0232 114 VAL 46 HA 0.0103 -0.0074 0.0248 115 VAL 46 HB 0.0133 -0.0059 0.0264 116 VAL 46 1HG1 0.0102 -0.0029 0.0261 117 VAL 46 2HG1 0.0092 -0.0033 0.0256 118 VAL 46 3HG1 0.0077 -0.0049 0.0246 119 VAL 46 1HG2 0.0125 -0.0064 0.0260 120 VAL 46 2HG2 0.0101 -0.0084 0.0245 121 VAL 46 3HG2 0.0133 -0.0095 0.0254 122 VAL 47 N 0.0128 -0.0130 0.0252 123 VAL 47 CA 0.0138 -0.0145 0.0256 124 VAL 47 C 0.0122 -0.0146 0.0256 125 VAL 47 O 0.0130 -0.0144 0.0256 126 VAL 47 CB 0.0142 -0.0169 0.0262 127 VAL 47 CG1 0.0149 -0.0186 0.0266 128 VAL 47 CG2 0.0161 -0.0168 0.0261 129 VAL 47 H 0.0123 -0.0136 0.0254 130 VAL 47 HA 0.0155 -0.0138 0.0254 131 VAL 47 HB 0.0125 -0.0176 0.0264 132 VAL 47 1HG1 0.0152 -0.0203 0.0270 133 VAL 47 2HG1 0.0135 -0.0187 0.0266 134 VAL 47 3HG1 0.0166 -0.0180 0.0264 135 VAL 47 1HG2 0.0164 -0.0186 0.0266 136 VAL 47 2HG2 0.0178 -0.0162 0.0259 137 VAL 47 3HG2 0.0155 -0.0157 0.0258 138 GLY 48 N 0.0109 -0.0138 0.0254 139 GLY 48 CA 0.0101 -0.0130 0.0258 140 GLY 48 C 0.0104 -0.0111 0.0254 141 GLY 48 O 0.0105 -0.0105 0.0253 142 GLY 48 H 0.0103 -0.0145 0.0258 143 GLY 48 1HA 0.0105 -0.0137 0.0257 144 GLY 48 2HA 0.0090 -0.0132 0.0266 145 LEU 49 N 0.0111 -0.0106 0.0253 146 LEU 49 CA 0.0111 -0.0097 0.0249 147 LEU 49 C 0.0117 -0.0095 0.0243 148 LEU 49 O 0.0115 -0.0089 0.0241 149 LEU 49 CB 0.0112 -0.0094 0.0246 150 LEU 49 CG 0.0106 -0.0093 0.0251 151 LEU 49 CD1 0.0108 -0.0091 0.0248 152 LEU 49 CD2 0.0099 -0.0086 0.0253 153 LEU 49 H 0.0111 -0.0110 0.0254 154 LEU 49 HA 0.0105 -0.0093 0.0251 155 LEU 49 1HB 0.0117 -0.0098 0.0244 156 LEU 49 2HB 0.0113 -0.0087 0.0243 157 LEU 49 HG 0.0104 -0.0099 0.0255 158 LEU 49 1HD1 0.0104 -0.0091 0.0251 159 LEU 49 2HD1 0.0113 -0.0097 0.0246 160 LEU 49 3HD1 0.0110 -0.0085 0.0244 161 LEU 49 1HD2 0.0094 -0.0085 0.0256 162 LEU 49 2HD2 0.0100 -0.0080 0.0249 163 LEU 49 3HD2 0.0097 -0.0087 0.0255 164 LEU 50 N 0.0131 -0.0095 0.0235 165 LEU 50 CA 0.0131 -0.0092 0.0226 166 LEU 50 C 0.0119 -0.0089 0.0236 167 LEU 50 O 0.0110 -0.0081 0.0227 168 LEU 50 CB 0.0148 -0.0101 0.0223 169 LEU 50 CG 0.0160 -0.0104 0.0210 170 LEU 50 CD1 0.0178 -0.0114 0.0211 171 LEU 50 CD2 0.0157 -0.0096 0.0191 172 LEU 50 H 0.0141 -0.0102 0.0239 173 LEU 50 HA 0.0127 -0.0086 0.0213 174 LEU 50 1HB 0.0152 -0.0108 0.0236 175 LEU 50 2HB 0.0148 -0.0100 0.0219 176 LEU 50 HG 0.0160 -0.0105 0.0213 177 LEU 50 1HD1 0.0186 -0.0116 0.0202 178 LEU 50 2HD1 0.0180 -0.0120 0.0225 179 LEU 50 3HD1 0.0179 -0.0114 0.0208 180 LEU 50 1HD2 0.0166 -0.0098 0.0181 181 LEU 50 2HD2 0.0158 -0.0095 0.0187 182 LEU 50 3HD2 0.0145 -0.0089 0.0189 183 VAL 51 N 0.0110 -0.0097 0.0245 184 VAL 51 CA 0.0101 -0.0088 0.0252 185 VAL 51 C 0.0084 -0.0066 0.0255 186 VAL 51 O 0.0077 -0.0052 0.0247 187 VAL 51 CB 0.0101 -0.0101 0.0275 188 VAL 51 CG1 0.0090 -0.0091 0.0284 189 VAL 51 CG2 0.0118 -0.0122 0.0269 190 VAL 51 H 0.0115 -0.0110 0.0256 191 VAL 51 HA 0.0106 -0.0087 0.0238 192 VAL 51 HB 0.0098 -0.0104 0.0288 193 VAL 51 1HG1 0.0090 -0.0101 0.0300 194 VAL 51 2HG1 0.0077 -0.0076 0.0288 195 VAL 51 3HG1 0.0093 -0.0088 0.0270 196 VAL 51 1HG2 0.0119 -0.0132 0.0286 197 VAL 51 2HG2 0.0122 -0.0119 0.0256 198 VAL 51 3HG2 0.0126 -0.0130 0.0263 199 GLY 52 N 0.0084 -0.0062 0.0264 200 GLY 52 CA 0.0072 -0.0043 0.0270 201 GLY 52 C 0.0069 -0.0030 0.0250 202 GLY 52 O 0.0060 -0.0011 0.0247 203 GLY 52 H 0.0089 -0.0075 0.0271 204 GLY 52 1HA 0.0067 -0.0035 0.0278 205 GLY 52 2HA 0.0071 -0.0045 0.0283 206 MET 53 N 0.0079 -0.0043 0.0235 207 MET 53 CA 0.0073 -0.0037 0.0216 208 MET 53 C 0.0066 -0.0028 0.0205 209 MET 53 O 0.0056 -0.0016 0.0195 210 MET 53 CB 0.0083 -0.0050 0.0204 211 MET 53 CG 0.0088 -0.0056 0.0213 212 MET 53 SD 0.0099 -0.0070 0.0197 213 MET 53 CE 0.0113 -0.0088 0.0197 214 MET 53 H 0.0088 -0.0055 0.0238 215 MET 53 HA 0.0066 -0.0028 0.0220 216 MET 53 1HB 0.0091 -0.0060 0.0203 217 MET 53 2HB 0.0080 -0.0046 0.0189 218 MET 53 1HG 0.0080 -0.0046 0.0215 219 MET 53 2HG 0.0093 -0.0061 0.0228 220 MET 53 1HE 0.0120 -0.0097 0.0187 221 MET 53 2HE 0.0117 -0.0092 0.0212 222 MET 53 3HE 0.0111 -0.0085 0.0191 223 VAL 54 N 0.0066 -0.0030 0.0203 224 VAL 54 CA 0.0053 -0.0019 0.0191 225 VAL 54 C 0.0037 0.0002 0.0206 226 VAL 54 O 0.0020 0.0017 0.0194 227 VAL 54 CB 0.0063 -0.0030 0.0191 228 VAL 54 CG1 0.0050 -0.0017 0.0182 229 VAL 54 CG2 0.0078 -0.0050 0.0172 230 VAL 54 H 0.0079 -0.0043 0.0213 231 VAL 54 HA 0.0048 -0.0018 0.0170 232 VAL 54 HB 0.0070 -0.0033 0.0212 233 VAL 54 1HG1 0.0057 -0.0025 0.0183 234 VAL 54 2HG1 0.0039 -0.0003 0.0196 235 VAL 54 3HG1 0.0042 -0.0013 0.0162 236 VAL 54 1HG2 0.0086 -0.0058 0.0172 237 VAL 54 2HG2 0.0071 -0.0046 0.0152 238 VAL 54 3HG2 0.0088 -0.0059 0.0179 239 GLY 55 N 0.0041 0.0006 0.0230 240 GLY 55 CA 0.0026 0.0031 0.0248 241 GLY 55 C 0.0012 0.0047 0.0242 242 GLY 55 O -0.0006 0.0070 0.0242 243 GLY 55 H 0.0056 -0.0009 0.0241 244 GLY 55 1HA 0.0018 0.0040 0.0243 245 GLY 55 2HA 0.0034 0.0029 0.0272 246 MET 56 N 0.0020 0.0036 0.0237 247 MET 56 CA 0.0009 0.0047 0.0232 248 MET 56 C -0.0010 0.0059 0.0208 249 MET 56 O -0.0025 0.0078 0.0209 250 MET 56 CB 0.0021 0.0030 0.0224 251 MET 56 CG 0.0037 0.0020 0.0247 252 MET 56 SD 0.0053 -0.0004 0.0235 253 MET 56 CE 0.0038 0.0008 0.0223 254 MET 56 H 0.0035 0.0020 0.0239 255 MET 56 HA 0.0005 0.0060 0.0250 256 MET 56 1HB 0.0026 0.0015 0.0208 257 MET 56 2HB 0.0011 0.0037 0.0215 258 MET 56 1HG 0.0032 0.0034 0.0262 259 MET 56 2HG 0.0046 0.0015 0.0259 260 MET 56 1HE 0.0046 -0.0005 0.0215 261 MET 56 2HE 0.0024 0.0016 0.0205 262 MET 56 3HE 0.0034 0.0021 0.0239 263 THR 57 N -0.0013 0.0049 0.0186 264 THR 57 CA -0.0033 0.0058 0.0161 265 THR 57 C -0.0047 0.0075 0.0163 266 THR 57 O -0.0067 0.0091 0.0151 267 THR 57 CB -0.0028 0.0039 0.0132 268 THR 57 CG2 -0.0050 0.0049 0.0108 269 THR 57 OG1 -0.0016 0.0025 0.0132 270 THR 57 H 0.0001 0.0034 0.0185 271 THR 57 HA -0.0042 0.0069 0.0162 272 THR 57 HB -0.0020 0.0028 0.0130 273 THR 57 HG1 -0.0001 0.0017 0.0147 274 THR 57 1HG2 -0.0047 0.0036 0.0088 275 THR 57 2HG2 -0.0060 0.0060 0.0107 276 THR 57 3HG2 -0.0058 0.0060 0.0111 277 VAL 58 N -0.0038 0.0070 0.0178 278 VAL 58 CA -0.0051 0.0086 0.0182 279 VAL 58 C -0.0065 0.0111 0.0200 280 VAL 58 O -0.0085 0.0129 0.0194 281 VAL 58 CB -0.0037 0.0077 0.0196 282 VAL 58 CG1 -0.0051 0.0097 0.0204 283 VAL 58 CG2 -0.0026 0.0054 0.0174 284 VAL 58 H -0.0021 0.0055 0.0187 285 VAL 58 HA -0.0063 0.0088 0.0160 286 VAL 58 HB -0.0023 0.0073 0.0217 287 VAL 58 1HG1 -0.0040 0.0090 0.0214 288 VAL 58 2HG1 -0.0059 0.0113 0.0220 289 VAL 58 3HG1 -0.0064 0.0101 0.0183 290 VAL 58 1HG2 -0.0015 0.0047 0.0184 291 VAL 58 2HG2 -0.0039 0.0058 0.0154 292 VAL 58 3HG2 -0.0016 0.0040 0.0169 293 ALA 59 N -0.0054 0.0111 0.0223 294 ALA 59 CA -0.0065 0.0133 0.0243 295 ALA 59 C -0.0084 0.0146 0.0227 296 ALA 59 O -0.0101 0.0169 0.0233 297 ALA 59 CB -0.0049 0.0128 0.0269 298 ALA 59 H -0.0038 0.0095 0.0228 299 ALA 59 HA -0.0072 0.0145 0.0250 300 ALA 59 1HB -0.0057 0.0145 0.0284 301 ALA 59 2HB -0.0036 0.0119 0.0280 302 ALA 59 3HB -0.0041 0.0116 0.0261 303 SER 60 N -0.0079 0.0133 0.0208 304 SER 60 CA -0.0097 0.0144 0.0192 305 SER 60 C -0.0115 0.0152 0.0168 306 SER 60 O -0.0135 0.0168 0.0160 307 SER 60 CB -0.0088 0.0126 0.0179 308 SER 60 OG -0.0082 0.0107 0.0156 309 SER 60 H -0.0065 0.0114 0.0205 310 SER 60 HA -0.0104 0.0160 0.0208 311 SER 60 1HB -0.0100 0.0136 0.0172 312 SER 60 2HB -0.0073 0.0119 0.0196 313 SER 60 HG -0.0072 0.0095 0.0152 314 GLY 61 N -0.0110 0.0140 0.0158 315 GLY 61 CA -0.0126 0.0146 0.0137 316 GLY 61 C -0.0132 0.0136 0.0106 317 GLY 61 O -0.0151 0.0146 0.0087 318 GLY 61 H -0.0094 0.0126 0.0165 319 GLY 61 1HA -0.0120 0.0139 0.0138 320 GLY 61 2HA -0.0141 0.0166 0.0142 321 SER 62 N -0.0117 0.0117 0.0101 322 SER 62 CA -0.0124 0.0109 0.0072 323 SER 62 C -0.0119 0.0092 0.0052 324 SER 62 O -0.0101 0.0071 0.0051 325 SER 62 CB -0.0114 0.0097 0.0072 326 SER 62 OG -0.0119 0.0087 0.0044 327 SER 62 H -0.0102 0.0109 0.0117 328 SER 62 HA -0.0142 0.0124 0.0064 329 SER 62 1HB -0.0120 0.0110 0.0084 330 SER 62 2HB -0.0096 0.0083 0.0083 331 SER 62 HG -0.0114 0.0082 0.0045 332 ARG 63 N -0.0138 0.0102 0.0036 333 ARG 63 CA -0.0135 0.0088 0.0016 334 ARG 63 C -0.0125 0.0065 -0.0006 335 ARG 63 O -0.0112 0.0046 -0.0013 336 ARG 63 CB -0.0158 0.0103 -0.0000 337 ARG 63 CG -0.0167 0.0125 0.0019 338 ARG 63 CD -0.0156 0.0118 0.0030 339 ARG 63 NE -0.0166 0.0139 0.0048 340 ARG 63 CZ -0.0157 0.0138 0.0064 341 ARG 63 NH1 -0.0138 0.0117 0.0065 342 ARG 63 NH2 -0.0168 0.0159 0.0080 343 ARG 63 H -0.0152 0.0120 0.0040 344 ARG 63 HA -0.0124 0.0082 0.0029 345 ARG 63 1HB -0.0170 0.0111 -0.0012 346 ARG 63 2HB -0.0156 0.0092 -0.0017 347 ARG 63 1HG -0.0166 0.0134 0.0039 348 ARG 63 2HG -0.0185 0.0138 0.0007 349 ARG 63 1HD -0.0157 0.0109 0.0011 350 ARG 63 2HD -0.0138 0.0106 0.0043 351 ARG 63 HE -0.0181 0.0156 0.0048 352 ARG 63 1HH1 -0.0129 0.0102 0.0053 353 ARG 63 2HH1 -0.0131 0.0117 0.0077 354 ARG 63 1HH2 -0.0182 0.0175 0.0080 355 ARG 63 2HH2 -0.0161 0.0159 0.0092 356 LEU 64 N -0.0132 0.0067 -0.0014 357 LEU 64 CA -0.0123 0.0045 -0.0036 358 LEU 64 C -0.0097 0.0026 -0.0021 359 LEU 64 O -0.0084 0.0004 -0.0034 360 LEU 64 CB -0.0136 0.0051 -0.0050 361 LEU 64 CG -0.0162 0.0068 -0.0070 362 LEU 64 CD1 -0.0172 0.0074 -0.0080 363 LEU 64 CD2 -0.0164 0.0056 -0.0097 364 LEU 64 H -0.0143 0.0082 -0.0008 365 LEU 64 HA -0.0124 0.0037 -0.0053 366 LEU 64 1HB -0.0135 0.0060 -0.0033 367 LEU 64 2HB -0.0127 0.0034 -0.0064 368 LEU 64 HG -0.0171 0.0085 -0.0057 369 LEU 64 1HD1 -0.0190 0.0086 -0.0093 370 LEU 64 2HD1 -0.0171 0.0083 -0.0060 371 LEU 64 3HD1 -0.0164 0.0057 -0.0093 372 LEU 64 1HD2 -0.0182 0.0068 -0.0110 373 LEU 64 2HD2 -0.0156 0.0039 -0.0110 374 LEU 64 3HD2 -0.0157 0.0052 -0.0090 375 PHE 65 N -0.0090 0.0034 0.0006 376 PHE 65 CA -0.0067 0.0017 0.0021 377 PHE 65 C -0.0054 0.0009 0.0033 378 PHE 65 O -0.0034 -0.0011 0.0036 379 PHE 65 CB -0.0064 0.0027 0.0044 380 PHE 65 CG -0.0068 0.0024 0.0030 381 PHE 65 CD1 -0.0089 0.0038 0.0014 382 PHE 65 CD2 -0.0050 0.0006 0.0034 383 PHE 65 CE1 -0.0092 0.0034 0.0002 384 PHE 65 CE2 -0.0053 0.0002 0.0022 385 PHE 65 CZ -0.0074 0.0016 0.0006 386 PHE 65 H -0.0102 0.0052 0.0016 387 PHE 65 HA -0.0060 0.0002 0.0006 388 PHE 65 1HB -0.0076 0.0045 0.0055 389 PHE 65 2HB -0.0047 0.0018 0.0060 390 PHE 65 HD1 -0.0104 0.0052 0.0011 391 PHE 65 HD2 -0.0033 -0.0005 0.0047 392 PHE 65 HE1 -0.0109 0.0045 -0.0010 393 PHE 65 HE2 -0.0038 -0.0012 0.0026 394 PHE 65 HZ -0.0076 0.0014 -0.0003 395 LEU 66 N -0.0063 0.0023 0.0036 396 LEU 66 CA -0.0052 0.0014 0.0044 397 LEU 66 C -0.0046 -0.0006 0.0019 398 LEU 66 O -0.0028 -0.0023 0.0022 399 LEU 66 CB -0.0066 0.0034 0.0052 400 LEU 66 CG -0.0070 0.0054 0.0081 401 LEU 66 CD1 -0.0086 0.0074 0.0085 402 LEU 66 CD2 -0.0048 0.0044 0.0106 403 LEU 66 H -0.0079 0.0039 0.0035 404 LEU 66 HA -0.0037 0.0007 0.0062 405 LEU 66 1HB -0.0082 0.0042 0.0035 406 LEU 66 2HB -0.0058 0.0026 0.0054 407 LEU 66 HG -0.0076 0.0060 0.0081 408 LEU 66 1HD1 -0.0088 0.0087 0.0106 409 LEU 66 2HD1 -0.0101 0.0082 0.0069 410 LEU 66 3HD1 -0.0080 0.0068 0.0086 411 LEU 66 1HD2 -0.0051 0.0057 0.0125 412 LEU 66 2HD2 -0.0042 0.0037 0.0106 413 LEU 66 3HD2 -0.0036 0.0029 0.0104 414 GLY 67 N -0.0063 -0.0002 -0.0006 415 GLY 67 CA -0.0060 -0.0021 -0.0031 416 GLY 67 C -0.0041 -0.0041 -0.0031 417 GLY 67 O -0.0028 -0.0061 -0.0038 418 GLY 67 H -0.0077 0.0014 -0.0007 419 GLY 67 1HA -0.0056 -0.0026 -0.0033 420 GLY 67 2HA -0.0074 -0.0014 -0.0048 421 ALA 68 N -0.0041 -0.0038 -0.0021 422 ALA 68 CA -0.0022 -0.0057 -0.0020 423 ALA 68 C -0.0000 -0.0068 -0.0001 424 ALA 68 O 0.0016 -0.0089 -0.0007 425 ALA 68 CB -0.0024 -0.0049 -0.0011 426 ALA 68 H -0.0053 -0.0022 -0.0017 427 ALA 68 HA -0.0023 -0.0070 -0.0041 428 ALA 68 1HB -0.0010 -0.0064 -0.0011 429 ALA 68 2HB -0.0039 -0.0042 -0.0025 430 ALA 68 3HB -0.0023 -0.0036 0.0009 431 GLY 69 N 0.0004 -0.0051 0.0021 432 GLY 69 CA 0.0024 -0.0056 0.0042 433 GLY 69 C 0.0034 -0.0073 0.0031 434 GLY 69 O 0.0053 -0.0082 0.0045 435 GLY 69 H -0.0011 -0.0034 0.0025 436 GLY 69 1HA 0.0038 -0.0063 0.0051 437 GLY 69 2HA 0.0018 -0.0040 0.0058 438 ALA 70 N 0.0016 -0.0079 0.0004 439 ALA 70 CA 0.0018 -0.0096 -0.0012 440 ALA 70 C 0.0039 -0.0123 -0.0014 441 ALA 70 O 0.0047 -0.0139 -0.0023 442 ALA 70 CB -0.0003 -0.0097 -0.0040 443 ALA 70 H 0.0001 -0.0071 -0.0005 444 ALA 70 HA 0.0019 -0.0089 -0.0003 445 ALA 70 1HB -0.0001 -0.0109 -0.0051 446 ALA 70 2HB -0.0019 -0.0077 -0.0039 447 ALA 70 3HB -0.0005 -0.0104 -0.0049 448 ILE 71 N 0.0046 -0.0128 -0.0009 449 ILE 71 CA 0.0068 -0.0153 -0.0010 450 ILE 71 C 0.0088 -0.0158 0.0010 451 ILE 71 O 0.0103 -0.0180 0.0004 452 ILE 71 CB 0.0076 -0.0157 -0.0003 453 ILE 71 CG1 0.0058 -0.0158 -0.0027 454 ILE 71 CG2 0.0102 -0.0181 0.0003 455 ILE 71 CD1 0.0055 -0.0181 -0.0055 456 ILE 71 H 0.0038 -0.0114 -0.0004 457 ILE 71 HA 0.0064 -0.0168 -0.0030 458 ILE 71 HB 0.0075 -0.0139 0.0015 459 ILE 71 1HG1 0.0040 -0.0140 -0.0029 460 ILE 71 2HG1 0.0063 -0.0159 -0.0021 461 ILE 71 1HG2 0.0108 -0.0183 0.0008 462 ILE 71 2HG2 0.0115 -0.0180 0.0020 463 ILE 71 3HG2 0.0103 -0.0198 -0.0015 464 ILE 71 1HD1 0.0042 -0.0179 -0.0070 465 ILE 71 2HD1 0.0072 -0.0199 -0.0054 466 ILE 71 3HD1 0.0048 -0.0180 -0.0063 467 PHE 72 N 0.0092 -0.0128 0.0034 468 PHE 72 CA 0.0112 -0.0140 0.0054 469 PHE 72 C 0.0113 -0.0152 0.0037 470 PHE 72 O 0.0130 -0.0175 0.0034 471 PHE 72 CB 0.0112 -0.0121 0.0085 472 PHE 72 CG 0.0110 -0.0108 0.0101 473 PHE 72 CD1 0.0101 -0.0084 0.0122 474 PHE 72 CD2 0.0115 -0.0118 0.0096 475 PHE 72 CE1 0.0097 -0.0070 0.0137 476 PHE 72 CE2 0.0112 -0.0104 0.0111 477 PHE 72 CZ 0.0103 -0.0080 0.0132 478 PHE 72 H 0.0079 -0.0108 0.0039 479 PHE 72 HA 0.0126 -0.0156 0.0057 480 PHE 72 1HB 0.0101 -0.0107 0.0085 481 PHE 72 2HB 0.0128 -0.0133 0.0098 482 PHE 72 HD1 0.0097 -0.0076 0.0125 483 PHE 72 HD2 0.0122 -0.0137 0.0080 484 PHE 72 HE1 0.0090 -0.0051 0.0153 485 PHE 72 HE2 0.0116 -0.0112 0.0107 486 PHE 72 HZ 0.0100 -0.0069 0.0144 487 ALA 73 N 0.0090 -0.0144 0.0026 488 ALA 73 CA 0.0083 -0.0151 0.0010 489 ALA 73 C 0.0088 -0.0176 -0.0011 490 ALA 73 O 0.0098 -0.0192 -0.0015 491 ALA 73 CB 0.0058 -0.0131 0.0001 492 ALA 73 H 0.0078 -0.0127 0.0030 493 ALA 73 HA 0.0094 -0.0152 0.0022 494 ALA 73 1HB 0.0055 -0.0112 0.0017 495 ALA 73 2HB 0.0047 -0.0129 -0.0011 496 ALA 73 3HB 0.0052 -0.0134 -0.0011 497 ILE 74 N 0.0078 -0.0185 -0.0024 498 ILE 74 CA 0.0081 -0.0209 -0.0044 499 ILE 74 C 0.0107 -0.0227 -0.0037 500 ILE 74 O 0.0113 -0.0244 -0.0047 501 ILE 74 CB 0.0068 -0.0217 -0.0064 502 ILE 74 CG1 0.0065 -0.0239 -0.0087 503 ILE 74 CG2 0.0082 -0.0226 -0.0059 504 ILE 74 CD1 0.0050 -0.0234 -0.0097 505 ILE 74 H 0.0070 -0.0176 -0.0023 506 ILE 74 HA 0.0072 -0.0207 -0.0051 507 ILE 74 HB 0.0050 -0.0202 -0.0067 508 ILE 74 1HG1 0.0056 -0.0244 -0.0100 509 ILE 74 2HG1 0.0082 -0.0254 -0.0085 510 ILE 74 1HG2 0.0072 -0.0231 -0.0073 511 ILE 74 2HG2 0.0084 -0.0212 -0.0043 512 ILE 74 3HG2 0.0099 -0.0241 -0.0057 513 ILE 74 1HD1 0.0048 -0.0250 -0.0113 514 ILE 74 2HD1 0.0058 -0.0230 -0.0085 515 ILE 74 3HD1 0.0032 -0.0220 -0.0100 516 PHE 75 N 0.0125 -0.0227 -0.0023 517 PHE 75 CA 0.0152 -0.0246 -0.0014 518 PHE 75 C 0.0162 -0.0241 0.0000 519 PHE 75 O 0.0175 -0.0261 -0.0003 520 PHE 75 CB 0.0168 -0.0245 0.0003 521 PHE 75 CG 0.0166 -0.0261 -0.0012 522 PHE 75 CD1 0.0148 -0.0250 -0.0020 523 PHE 75 CD2 0.0183 -0.0289 -0.0019 524 PHE 75 CE1 0.0147 -0.0265 -0.0034 525 PHE 75 CE2 0.0182 -0.0304 -0.0033 526 PHE 75 CZ 0.0164 -0.0292 -0.0040 527 PHE 75 H 0.0120 -0.0211 -0.0015 528 PHE 75 HA 0.0153 -0.0267 -0.0030 529 PHE 75 1HB 0.0160 -0.0224 0.0014 530 PHE 75 2HB 0.0188 -0.0252 0.0016 531 PHE 75 HD1 0.0135 -0.0229 -0.0015 532 PHE 75 HD2 0.0198 -0.0298 -0.0013 533 PHE 75 HE1 0.0132 -0.0256 -0.0040 534 PHE 75 HE2 0.0196 -0.0325 -0.0038 535 PHE 75 HZ 0.0163 -0.0304 -0.0051 536 MET 76 N 0.0150 -0.0210 0.0000 537 MET 76 CA 0.0160 -0.0207 0.0016 538 MET 76 C 0.0156 -0.0216 -0.0001 539 MET 76 O 0.0170 -0.0225 0.0005 540 MET 76 CB 0.0151 -0.0182 0.0036 541 MET 76 CG 0.0159 -0.0174 0.0057 542 MET 76 SD 0.0150 -0.0146 0.0082 543 MET 76 CE 0.0120 -0.0127 0.0068 544 MET 76 H 0.0137 -0.0195 0.0002 545 MET 76 HA 0.0179 -0.0218 0.0026 546 MET 76 1HB 0.0132 -0.0172 0.0026 547 MET 76 2HB 0.0155 -0.0180 0.0044 548 MET 76 1HG 0.0178 -0.0186 0.0065 549 MET 76 2HG 0.0152 -0.0173 0.0049 550 MET 76 1HE 0.0113 -0.0109 0.0082 551 MET 76 2HE 0.0116 -0.0128 0.0061 552 MET 76 3HE 0.0112 -0.0131 0.0052 553 ILE 77 N 0.0127 -0.0214 -0.0010 554 ILE 77 CA 0.0110 -0.0218 -0.0021 555 ILE 77 C 0.0115 -0.0242 -0.0027 556 ILE 77 O 0.0113 -0.0246 -0.0030 557 ILE 77 CB 0.0090 -0.0214 -0.0031 558 ILE 77 CG1 0.0084 -0.0188 -0.0025 559 ILE 77 CG2 0.0073 -0.0222 -0.0044 560 ILE 77 CD1 0.0067 -0.0182 -0.0033 561 ILE 77 H 0.0124 -0.0211 -0.0011 562 ILE 77 HA 0.0109 -0.0207 -0.0018 563 ILE 77 HB 0.0091 -0.0222 -0.0033 564 ILE 77 1HG1 0.0079 -0.0180 -0.0025 565 ILE 77 2HG1 0.0097 -0.0182 -0.0016 566 ILE 77 1HG2 0.0059 -0.0219 -0.0051 567 ILE 77 2HG2 0.0077 -0.0239 -0.0048 568 ILE 77 3HG2 0.0072 -0.0213 -0.0041 569 ILE 77 1HD1 0.0064 -0.0165 -0.0029 570 ILE 77 2HD1 0.0071 -0.0190 -0.0033 571 ILE 77 3HD1 0.0053 -0.0188 -0.0043 572 GLY 78 N 0.0121 -0.0268 -0.0020 573 GLY 78 CA 0.0117 -0.0295 -0.0016 574 GLY 78 C 0.0128 -0.0288 -0.0015 575 GLY 78 O 0.0115 -0.0297 -0.0016 576 GLY 78 H 0.0133 -0.0270 -0.0017 577 GLY 78 1HA 0.0093 -0.0301 -0.0020 578 GLY 78 2HA 0.0128 -0.0314 -0.0010 579 GLY 79 N 0.0184 -0.0284 -0.0030 580 GLY 79 CA 0.0198 -0.0252 -0.0048 581 GLY 79 C 0.0156 -0.0211 -0.0059 582 GLY 79 O 0.0160 -0.0187 -0.0071 583 GLY 79 H 0.0211 -0.0289 -0.0034 584 GLY 79 1HA 0.0207 -0.0274 -0.0040 585 GLY 79 2HA 0.0234 -0.0237 -0.0064 586 VAL 80 N 0.0097 -0.0205 -0.0045 587 VAL 80 CA 0.0066 -0.0167 -0.0046 588 VAL 80 C 0.0033 -0.0157 -0.0022 589 VAL 80 O 0.0008 -0.0123 -0.0027 590 VAL 80 CB 0.0053 -0.0167 -0.0034 591 VAL 80 CG1 0.0086 -0.0178 -0.0057 592 VAL 80 CG2 0.0032 -0.0191 0.0009 593 VAL 80 H 0.0104 -0.0230 -0.0028 594 VAL 80 HA 0.0074 -0.0144 -0.0075 595 VAL 80 HB 0.0033 -0.0136 -0.0041 596 VAL 80 1HG1 0.0078 -0.0176 -0.0050 597 VAL 80 2HG1 0.0098 -0.0159 -0.0086 598 VAL 80 3HG1 0.0107 -0.0209 -0.0051 599 VAL 80 1HG2 0.0023 -0.0189 0.0016 600 VAL 80 2HG2 0.0049 -0.0221 0.0019 601 VAL 80 3HG2 0.0007 -0.0180 0.0023 602 ALA 81 N 0.0010 -0.0181 0.0011 603 ALA 81 CA -0.0037 -0.0172 0.0042 604 ALA 81 C -0.0016 -0.0153 0.0010 605 ALA 81 O -0.0050 -0.0114 0.0008 606 ALA 81 CB -0.0048 -0.0229 0.0095 607 ALA 81 H 0.0039 -0.0224 0.0020 608 ALA 81 HA -0.0077 -0.0136 0.0046 609 ALA 81 1HB -0.0082 -0.0220 0.0117 610 ALA 81 2HB -0.0062 -0.0241 0.0117 611 ALA 81 3HB -0.0007 -0.0265 0.0090 612 MET 82 N 0.0049 -0.0185 -0.0018 613 MET 82 CA 0.0085 -0.0175 -0.0054 614 MET 82 C 0.0089 -0.0101 -0.0111 615 MET 82 O 0.0070 -0.0071 -0.0118 616 MET 82 CB 0.0156 -0.0233 -0.0067 617 MET 82 CG 0.0154 -0.0307 -0.0010 618 MET 82 SD 0.0110 -0.0314 0.0029 619 MET 82 CE 0.0024 -0.0306 0.0091 620 MET 82 H 0.0077 -0.0220 -0.0014 621 MET 82 HA 0.0056 -0.0179 -0.0028 622 MET 82 1HB 0.0186 -0.0234 -0.0090 623 MET 82 2HB 0.0183 -0.0220 -0.0097 624 MET 82 1HG 0.0126 -0.0321 0.0021 625 MET 82 2HG 0.0207 -0.0346 -0.0023 626 MET 82 1HE -0.0006 -0.0310 0.0117 627 MET 82 2HE -0.0003 -0.0256 0.0075 628 MET 82 3HE 0.0027 -0.0349 0.0120 629 MET 83 N 0.0060 -0.0073 -0.0117 630 MET 83 CA 0.0078 -0.0013 -0.0183 631 MET 83 C 0.0022 0.0057 -0.0181 632 MET 83 O 0.0030 0.0114 -0.0234 633 MET 83 CB 0.0080 -0.0006 -0.0193 634 MET 83 CG 0.0015 0.0034 -0.0154 635 MET 83 SD 0.0019 0.0026 -0.0152 636 MET 83 CE 0.0048 0.0092 -0.0235 637 MET 83 H 0.0010 -0.0053 -0.0080 638 MET 83 HA 0.0125 -0.0024 -0.0226 639 MET 83 1HB 0.0109 0.0023 -0.0246 640 MET 83 2HB 0.0106 -0.0061 -0.0175 641 MET 83 1HG -0.0020 0.0016 -0.0102 642 MET 83 2HG -0.0004 0.0092 -0.0180 643 MET 83 1HE 0.0052 0.0095 -0.0242 644 MET 83 2HE 0.0012 0.0146 -0.0240 645 MET 83 3HE 0.0096 0.0077 -0.0275 646 MET 84 N -0.0035 0.0059 -0.0124 647 MET 84 CA -0.0097 0.0122 -0.0109 648 MET 84 C -0.0105 0.0099 -0.0083 649 MET 84 O -0.0119 0.0147 -0.0107 650 MET 84 CB -0.0163 0.0139 -0.0055 651 MET 84 CG -0.0169 0.0176 -0.0077 652 MET 84 SD -0.0174 0.0274 -0.0147 653 MET 84 CE -0.0089 0.0259 -0.0222 654 MET 84 H -0.0038 0.0007 -0.0081 655 MET 84 HA -0.0089 0.0175 -0.0158 656 MET 84 1HB -0.0168 0.0085 -0.0009 657 MET 84 2HB -0.0207 0.0180 -0.0041 658 MET 84 1HG -0.0125 0.0139 -0.0094 659 MET 84 2HG -0.0216 0.0178 -0.0031 660 MET 84 1HE -0.0087 0.0314 -0.0267 661 MET 84 2HE -0.0053 0.0222 -0.0231 662 MET 84 3HE -0.0076 0.0231 -0.0215 663 PHE 85 N -0.0097 0.0021 -0.0041 664 PHE 85 CA -0.0103 -0.0013 -0.0010 665 PHE 85 C -0.0052 0.0002 -0.0068 666 PHE 85 O -0.0071 0.0029 -0.0071 667 PHE 85 CB -0.0082 -0.0102 0.0038 668 PHE 85 CG -0.0080 -0.0151 0.0073 669 PHE 85 CD1 -0.0142 -0.0161 0.0137 670 PHE 85 CD2 -0.0016 -0.0189 0.0042 671 PHE 85 CE1 -0.0139 -0.0207 0.0169 672 PHE 85 CE2 -0.0013 -0.0235 0.0074 673 PHE 85 CZ -0.0075 -0.0244 0.0137 674 PHE 85 H -0.0087 -0.0015 -0.0023 675 PHE 85 HA -0.0159 0.0016 0.0020 676 PHE 85 1HB -0.0118 -0.0111 0.0077 677 PHE 85 2HB -0.0029 -0.0127 0.0007 678 PHE 85 HD1 -0.0192 -0.0132 0.0161 679 PHE 85 HD2 0.0033 -0.0182 -0.0008 680 PHE 85 HE1 -0.0189 -0.0214 0.0220 681 PHE 85 HE2 0.0038 -0.0264 0.0049 682 PHE 85 HZ -0.0073 -0.0280 0.0163 683 GLY 86 N 0.0011 -0.0013 -0.0111 684 GLY 86 CA 0.0071 -0.0006 -0.0180 685 GLY 86 C 0.0078 0.0067 -0.0246 686 GLY 86 O 0.0138 0.0066 -0.0307 687 GLY 86 H 0.0022 -0.0039 -0.0102 688 GLY 86 1HA 0.0062 0.0003 -0.0178 689 GLY 86 2HA 0.0121 -0.0062 -0.0187 690 GLY 87 N 0.0019 0.0130 -0.0237 691 GLY 87 CA 0.0024 0.0198 -0.0293 692 GLY 87 C 0.0048 0.0242 -0.0354 693 GLY 87 O 0.0042 0.0234 -0.0341 694 GLY 87 H -0.0030 0.0131 -0.0186 695 GLY 87 1HA 0.0061 0.0175 -0.0316 696 GLY 87 2HA -0.0028 0.0239 -0.0270 697 ARG 88 N 0.0074 0.0292 -0.0420 698 ARG 88 CA 0.0103 0.0336 -0.0485 699 ARG 88 C 0.0174 0.0283 -0.0521 700 ARG 88 O 0.0205 0.0312 -0.0575 701 ARG 88 CB 0.0059 0.0378 -0.0472 702 ARG 88 CG -0.0014 0.0439 -0.0441 703 ARG 88 CD -0.0048 0.0480 -0.0437 704 ARG 88 NE -0.0120 0.0536 -0.0405 705 ARG 88 CZ -0.0143 0.0611 -0.0439 706 ARG 88 NH1 -0.0100 0.0641 -0.0508 707 ARG 88 NH2 -0.0210 0.0656 -0.0404 708 ARG 88 H 0.0075 0.0295 -0.0424 709 ARG 88 HA 0.0105 0.0381 -0.0523 710 ARG 88 1HB 0.0060 0.0337 -0.0440 711 ARG 88 2HB 0.0083 0.0411 -0.0524 712 ARG 88 1HG -0.0016 0.0481 -0.0473 713 ARG 88 2HG -0.0043 0.0408 -0.0387 714 ARG 88 1HD -0.0047 0.0435 -0.0404 715 ARG 88 2HD -0.0021 0.0510 -0.0490 716 ARG 88 HE -0.0155 0.0517 -0.0352 717 ARG 88 1HH1 -0.0049 0.0607 -0.0536 718 ARG 88 2HH1 -0.0118 0.0697 -0.0533 719 ARG 88 1HH2 -0.0243 0.0634 -0.0351 720 ARG 88 2HH2 -0.0227 0.0712 -0.0429 721 PHE 89 N 0.0205 0.0205 -0.0492 722 PHE 89 CA 0.0272 0.0152 -0.0523 723 PHE 89 C 0.0320 0.0124 -0.0552 724 PHE 89 O 0.0368 0.0060 -0.0555 725 PHE 89 CB 0.0268 0.0084 -0.0470 726 PHE 89 CG 0.0225 0.0111 -0.0446 727 PHE 89 CD1 0.0171 0.0097 -0.0380 728 PHE 89 CD2 0.0238 0.0153 -0.0489 729 PHE 89 CE1 0.0129 0.0122 -0.0355 730 PHE 89 CE2 0.0197 0.0179 -0.0465 731 PHE 89 CZ 0.0142 0.0163 -0.0398 732 PHE 89 H 0.0177 0.0183 -0.0448 733 PHE 89 HA 0.0291 0.0182 -0.0564 734 PHE 89 1HB 0.0246 0.0056 -0.0427 735 PHE 89 2HB 0.0317 0.0042 -0.0489 736 PHE 89 HD1 0.0161 0.0065 -0.0347 737 PHE 89 HD2 0.0279 0.0167 -0.0541 738 PHE 89 HE1 0.0085 0.0110 -0.0301 739 PHE 89 HE2 0.0207 0.0212 -0.0500 740 PHE 89 HZ 0.0109 0.0183 -0.0379 741 GLY 90 N 0.0314 0.0169 -0.0576 742 GLY 90 CA 0.0352 0.0153 -0.0602 743 GLY 90 C 0.0328 0.0206 -0.0622 744 GLY 90 O 0.0290 0.0258 -0.0627 745 GLY 90 H 0.0278 0.0211 -0.0575 746 GLY 90 1HA 0.0394 0.0144 -0.0638 747 GLY 90 2HA 0.0356 0.0110 -0.0569 748 GLY 91 N 0.0357 0.0189 -0.0639 749 GLY 91 CA 0.0336 0.0242 -0.0676 750 GLY 91 C 0.0271 0.0252 -0.0626 751 GLY 91 O 0.0275 0.0243 -0.0619 752 GLY 91 H 0.0399 0.0144 -0.0629 753 GLY 91 1HA 0.0323 0.0288 -0.0714 754 GLY 91 2HA 0.0380 0.0230 -0.0704 755 GLN 92 N 0.0210 0.0292 -0.0568 756 GLN 92 CA 0.0139 0.0302 -0.0502 757 GLN 92 C 0.0082 0.0381 -0.0505 758 GLN 92 O 0.0093 0.0413 -0.0542 759 GLN 92 CB 0.0127 0.0233 -0.0432 760 GLN 92 CG 0.0169 0.0153 -0.0412 761 GLN 92 CD 0.0244 0.0102 -0.0449 762 GLN 92 NE2 0.0295 0.0067 -0.0475 763 GLN 92 OE1 0.0256 0.0093 -0.0454 764 GLN 92 H 0.0221 0.0303 -0.0590 765 GLN 92 HA 0.0133 0.0305 -0.0497 766 GLN 92 1HB 0.0141 0.0225 -0.0440 767 GLN 92 2HB 0.0071 0.0248 -0.0385 768 GLN 92 1HG 0.0139 0.0121 -0.0354 769 GLN 92 2HG 0.0174 0.0162 -0.0424 770 GLN 92 1HE2 0.0345 0.0032 -0.0500 771 GLN 92 2HE2 0.0283 0.0076 -0.0470 772 GLN 93 N 0.0019 0.0415 -0.0465 773 GLN 93 CA -0.0046 0.0489 -0.0454 774 GLN 93 C -0.0037 0.0569 -0.0525 775 GLN 93 O -0.0079 0.0636 -0.0532 776 GLN 93 CB -0.0066 0.0481 -0.0426 777 GLN 93 CG -0.0084 0.0408 -0.0351 778 GLN 93 CD -0.0105 0.0402 -0.0325 779 GLN 93 NE2 -0.0164 0.0393 -0.0254 780 GLN 93 OE1 -0.0066 0.0407 -0.0369 781 GLN 93 H 0.0015 0.0383 -0.0437 782 GLN 93 HA -0.0090 0.0494 -0.0411 783 GLN 93 1HB -0.0023 0.0474 -0.0467 784 GLN 93 2HB -0.0113 0.0538 -0.0420 785 GLN 93 1HG -0.0130 0.0417 -0.0309 786 GLN 93 2HG -0.0037 0.0349 -0.0355 787 GLN 93 1HE2 -0.0180 0.0389 -0.0235 788 GLN 93 2HE2 -0.0195 0.0390 -0.0220 789 GLN 94 N 0.0007 0.0567 -0.0584 790 GLN 94 CA 0.0021 0.0642 -0.0657 791 GLN 94 C -0.0046 0.0703 -0.0635 792 GLN 94 O -0.0060 0.0781 -0.0681 793 GLN 94 CB 0.0099 0.0610 -0.0713 794 GLN 94 CG 0.0102 0.0578 -0.0692 795 GLN 94 CD 0.0109 0.0484 -0.0625 796 GLN 94 NE2 0.0151 0.0438 -0.0633 797 GLN 94 OE1 0.0078 0.0453 -0.0568 798 GLN 94 H 0.0041 0.0508 -0.0573 799 GLN 94 HA 0.0021 0.0677 -0.0685 800 GLN 94 1HB 0.0116 0.0663 -0.0773 801 GLN 94 2HB 0.0143 0.0556 -0.0717 802 GLN 94 1HG 0.0053 0.0623 -0.0676 803 GLN 94 2HG 0.0154 0.0577 -0.0745 804 GLN 94 1HE2 0.0157 0.0377 -0.0591 805 GLN 94 2HE2 0.0176 0.0464 -0.0679