1 PRO 1 N 0.0100 -0.0019 -0.0353 2 PRO 1 CA 0.0091 -0.0001 -0.0363 3 PRO 1 C 0.0081 -0.0021 -0.0342 4 PRO 1 O 0.0082 -0.0048 -0.0320 5 PRO 1 CB 0.0058 0.0024 -0.0369 6 PRO 1 CG 0.0039 0.0009 -0.0347 7 PRO 1 CD 0.0069 -0.0014 -0.0342 8 GLN 2 N 0.0077 -0.0079 -0.0386 9 GLN 2 CA 0.0058 -0.0075 -0.0360 10 GLN 2 C 0.0041 -0.0074 -0.0361 11 GLN 2 O 0.0030 -0.0078 -0.0384 12 GLN 2 CB 0.0037 -0.0074 -0.0360 13 GLN 2 CG 0.0019 -0.0070 -0.0332 14 GLN 2 CD -0.0010 -0.0070 -0.0337 15 GLN 2 OE1 -0.0030 -0.0072 -0.0353 16 GLN 2 NE2 -0.0012 -0.0068 -0.0323 17 ILE 3 N 0.0073 -0.0089 -0.0351 18 ILE 3 CA 0.0049 -0.0075 -0.0334 19 ILE 3 C 0.0021 -0.0058 -0.0304 20 ILE 3 O 0.0030 -0.0062 -0.0277 21 ILE 3 CB 0.0068 -0.0085 -0.0318 22 ILE 3 CG1 0.0079 -0.0089 -0.0274 23 ILE 3 CG2 0.0101 -0.0104 -0.0343 24 ILE 3 CD1 0.0096 -0.0097 -0.0257 25 THR 4 N 0.0019 -0.0078 -0.0397 26 THR 4 CA -0.0035 -0.0020 -0.0345 27 THR 4 C -0.0008 -0.0009 -0.0262 28 THR 4 O 0.0046 -0.0044 -0.0250 29 THR 4 CB -0.0104 0.0016 -0.0385 30 THR 4 OG1 -0.0086 -0.0006 -0.0409 31 THR 4 CG2 -0.0144 0.0018 -0.0460 32 LEU 5 N 0.0015 0.0036 -0.0181 33 LEU 5 CA 0.0022 0.0036 -0.0107 34 LEU 5 C -0.0015 0.0087 -0.0074 35 LEU 5 O -0.0019 0.0099 -0.0013 36 LEU 5 CB 0.0034 0.0025 -0.0076 37 LEU 5 CG 0.0079 -0.0032 -0.0092 38 LEU 5 CD1 0.0083 -0.0035 -0.0073 39 LEU 5 CD2 0.0116 -0.0075 -0.0057 40 TRP 6 N -0.0036 0.0268 -0.0156 41 TRP 6 CA -0.0087 0.0357 -0.0106 42 TRP 6 C -0.0056 0.0328 -0.0008 43 TRP 6 O -0.0084 0.0388 0.0076 44 TRP 6 CB -0.0131 0.0408 -0.0205 45 TRP 6 CG -0.0160 0.0436 -0.0299 46 TRP 6 CD1 -0.0137 0.0381 -0.0403 47 TRP 6 CD2 -0.0216 0.0525 -0.0298 48 TRP 6 NE1 -0.0176 0.0430 -0.0466 49 TRP 6 CE2 -0.0225 0.0519 -0.0404 50 TRP 6 CE3 -0.0260 0.0610 -0.0217 51 TRP 6 CZ2 -0.0277 0.0595 -0.0432 52 TRP 6 CZ3 -0.0312 0.0686 -0.0245 53 TRP 6 CH2 -0.0319 0.0677 -0.0351 54 GLN 7 N 0.0013 0.0236 -0.0069 55 GLN 7 CA 0.0046 0.0170 0.0083 56 GLN 7 C 0.0018 0.0047 0.0076 57 GLN 7 O -0.0031 -0.0007 -0.0045 58 GLN 7 CB 0.0050 0.0095 0.0145 59 GLN 7 CG 0.0073 0.0203 0.0145 60 GLN 7 CD 0.0136 0.0287 0.0289 61 GLN 7 OE1 0.0167 0.0406 0.0308 62 GLN 7 NE2 0.0155 0.0229 0.0391 63 ARG 8 N 0.0005 0.0025 0.0063 64 ARG 8 CA 0.0027 -0.0004 0.0076 65 ARG 8 C 0.0049 -0.0017 0.0050 66 ARG 8 O 0.0047 -0.0008 0.0032 67 ARG 8 CB 0.0022 -0.0010 0.0104 68 ARG 8 CG 0.0007 -0.0007 0.0136 69 ARG 8 CD -0.0003 -0.0006 0.0161 70 ARG 8 NE -0.0010 -0.0012 0.0194 71 ARG 8 CZ -0.0027 -0.0004 0.0220 72 ARG 8 NH1 -0.0040 0.0012 0.0217 73 ARG 8 NH2 -0.0031 -0.0011 0.0249 74 PRO 9 N 0.0094 -0.0069 0.0015 75 PRO 9 CA 0.0110 -0.0091 -0.0012 76 PRO 9 C 0.0131 -0.0115 0.0000 77 PRO 9 O 0.0149 -0.0136 0.0009 78 PRO 9 CB 0.0115 -0.0098 -0.0016 79 PRO 9 CG 0.0113 -0.0092 0.0019 80 PRO 9 CD 0.0094 -0.0067 0.0034 81 LEU 10 N 0.0150 -0.0107 -0.0010 82 LEU 10 CA 0.0159 -0.0113 -0.0008 83 LEU 10 C 0.0165 -0.0118 -0.0020 84 LEU 10 O 0.0160 -0.0116 -0.0031 85 LEU 10 CB 0.0154 -0.0109 -0.0006 86 LEU 10 CG 0.0150 -0.0105 0.0007 87 LEU 10 CD1 0.0143 -0.0100 0.0007 88 LEU 10 CD2 0.0159 -0.0110 0.0017 89 VAL 11 N 0.0175 -0.0058 -0.0060 90 VAL 11 CA 0.0167 -0.0063 -0.0054 91 VAL 11 C 0.0160 -0.0068 -0.0044 92 VAL 11 O 0.0158 -0.0069 -0.0043 93 VAL 11 CB 0.0160 -0.0068 -0.0065 94 VAL 11 CG1 0.0167 -0.0063 -0.0075 95 VAL 11 CG2 0.0152 -0.0072 -0.0073 96 THR 12 N 0.0179 -0.0042 -0.0023 97 THR 12 N 0.0179 -0.0042 -0.0023 98 THR 12 CA 0.0146 -0.0034 -0.0013 99 THR 12 CA 0.0146 -0.0034 -0.0012 100 THR 12 C 0.0115 -0.0036 -0.0027 101 THR 12 C 0.0113 -0.0035 -0.0023 102 THR 12 O 0.0117 -0.0037 -0.0029 103 THR 12 O 0.0113 -0.0032 -0.0018 104 THR 12 CB 0.0145 -0.0020 0.0026 105 THR 12 CB 0.0148 -0.0020 0.0026 106 THR 12 OG1 0.0176 -0.0019 0.0038 107 THR 12 OG1 0.0152 -0.0014 0.0043 108 THR 12 CG2 0.0111 -0.0012 0.0037 109 THR 12 CG2 0.0180 -0.0020 0.0036 110 ILE 13 N 0.0077 -0.0023 -0.0033 111 ILE 13 CA 0.0064 -0.0025 -0.0038 112 ILE 13 C 0.0047 -0.0018 -0.0031 113 ILE 13 O 0.0043 -0.0014 -0.0027 114 ILE 13 CB 0.0060 -0.0037 -0.0054 115 ILE 13 CG1 0.0050 -0.0040 -0.0060 116 ILE 13 CG2 0.0078 -0.0045 -0.0062 117 ILE 13 CD1 0.0045 -0.0052 -0.0076 118 LYS 14 N -0.0010 -0.0003 -0.0041 119 LYS 14 CA -0.0063 0.0032 -0.0038 120 LYS 14 C -0.0103 0.0031 -0.0075 121 LYS 14 O -0.0095 0.0028 -0.0072 122 LYS 14 CB -0.0067 0.0073 0.0018 123 LYS 14 CG -0.0121 0.0109 0.0022 124 LYS 14 CD -0.0127 0.0150 0.0076 125 LYS 14 CE -0.0181 0.0184 0.0077 126 LYS 14 NZ -0.0188 0.0225 0.0130 127 ILE 15 N -0.0090 0.0051 -0.0072 128 ILE 15 CA -0.0083 0.0054 -0.0066 129 ILE 15 C -0.0097 0.0073 -0.0096 130 ILE 15 O -0.0119 0.0068 -0.0120 131 ILE 15 CB -0.0091 0.0020 -0.0049 132 ILE 15 CG1 -0.0083 0.0024 -0.0043 133 ILE 15 CG2 -0.0120 -0.0005 -0.0067 134 ILE 15 CD1 -0.0087 -0.0008 -0.0024 135 GLY 16 N -0.0105 0.0101 -0.0097 136 GLY 16 CA -0.0117 0.0126 -0.0130 137 GLY 16 C -0.0150 0.0174 -0.0199 138 GLY 16 O -0.0199 0.0180 -0.0226 139 GLY 17 N -0.0178 0.0270 -0.0175 140 GLY 17 CA -0.0206 0.0386 -0.0171 141 GLY 17 C -0.0222 0.0304 -0.0199 142 GLY 17 O -0.0250 0.0394 -0.0200 143 GLN 18 N -0.0169 0.0208 -0.0152 144 GLN 18 CA -0.0192 0.0156 -0.0174 145 GLN 18 C -0.0176 0.0113 -0.0131 146 GLN 18 O -0.0152 0.0106 -0.0087 147 GLN 18 CB -0.0215 0.0123 -0.0204 148 GLN 18 CG -0.0232 0.0162 -0.0248 149 GLN 18 CD -0.0252 0.0130 -0.0274 150 GLN 18 OE1 -0.0273 0.0084 -0.0295 151 GLN 18 NE2 -0.0247 0.0153 -0.0272 152 LEU 19 N -0.0123 0.0093 -0.0091 153 LEU 19 CA -0.0067 0.0070 -0.0072 154 LEU 19 C -0.0046 0.0028 -0.0111 155 LEU 19 O -0.0059 0.0023 -0.0129 156 LEU 19 CB -0.0044 0.0090 -0.0025 157 LEU 19 CG -0.0066 0.0135 0.0016 158 LEU 19 CD1 -0.0044 0.0151 0.0058 159 LEU 19 CD2 -0.0054 0.0141 0.0035 160 LYS 20 N -0.0009 0.0022 -0.0066 161 LYS 20 CA -0.0007 -0.0012 -0.0081 162 LYS 20 C 0.0023 -0.0031 -0.0066 163 LYS 20 O 0.0043 -0.0019 -0.0045 164 LYS 20 CB -0.0019 -0.0028 -0.0098 165 LYS 20 CG -0.0051 -0.0013 -0.0115 166 LYS 20 CD -0.0062 -0.0031 -0.0132 167 LYS 20 CE -0.0094 -0.0017 -0.0150 168 LYS 20 NZ -0.0111 -0.0020 -0.0165 169 GLU 21 N 0.0103 -0.0049 -0.0083 170 GLU 21 CA 0.0121 -0.0067 -0.0073 171 GLU 21 C 0.0120 -0.0072 -0.0091 172 GLU 21 O 0.0112 -0.0073 -0.0116 173 GLU 21 CB 0.0137 -0.0088 -0.0077 174 GLU 21 CG 0.0142 -0.0086 -0.0057 175 GLU 21 CD 0.0158 -0.0095 -0.0032 176 GLU 21 OE1 0.0160 -0.0093 -0.0022 177 GLU 21 OE2 0.0169 -0.0104 -0.0021 178 ALA 22 N 0.0118 -0.0074 -0.0032 179 ALA 22 CA 0.0118 -0.0074 -0.0033 180 ALA 22 C 0.0123 -0.0089 -0.0016 181 ALA 22 O 0.0126 -0.0094 0.0002 182 ALA 22 CB 0.0112 -0.0050 -0.0030 183 LEU 23 N 0.0144 -0.0087 0.0038 184 LEU 23 CA 0.0137 -0.0089 0.0044 185 LEU 23 C 0.0142 -0.0087 0.0050 186 LEU 23 O 0.0148 -0.0085 0.0055 187 LEU 23 CB 0.0132 -0.0090 0.0050 188 LEU 23 CG 0.0124 -0.0092 0.0055 189 LEU 23 CD1 0.0116 -0.0095 0.0049 190 LEU 23 CD2 0.0122 -0.0093 0.0062 191 LEU 24 N 0.0110 -0.0072 0.0005 192 LEU 24 CA 0.0115 -0.0079 -0.0002 193 LEU 24 C 0.0108 -0.0069 0.0012 194 LEU 24 O 0.0094 -0.0054 0.0010 195 LEU 24 CB 0.0112 -0.0077 -0.0027 196 LEU 24 CG 0.0118 -0.0085 -0.0043 197 LEU 24 CD1 0.0112 -0.0080 -0.0067 198 LEU 24 CD2 0.0135 -0.0103 -0.0042 199 ASP 25 N 0.0109 -0.0071 0.0032 200 ASP 25 CA 0.0112 -0.0062 0.0027 201 ASP 25 C 0.0103 -0.0051 0.0028 202 ASP 25 O 0.0102 -0.0042 0.0026 203 ASP 25 CB 0.0124 -0.0057 0.0020 204 ASP 25 CG 0.0129 -0.0050 0.0016 205 ASP 25 OD1 0.0123 -0.0046 0.0017 206 ASP 25 OD2 0.0139 -0.0047 0.0010 207 THR 26 N 0.0089 -0.0060 0.0021 208 THR 26 CA 0.0079 -0.0050 0.0022 209 THR 26 C 0.0083 -0.0040 0.0008 210 THR 26 O 0.0074 -0.0029 0.0006 211 THR 26 CB 0.0075 -0.0057 0.0031 212 THR 26 OG1 0.0087 -0.0064 0.0028 213 THR 26 CG2 0.0070 -0.0066 0.0045 214 GLY 27 N 0.0082 -0.0049 0.0026 215 GLY 27 CA 0.0089 -0.0034 0.0004 216 GLY 27 C 0.0099 0.0007 -0.0030 217 GLY 27 O 0.0105 0.0024 -0.0048 218 ALA 28 N 0.0081 0.0040 -0.0031 219 ALA 28 CA 0.0082 0.0055 -0.0043 220 ALA 28 C 0.0046 0.0073 -0.0036 221 ALA 28 O 0.0025 0.0059 -0.0015 222 ALA 28 CB 0.0097 0.0031 -0.0033 223 ASP 29 N 0.0054 0.0130 -0.0087 224 ASP 29 CA 0.0002 0.0147 -0.0087 225 ASP 29 C -0.0007 0.0121 -0.0066 226 ASP 29 O -0.0051 0.0110 -0.0047 227 ASP 29 CB -0.0000 0.0196 -0.0124 228 ASP 29 CG 0.0003 0.0226 -0.0147 229 ASP 29 OD1 -0.0006 0.0211 -0.0133 230 ASP 29 OD2 0.0014 0.0264 -0.0178 231 ASP 30 N 0.0024 0.0082 -0.0009 232 ASP 30 CA 0.0028 0.0066 -0.0001 233 ASP 30 CA 0.0027 0.0066 -0.0002 234 ASP 30 C 0.0038 0.0057 0.0008 235 ASP 30 O 0.0047 0.0065 0.0010 236 ASP 30 CB 0.0038 0.0070 0.0003 237 ASP 30 CB 0.0031 0.0067 0.0000 238 ASP 30 CG 0.0034 0.0086 -0.0005 239 ASP 30 CG 0.0019 0.0074 -0.0009 240 ASP 30 OD1 0.0019 0.0088 -0.0013 241 ASP 30 OD1 0.0005 0.0066 -0.0014 242 ASP 30 OD2 0.0045 0.0097 -0.0002 243 ASP 30 OD2 0.0023 0.0087 -0.0011 244 THR 31 N 0.0037 0.0041 0.0018 245 THR 31 CA 0.0046 0.0034 0.0030 246 THR 31 C 0.0057 0.0035 0.0039 247 THR 31 O 0.0055 0.0032 0.0039 248 THR 31 CB 0.0036 0.0018 0.0034 249 THR 31 OG1 0.0027 0.0018 0.0026 250 THR 31 CG2 0.0045 0.0009 0.0048 251 VAL 32 N 0.0070 -0.0015 0.0035 252 VAL 32 CA 0.0069 -0.0015 0.0034 253 VAL 32 C 0.0071 -0.0014 0.0040 254 VAL 32 O 0.0077 -0.0013 0.0042 255 VAL 32 CB 0.0073 -0.0016 0.0029 256 VAL 32 CG1 0.0069 -0.0016 0.0027 257 VAL 32 CG2 0.0074 -0.0017 0.0024 258 LEU 33 N 0.0009 -0.0020 0.0021 259 LEU 33 CA 0.0002 -0.0008 0.0020 260 LEU 33 C -0.0012 -0.0011 0.0020 261 LEU 33 O -0.0018 -0.0019 0.0020 262 LEU 33 CB 0.0004 0.0003 0.0020 263 LEU 33 CG 0.0019 0.0007 0.0021 264 LEU 33 CD1 0.0020 0.0019 0.0021 265 LEU 33 CD2 0.0026 0.0010 0.0021 266 GLU 34 N -0.0018 -0.0008 0.0010 267 GLU 34 CA -0.0045 -0.0013 -0.0004 268 GLU 34 C -0.0066 0.0008 -0.0009 269 GLU 34 O -0.0060 0.0028 0.0001 270 GLU 34 CB -0.0047 -0.0007 -0.0004 271 GLU 34 CG -0.0024 -0.0025 0.0002 272 GLU 34 CD -0.0024 -0.0014 0.0005 273 GLU 34 OE1 -0.0029 0.0012 0.0011 274 GLU 34 OE2 -0.0019 -0.0033 0.0002 275 GLU 35 N -0.0142 0.0023 0.0009 276 GLU 35 CA -0.0153 0.0040 0.0000 277 GLU 35 C -0.0141 0.0081 -0.0010 278 GLU 35 O -0.0148 0.0101 -0.0019 279 GLU 35 CB -0.0195 0.0034 -0.0009 280 GLU 35 CG -0.0210 0.0043 -0.0017 281 GLU 35 CD -0.0186 0.0029 -0.0005 282 GLU 35 OE1 -0.0182 -0.0004 0.0007 283 GLU 35 OE2 -0.0173 0.0051 -0.0009 284 MET 36 N -0.0156 0.0064 0.0004 285 MET 36 CA -0.0144 0.0073 -0.0017 286 MET 36 C -0.0120 0.0074 -0.0012 287 MET 36 O -0.0113 0.0069 0.0008 288 MET 36 CB -0.0140 0.0076 -0.0024 289 MET 36 CG -0.0126 0.0073 -0.0009 290 MET 36 SD -0.0121 0.0077 -0.0020 291 MET 36 CE -0.0109 0.0087 -0.0046 292 ASN 37 N -0.0157 0.0121 -0.0017 293 ASN 37 CA -0.0132 0.0119 -0.0013 294 ASN 37 C -0.0080 0.0128 -0.0012 295 ASN 37 O -0.0063 0.0163 -0.0029 296 ASN 37 CB -0.0152 0.0150 -0.0031 297 ASN 37 CG -0.0135 0.0142 -0.0025 298 ASN 37 OD1 -0.0106 0.0114 -0.0008 299 ASN 37 ND2 -0.0152 0.0167 -0.0040 300 LEU 38 N -0.0063 0.0066 0.0031 301 LEU 38 CA -0.0021 0.0072 0.0034 302 LEU 38 C 0.0015 0.0077 0.0037 303 LEU 38 O 0.0012 0.0064 0.0060 304 LEU 38 CB -0.0015 0.0055 0.0069 305 LEU 38 CG -0.0037 0.0054 0.0063 306 LEU 38 CD1 -0.0022 0.0039 0.0098 307 LEU 38 CD2 -0.0026 0.0076 0.0024 308 PRO 39 N 0.0009 0.0120 0.0014 309 PRO 39 CA 0.0027 0.0109 0.0019 310 PRO 39 C 0.0094 0.0044 0.0055 311 PRO 39 O 0.0144 0.0028 0.0062 312 PRO 39 CB 0.0064 0.0183 -0.0029 313 PRO 39 CG 0.0094 0.0221 -0.0055 314 PRO 39 CD 0.0063 0.0178 -0.0026 315 GLY 40 N 0.0119 -0.0165 0.0127 316 GLY 40 CA 0.0136 -0.0192 0.0126 317 GLY 40 C 0.0134 -0.0173 0.0181 318 GLY 40 O 0.0124 -0.0144 0.0230 319 ARG 41 N 0.0109 -0.0216 0.0271 320 ARG 41 CA 0.0140 -0.0040 0.0225 321 ARG 41 C 0.0123 0.0037 0.0203 322 ARG 41 O 0.0019 -0.0017 0.0212 323 ARG 41 CB 0.0024 0.0043 0.0196 324 ARG 41 CG -0.0163 0.0017 0.0192 325 ARG 41 CD -0.0266 0.0054 0.0176 326 ARG 41 NE -0.0430 0.0121 0.0149 327 ARG 41 CZ -0.0547 0.0172 0.0129 328 ARG 41 NH1 -0.0520 0.0165 0.0132 329 ARG 41 NH2 -0.0691 0.0231 0.0104 330 TRP 42 N 0.0071 0.0074 0.0196 331 TRP 42 CA 0.0066 0.0077 0.0197 332 TRP 42 C 0.0070 0.0095 0.0196 333 TRP 42 O 0.0078 0.0104 0.0193 334 TRP 42 CB 0.0075 0.0064 0.0194 335 TRP 42 CG 0.0092 0.0064 0.0188 336 TRP 42 CD1 0.0101 0.0055 0.0184 337 TRP 42 CD2 0.0103 0.0074 0.0183 338 TRP 42 NE1 0.0117 0.0058 0.0178 339 TRP 42 CE2 0.0118 0.0070 0.0178 340 TRP 42 CE3 0.0101 0.0086 0.0184 341 TRP 42 CZ2 0.0132 0.0077 0.0172 342 TRP 42 CZ3 0.0115 0.0093 0.0179 343 TRP 42 CH2 0.0130 0.0088 0.0173 344 LYS 43 N 0.0041 0.0130 0.0168 345 LYS 43 CA 0.0054 0.0211 0.0132 346 LYS 43 C 0.0096 0.0133 0.0097 347 LYS 43 O 0.0079 0.0031 0.0144 348 LYS 43 CB -0.0025 0.0288 0.0214 349 LYS 43 CG -0.0065 0.0384 0.0241 350 LYS 43 CD -0.0129 0.0481 0.0299 351 LYS 43 CE -0.0164 0.0578 0.0321 352 LYS 43 NZ -0.0108 0.0665 0.0228 353 PRO 44 N 0.0057 0.0093 0.0122 354 PRO 44 CA 0.0065 0.0050 0.0106 355 PRO 44 C 0.0058 0.0033 0.0144 356 PRO 44 O 0.0049 0.0064 0.0169 357 PRO 44 CB 0.0074 0.0069 0.0060 358 PRO 44 CG 0.0072 0.0116 0.0045 359 PRO 44 CD 0.0060 0.0138 0.0091 360 LYS 45 N 0.0012 -0.0071 0.0112 361 LYS 45 CA 0.0023 -0.0080 0.0116 362 LYS 45 C 0.0019 -0.0088 0.0115 363 LYS 45 O 0.0011 -0.0083 0.0111 364 LYS 45 CB 0.0036 -0.0071 0.0122 365 LYS 45 CG 0.0049 -0.0079 0.0127 366 LYS 45 CD 0.0060 -0.0071 0.0132 367 LYS 45 CE 0.0071 -0.0080 0.0136 368 LYS 45 NZ 0.0078 -0.0091 0.0139 369 MET 46 N 0.0006 -0.0209 -0.0006 370 MET 46 CA 0.0045 -0.0172 -0.0006 371 MET 46 C 0.0123 -0.0144 -0.0047 372 MET 46 O 0.0147 -0.0180 -0.0101 373 MET 46 CB 0.0027 -0.0219 -0.0033 374 MET 46 CG 0.0031 -0.0183 -0.0004 375 MET 46 SD -0.0038 -0.0235 0.0008 376 MET 46 CE -0.0112 -0.0260 0.0049 377 ILE 47 N 0.0049 -0.0012 -0.0040 378 ILE 47 CA 0.0056 -0.0012 -0.0039 379 ILE 47 C 0.0073 -0.0011 -0.0044 380 ILE 47 O 0.0081 -0.0012 -0.0041 381 ILE 47 CB 0.0054 -0.0016 -0.0023 382 ILE 47 CG1 0.0062 -0.0019 -0.0011 383 ILE 47 CG2 0.0036 -0.0017 -0.0020 384 ILE 47 CD1 0.0063 -0.0022 0.0004 385 GLY 48 N 0.0023 0.0042 -0.0053 386 GLY 48 CA 0.0025 0.0049 -0.0052 387 GLY 48 C 0.0000 0.0027 -0.0051 388 GLY 48 O -0.0028 0.0020 -0.0048 389 GLY 49 N 0.0028 -0.0012 -0.0052 390 GLY 49 CA 0.0007 -0.0056 -0.0032 391 GLY 49 C 0.0000 -0.0088 -0.0038 392 GLY 49 O 0.0006 -0.0073 -0.0042 393 ILE 50 N -0.0006 -0.0113 -0.0055 394 ILE 50 CA -0.0020 -0.0142 -0.0058 395 ILE 50 C -0.0026 -0.0141 -0.0090 396 ILE 50 O -0.0025 -0.0129 -0.0111 397 ILE 50 CB -0.0028 -0.0160 -0.0054 398 ILE 50 CG1 -0.0032 -0.0182 -0.0028 399 ILE 50 CG2 -0.0039 -0.0173 -0.0083 400 ILE 50 CD1 -0.0038 -0.0198 -0.0019 401 GLY 51 N -0.0023 -0.0178 -0.0096 402 GLY 51 CA -0.0021 -0.0177 -0.0132 403 GLY 51 C 0.0022 -0.0145 -0.0130 404 GLY 51 O 0.0024 -0.0144 -0.0150 405 GLY 52 N 0.0071 -0.0078 -0.0086 406 GLY 52 CA 0.0122 0.0005 -0.0091 407 GLY 52 C 0.0143 0.0029 -0.0102 408 GLY 52 O 0.0107 -0.0001 -0.0078 409 PHE 53 N 0.0230 0.0123 -0.0089 410 PHE 53 CA 0.0202 0.0078 -0.0085 411 PHE 53 CA 0.0202 0.0079 -0.0085 412 PHE 53 C 0.0255 0.0012 -0.0064 413 PHE 53 O 0.0325 0.0015 -0.0053 414 PHE 53 CB 0.0189 0.0133 -0.0097 415 PHE 53 CB 0.0196 0.0133 -0.0096 416 PHE 53 CG 0.0120 0.0184 -0.0118 417 PHE 53 CG 0.0274 0.0163 -0.0090 418 PHE 53 CD1 0.0052 0.0169 -0.0126 419 PHE 53 CD1 0.0308 0.0231 -0.0098 420 PHE 53 CD2 0.0122 0.0248 -0.0130 421 PHE 53 CD2 0.0313 0.0123 -0.0076 422 PHE 53 CE1 -0.0013 0.0216 -0.0145 423 PHE 53 CE1 0.0379 0.0259 -0.0092 424 PHE 53 CE2 0.0058 0.0295 -0.0149 425 PHE 53 CE2 0.0384 0.0150 -0.0070 426 PHE 53 CZ -0.0010 0.0279 -0.0157 427 PHE 53 CZ 0.0417 0.0218 -0.0078 428 ILE 54 N 0.0088 -0.0018 0.0011 429 ILE 54 CA 0.0107 -0.0043 0.0021 430 ILE 54 C 0.0106 -0.0061 0.0019 431 ILE 54 O 0.0087 -0.0062 0.0006 432 ILE 54 CB 0.0104 -0.0065 0.0017 433 ILE 54 CG1 0.0078 -0.0078 -0.0001 434 ILE 54 CG2 0.0110 -0.0049 0.0022 435 ILE 54 CD1 0.0076 -0.0106 -0.0005 436 LYS 55 N 0.0058 0.0195 0.0056 437 LYS 55 CA -0.0005 -0.0189 0.0068 438 LYS 55 C 0.0017 -0.0150 0.0017 439 LYS 55 O 0.0004 0.0110 0.0186 440 LYS 55 CB -0.0147 -0.0353 0.0441 441 LYS 55 CG -0.0187 -0.0461 0.0516 442 LYS 55 CD -0.0332 -0.0620 0.0901 443 LYS 55 CE -0.0375 -0.0289 0.1200 444 LYS 55 NZ -0.0508 -0.0439 0.1552 445 VAL 56 N 0.0009 -0.0074 0.0108 446 VAL 56 CA 0.0014 -0.0064 0.0103 447 VAL 56 C 0.0019 -0.0064 0.0102 448 VAL 56 O 0.0022 -0.0072 0.0106 449 VAL 56 CB 0.0022 -0.0062 0.0100 450 VAL 56 CG1 0.0016 -0.0061 0.0100 451 VAL 56 CG2 0.0031 -0.0070 0.0104 452 ARG 57 N -0.0013 -0.0008 0.0157 453 ARG 57 CA 0.0009 0.0004 0.0154 454 ARG 57 C 0.0030 0.0010 0.0158 455 ARG 57 O 0.0026 0.0016 0.0149 456 ARG 57 CB 0.0003 0.0021 0.0132 457 ARG 57 CG -0.0015 0.0017 0.0128 458 ARG 57 CD -0.0020 0.0034 0.0107 459 ARG 57 NE -0.0041 0.0038 0.0092 460 ARG 57 CZ -0.0038 0.0053 0.0077 461 ARG 57 NH1 -0.0017 0.0067 0.0072 462 ARG 57 NH2 -0.0058 0.0055 0.0065 463 GLN 58 N 0.0033 0.0054 0.0172 464 GLN 58 CA 0.0024 0.0055 0.0188 465 GLN 58 C 0.0021 0.0063 0.0192 466 GLN 58 O 0.0021 0.0077 0.0187 467 GLN 58 CB 0.0020 0.0065 0.0194 468 GLN 58 CG 0.0011 0.0067 0.0211 469 GLN 58 CD 0.0006 0.0077 0.0216 470 GLN 58 OE1 0.0008 0.0076 0.0212 471 GLN 58 NE2 -0.0002 0.0088 0.0226 472 TYR 59 N 0.0008 0.0041 0.0167 473 TYR 59 CA 0.0017 0.0038 0.0156 474 TYR 59 C 0.0016 0.0038 0.0154 475 TYR 59 O 0.0004 0.0038 0.0151 476 TYR 59 CB 0.0014 0.0035 0.0143 477 TYR 59 CG 0.0017 0.0035 0.0142 478 TYR 59 CD1 0.0030 0.0033 0.0137 479 TYR 59 CD2 0.0008 0.0037 0.0147 480 TYR 59 CE1 0.0034 0.0033 0.0137 481 TYR 59 CE2 0.0011 0.0036 0.0146 482 TYR 59 CZ 0.0024 0.0034 0.0141 483 TYR 59 OH 0.0028 0.0034 0.0141 484 ASP 60 N 0.0001 0.0046 0.0143 485 ASP 60 CA -0.0047 0.0046 0.0144 486 ASP 60 C -0.0061 -0.0001 0.0140 487 ASP 60 O -0.0033 -0.0028 0.0137 488 ASP 60 CB -0.0054 0.0083 0.0148 489 ASP 60 CG -0.0045 0.0130 0.0152 490 ASP 60 OD1 -0.0054 0.0138 0.0153 491 ASP 60 OD2 -0.0029 0.0160 0.0155 492 GLN 61 N -0.0076 -0.0047 0.0008 493 GLN 61 CA -0.0122 -0.0107 0.0041 494 GLN 61 C -0.0073 -0.0153 0.0101 495 GLN 61 O -0.0090 -0.0204 0.0138 496 GLN 61 CB -0.0188 -0.0129 0.0032 497 GLN 61 CG -0.0232 -0.0081 -0.0029 498 GLN 61 CD -0.0288 -0.0097 -0.0038 499 GLN 61 OE1 -0.0268 -0.0108 -0.0021 500 GLN 61 NE2 -0.0358 -0.0098 -0.0067 501 ILE 62 N -0.0016 -0.0021 0.0056 502 ILE 62 CA -0.0014 -0.0026 0.0054 503 ILE 62 C -0.0034 -0.0028 0.0026 504 ILE 62 O -0.0053 -0.0010 0.0016 505 ILE 62 CB -0.0012 -0.0002 0.0077 506 ILE 62 CG1 0.0011 -0.0004 0.0105 507 ILE 62 CG2 -0.0015 -0.0004 0.0071 508 ILE 62 CD1 0.0032 -0.0033 0.0109 509 LEU 63 N -0.0031 -0.0049 -0.0045 510 LEU 63 CA -0.0051 -0.0052 -0.0075 511 LEU 63 C -0.0066 -0.0034 -0.0073 512 LEU 63 O -0.0054 -0.0036 -0.0059 513 LEU 63 CB -0.0038 -0.0083 -0.0094 514 LEU 63 CG -0.0057 -0.0089 -0.0125 515 LEU 63 CD1 -0.0078 -0.0084 -0.0146 516 LEU 63 CD2 -0.0043 -0.0117 -0.0139 517 ILE 64 N -0.0020 -0.0052 -0.0063 518 ILE 64 CA -0.0026 -0.0039 -0.0062 519 ILE 64 C -0.0039 -0.0042 -0.0082 520 ILE 64 O -0.0048 -0.0043 -0.0095 521 ILE 64 CB -0.0032 -0.0015 -0.0054 522 ILE 64 CG1 -0.0021 -0.0010 -0.0036 523 ILE 64 CG2 -0.0034 -0.0004 -0.0049 524 ILE 64 CD1 -0.0024 0.0013 -0.0024 525 GLU 65 N -0.0037 -0.0046 -0.0086 526 GLU 65 CA -0.0037 -0.0045 -0.0087 527 GLU 65 C -0.0027 -0.0036 -0.0088 528 GLU 65 O -0.0019 -0.0033 -0.0081 529 GLU 65 CB -0.0038 -0.0053 -0.0076 530 GLU 65 CG -0.0041 -0.0054 -0.0078 531 GLU 65 CD -0.0045 -0.0063 -0.0069 532 GLU 65 OE1 -0.0049 -0.0069 -0.0063 533 GLU 65 OE2 -0.0044 -0.0063 -0.0068 534 ILE 66 N 0.0018 -0.0057 -0.0102 535 ILE 66 CA 0.0022 -0.0050 -0.0103 536 ILE 66 C 0.0022 -0.0050 -0.0104 537 ILE 66 O 0.0018 -0.0051 -0.0109 538 ILE 66 CB 0.0021 -0.0046 -0.0109 539 ILE 66 CG1 0.0021 -0.0047 -0.0109 540 ILE 66 CG2 0.0025 -0.0039 -0.0111 541 ILE 66 CD1 0.0019 -0.0045 -0.0115 542 CYS 67 N 0.0074 -0.0067 -0.0107 543 CYS 67 CA 0.0078 -0.0074 -0.0096 544 CYS 67 C 0.0044 -0.0096 -0.0092 545 CYS 67 O 0.0033 -0.0096 -0.0101 546 CYS 67 CB 0.0093 -0.0049 -0.0118 547 CYS 67 SG 0.0107 -0.0052 -0.0103 548 GLY 68 N 0.0008 -0.0086 -0.0078 549 GLY 68 CA -0.0031 -0.0131 -0.0085 550 GLY 68 C -0.0072 -0.0128 -0.0119 551 GLY 68 O -0.0107 -0.0162 -0.0128 552 HIS 69 N -0.0066 -0.0083 -0.0162 553 HIS 69 CA -0.0079 -0.0092 -0.0183 554 HIS 69 C -0.0083 -0.0103 -0.0175 555 HIS 69 O -0.0074 -0.0093 -0.0168 556 HIS 69 CB -0.0074 -0.0074 -0.0204 557 HIS 69 CG -0.0073 -0.0065 -0.0218 558 HIS 69 ND1 -0.0062 -0.0054 -0.0207 559 HIS 69 CD2 -0.0080 -0.0064 -0.0241 560 HIS 69 CE1 -0.0063 -0.0047 -0.0223 561 HIS 69 NE2 -0.0074 -0.0053 -0.0244 562 LYS 70 N -0.0146 -0.0098 -0.0185 563 LYS 70 CA -0.0123 -0.0102 -0.0166 564 LYS 70 C -0.0134 -0.0068 -0.0175 565 LYS 70 O -0.0166 -0.0061 -0.0200 566 LYS 70 CB -0.0125 -0.0152 -0.0168 567 LYS 70 CG -0.0109 -0.0187 -0.0155 568 LYS 70 CD -0.0111 -0.0235 -0.0158 569 LYS 70 CE -0.0119 -0.0272 -0.0164 570 LYS 70 NZ -0.0088 -0.0277 -0.0139 571 ALA 71 N -0.0078 -0.0033 -0.0125 572 ALA 71 CA -0.0079 -0.0024 -0.0125 573 ALA 71 C -0.0068 -0.0031 -0.0112 574 ALA 71 O -0.0059 -0.0037 -0.0101 575 ALA 71 CB -0.0081 -0.0002 -0.0124 576 ILE 72 N -0.0089 -0.0013 -0.0083 577 ILE 72 CA -0.0077 -0.0025 -0.0062 578 ILE 72 C -0.0078 -0.0009 -0.0055 579 ILE 72 O -0.0085 -0.0005 -0.0070 580 ILE 72 CB -0.0071 -0.0053 -0.0068 581 ILE 72 CG1 -0.0067 -0.0070 -0.0070 582 ILE 72 CG2 -0.0060 -0.0062 -0.0048 583 ILE 72 CD1 -0.0062 -0.0098 -0.0078 584 GLY 73 N -0.0064 0.0006 -0.0010 585 GLY 73 CA -0.0066 0.0022 0.0001 586 GLY 73 C -0.0058 0.0028 0.0036 587 GLY 73 O -0.0050 0.0018 0.0052 588 THR 74 N -0.0060 0.0024 0.0063 589 THR 74 CA -0.0043 0.0034 0.0073 590 THR 74 C -0.0033 0.0038 0.0079 591 THR 74 O -0.0040 0.0048 0.0074 592 THR 74 CB -0.0044 0.0055 0.0072 593 THR 74 OG1 -0.0049 0.0049 0.0069 594 THR 74 CG2 -0.0026 0.0067 0.0082 595 VAL 75 N -0.0012 0.0030 0.0100 596 VAL 75 CA -0.0015 0.0032 0.0100 597 VAL 75 C -0.0008 0.0038 0.0111 598 VAL 75 O 0.0003 0.0035 0.0114 599 VAL 75 CB -0.0012 0.0023 0.0093 600 VAL 75 CG1 -0.0014 0.0026 0.0094 601 VAL 75 CG2 -0.0019 0.0018 0.0083 602 LEU 76 N 0.0033 0.0013 0.0105 603 LEU 76 CA 0.0033 0.0012 0.0101 604 LEU 76 C 0.0032 0.0009 0.0096 605 LEU 76 O 0.0031 0.0006 0.0097 606 LEU 76 CB 0.0032 0.0008 0.0103 607 LEU 76 CG 0.0032 0.0010 0.0109 608 LEU 76 CD1 0.0032 0.0006 0.0111 609 LEU 76 CD2 0.0034 0.0015 0.0109 610 VAL 77 N -0.0014 -0.0010 0.0100 611 VAL 77 CA -0.0027 -0.0008 0.0087 612 VAL 77 C -0.0039 -0.0023 0.0081 613 VAL 77 O -0.0040 -0.0025 0.0079 614 VAL 77 CB -0.0029 0.0011 0.0078 615 VAL 77 CG1 -0.0042 0.0012 0.0064 616 VAL 77 CG2 -0.0016 0.0026 0.0085 617 GLY 78 N -0.0030 -0.0044 0.0045 618 GLY 78 CA -0.0035 -0.0056 0.0032 619 GLY 78 C -0.0044 -0.0081 0.0027 620 GLY 78 O -0.0046 -0.0088 0.0032 621 PRO 79 N -0.0044 -0.0102 -0.0010 622 PRO 79 CA -0.0036 -0.0103 -0.0009 623 PRO 79 C -0.0022 -0.0108 -0.0009 624 PRO 79 O -0.0016 -0.0114 -0.0015 625 PRO 79 CB -0.0042 -0.0109 -0.0018 626 PRO 79 CG -0.0048 -0.0114 -0.0027 627 PRO 79 CD -0.0052 -0.0109 -0.0021 628 THR 80 N -0.0001 -0.0091 -0.0040 629 THR 80 CA 0.0014 -0.0100 -0.0031 630 THR 80 C 0.0012 -0.0098 -0.0032 631 THR 80 O 0.0004 -0.0082 -0.0034 632 THR 80 CB 0.0029 -0.0091 -0.0016 633 THR 80 OG1 0.0043 -0.0098 -0.0007 634 THR 80 CG2 0.0026 -0.0067 -0.0013 635 PRO 81 N 0.0004 -0.0137 -0.0076 636 PRO 81 CA 0.0009 -0.0132 -0.0069 637 PRO 81 C 0.0020 -0.0116 -0.0048 638 PRO 81 O 0.0020 -0.0108 -0.0041 639 PRO 81 CB 0.0024 -0.0153 -0.0075 640 PRO 81 CG 0.0035 -0.0165 -0.0078 641 PRO 81 CD 0.0019 -0.0158 -0.0083 642 VAL 82 N 0.0067 -0.0082 -0.0001 643 VAL 82 CA 0.0089 -0.0061 0.0019 644 VAL 82 C 0.0090 -0.0048 0.0026 645 VAL 82 O 0.0090 -0.0066 0.0017 646 VAL 82 CB 0.0122 -0.0079 0.0025 647 VAL 82 CG1 0.0148 -0.0063 0.0044 648 VAL 82 CG2 0.0122 -0.0083 0.0023 649 ASN 83 N 0.0070 -0.0060 -0.0008 650 ASN 83 CA 0.0082 -0.0047 -0.0001 651 ASN 83 C 0.0103 -0.0056 0.0012 652 ASN 83 O 0.0112 -0.0057 0.0018 653 ASN 83 CB 0.0083 -0.0022 0.0001 654 ASN 83 CG 0.0064 -0.0009 -0.0011 655 ASN 83 OD1 0.0052 -0.0013 -0.0018 656 ASN 83 ND2 0.0060 0.0006 -0.0013 657 ILE 84 N 0.0121 -0.0042 0.0023 658 ILE 84 N 0.0120 -0.0041 0.0024 659 ILE 84 CA 0.0121 -0.0044 0.0031 660 ILE 84 CA 0.0120 -0.0042 0.0030 661 ILE 84 C 0.0112 -0.0033 0.0039 662 ILE 84 C 0.0111 -0.0033 0.0040 663 ILE 84 O 0.0105 -0.0024 0.0033 664 ILE 84 O 0.0104 -0.0023 0.0035 665 ILE 84 CB 0.0126 -0.0047 0.0021 666 ILE 84 CB 0.0121 -0.0041 0.0018 667 ILE 84 CG1 0.0120 -0.0038 0.0009 668 ILE 84 CG1 0.0131 -0.0052 0.0009 669 ILE 84 CG2 0.0136 -0.0059 0.0016 670 ILE 84 CG2 0.0119 -0.0040 0.0024 671 ILE 84 CD1 0.0124 -0.0041 -0.0000 672 ILE 84 CD1 0.0132 -0.0050 -0.0005 673 ILE 85 N 0.0082 -0.0030 -0.0003 674 ILE 85 CA 0.0075 -0.0027 0.0001 675 ILE 85 C 0.0068 -0.0019 0.0005 676 ILE 85 O 0.0062 -0.0022 0.0008 677 ILE 85 CB 0.0069 -0.0037 0.0002 678 ILE 85 CG1 0.0076 -0.0046 -0.0002 679 ILE 85 CG2 0.0063 -0.0034 0.0006 680 ILE 85 CD1 0.0084 -0.0042 -0.0005 681 GLY 86 N 0.0045 0.0009 -0.0002 682 GLY 86 CA 0.0031 0.0034 -0.0009 683 GLY 86 C -0.0001 0.0035 -0.0007 684 GLY 86 O -0.0012 0.0016 0.0000 685 ARG 87 N -0.0057 0.0060 -0.0036 686 ARG 87 CA -0.0086 0.0066 -0.0019 687 ARG 87 C -0.0108 0.0081 -0.0014 688 ARG 87 O -0.0130 0.0078 0.0007 689 ARG 87 CB -0.0093 0.0084 -0.0028 690 ARG 87 CG -0.0073 0.0069 -0.0031 691 ARG 87 CD -0.0084 0.0086 -0.0037 692 ARG 87 NE -0.0080 0.0113 -0.0061 693 ARG 87 CZ -0.0101 0.0138 -0.0065 694 ARG 87 NH1 -0.0127 0.0141 -0.0047 695 ARG 87 NH2 -0.0094 0.0160 -0.0088 696 ASN 88 N -0.0044 0.0105 -0.0034 697 ASN 88 CA -0.0046 0.0092 -0.0034 698 ASN 88 C -0.0048 0.0079 -0.0034 699 ASN 88 O -0.0053 0.0068 -0.0039 700 ASN 88 CB -0.0038 0.0090 -0.0025 701 ASN 88 CG -0.0028 0.0084 -0.0014 702 ASN 88 OD1 -0.0024 0.0091 -0.0010 703 ASN 88 ND2 -0.0026 0.0072 -0.0009 704 LEU 89 N -0.0049 0.0043 -0.0048 705 LEU 89 CA -0.0052 0.0025 -0.0043 706 LEU 89 C -0.0061 0.0025 -0.0048 707 LEU 89 O -0.0070 0.0011 -0.0048 708 LEU 89 CB -0.0036 0.0017 -0.0030 709 LEU 89 CG -0.0029 0.0012 -0.0024 710 LEU 89 CD1 -0.0014 0.0004 -0.0011 711 LEU 89 CD2 -0.0041 0.0000 -0.0027 712 LEU 90 N -0.0043 -0.0004 -0.0029 713 LEU 90 CA -0.0053 -0.0013 -0.0023 714 LEU 90 C -0.0085 -0.0011 -0.0022 715 LEU 90 O -0.0099 -0.0028 -0.0012 716 LEU 90 CB -0.0039 0.0000 -0.0031 717 LEU 90 CG -0.0007 -0.0005 -0.0031 718 LEU 90 CD1 0.0004 0.0011 -0.0041 719 LEU 90 CD2 0.0002 -0.0033 -0.0017 720 THR 91 N -0.0126 0.0047 -0.0039 721 THR 91 CA -0.0179 0.0063 -0.0020 722 THR 91 C -0.0189 0.0030 -0.0017 723 THR 91 O -0.0235 0.0011 -0.0001 724 THR 91 CB -0.0184 0.0129 -0.0018 725 THR 91 OG1 -0.0138 0.0149 -0.0034 726 THR 91 CG2 -0.0185 0.0162 -0.0017 727 GLN 92 N -0.0152 0.0021 -0.0065 728 GLN 92 CA -0.0141 0.0003 -0.0079 729 GLN 92 C -0.0157 -0.0029 -0.0097 730 GLN 92 O -0.0159 -0.0044 -0.0106 731 GLN 92 CB -0.0102 0.0005 -0.0087 732 GLN 92 CG -0.0085 0.0036 -0.0070 733 GLN 92 CD -0.0050 0.0043 -0.0073 734 GLN 92 OE1 -0.0039 0.0068 -0.0059 735 GLN 92 NE2 -0.0031 0.0020 -0.0092 736 ILE 93 N -0.0080 -0.0029 -0.0162 737 ILE 93 CA -0.0078 -0.0037 -0.0152 738 ILE 93 C -0.0080 -0.0035 -0.0155 739 ILE 93 O -0.0077 -0.0041 -0.0148 740 ILE 93 CB -0.0063 -0.0041 -0.0146 741 ILE 93 CG1 -0.0051 -0.0034 -0.0152 742 ILE 93 CG2 -0.0062 -0.0043 -0.0143 743 ILE 93 CD1 -0.0036 -0.0037 -0.0146 744 GLY 94 N -0.0138 0.0012 -0.0047 745 GLY 94 CA -0.0085 0.0020 -0.0084 746 GLY 94 C -0.0016 0.0049 -0.0088 747 GLY 94 O 0.0035 0.0070 -0.0089 748 CYS 95 N 0.0016 0.0026 -0.0057 749 CYS 95 CA 0.0004 0.0007 -0.0060 750 CYS 95 C -0.0024 0.0031 -0.0032 751 CYS 95 O -0.0014 0.0070 -0.0018 752 CYS 95 CB 0.0042 0.0007 -0.0081 753 CYS 95 SG 0.0031 -0.0024 -0.0090 754 THR 96 N 0.0062 0.0073 -0.0035 755 THR 96 CA 0.0062 0.0046 -0.0008 756 THR 96 C 0.0059 -0.0004 -0.0021 757 THR 96 O 0.0058 -0.0023 -0.0037 758 THR 96 CB 0.0065 0.0051 0.0044 759 THR 96 OG1 0.0065 0.0031 0.0055 760 THR 96 CG2 0.0068 0.0101 0.0059 761 LEU 97 N 0.0098 -0.0039 0.0056 762 LEU 97 CA 0.0081 -0.0070 0.0056 763 LEU 97 C 0.0077 -0.0082 0.0087 764 LEU 97 O 0.0085 -0.0071 0.0113 765 LEU 97 CB 0.0077 -0.0079 0.0059 766 LEU 97 CG 0.0073 -0.0081 0.0028 767 LEU 97 CD1 0.0071 -0.0087 0.0039 768 LEU 97 CD2 0.0058 -0.0105 0.0007 769 ASN 98 N 0.0068 -0.0093 0.0053 770 ASN 98 CA 0.0055 -0.0108 0.0081 771 ASN 98 C 0.0022 -0.0144 0.0084 772 ASN 98 O 0.0007 -0.0160 0.0051 773 ASN 98 CB 0.0060 -0.0102 0.0062 774 ASN 98 CG 0.0091 -0.0068 0.0045 775 ASN 98 OD1 0.0098 -0.0061 0.0006 776 ASN 98 ND2 0.0110 -0.0047 0.0073 777 PHE 99 N 0.0043 -0.0133 0.0121 778 PHE 99 CA 0.0021 -0.0149 0.0124 779 PHE 99 C 0.0017 -0.0153 0.0148 780 PHE 99 O -0.0001 -0.0166 0.0153 781 PHE 99 CB 0.0011 -0.0156 0.0126 782 PHE 99 CG 0.0017 -0.0153 0.0150 783 PHE 99 CD1 0.0035 -0.0140 0.0151 784 PHE 99 CD2 0.0004 -0.0163 0.0171 785 PHE 99 CE1 0.0041 -0.0138 0.0173 786 PHE 99 CE2 0.0010 -0.0161 0.0193 787 PHE 99 CZ 0.0029 -0.0148 0.0194 788 PHE 99 OXT 0.0031 -0.0144 0.0162 789 PRO 1 N 0.0091 -0.0165 0.0291 790 PRO 1 CA 0.0102 -0.0130 0.0301 791 PRO 1 C 0.0112 -0.0110 0.0265 792 PRO 1 O 0.0109 -0.0124 0.0232 793 PRO 1 CB 0.0108 -0.0109 0.0322 794 PRO 1 CG 0.0105 -0.0121 0.0301 795 PRO 1 CD 0.0092 -0.0162 0.0290 796 GLN 2 N 0.0155 -0.0090 0.0333 797 GLN 2 CA 0.0143 -0.0049 0.0296 798 GLN 2 C 0.0136 -0.0024 0.0273 799 GLN 2 O 0.0142 -0.0012 0.0300 800 GLN 2 CB 0.0148 -0.0007 0.0323 801 GLN 2 CG 0.0136 0.0033 0.0285 802 GLN 2 CD 0.0139 0.0086 0.0310 803 GLN 2 OE1 0.0140 0.0118 0.0322 804 GLN 2 NE2 0.0140 0.0096 0.0318 805 ILE 3 N 0.0108 -0.0031 0.0230 806 ILE 3 CA 0.0102 -0.0016 0.0209 807 ILE 3 C 0.0096 0.0023 0.0184 808 ILE 3 O 0.0088 0.0021 0.0158 809 ILE 3 CB 0.0094 -0.0052 0.0181 810 ILE 3 CG1 0.0100 -0.0091 0.0205 811 ILE 3 CG2 0.0088 -0.0039 0.0157 812 ILE 3 CD1 0.0093 -0.0130 0.0182 813 THR 4 N 0.0085 0.0076 0.0267 814 THR 4 CA 0.0017 0.0140 0.0237 815 THR 4 C -0.0015 0.0119 0.0140 816 THR 4 O 0.0012 0.0058 0.0097 817 THR 4 CB -0.0018 0.0200 0.0264 818 THR 4 OG1 0.0001 0.0166 0.0247 819 THR 4 CG2 -0.0005 0.0244 0.0357 820 LEU 5 N -0.0130 0.0080 0.0114 821 LEU 5 CA -0.0127 0.0077 0.0042 822 LEU 5 C -0.0173 0.0126 0.0000 823 LEU 5 O -0.0182 0.0134 -0.0053 824 LEU 5 CB -0.0112 0.0061 0.0041 825 LEU 5 CG -0.0060 0.0006 0.0063 826 LEU 5 CD1 -0.0053 -0.0001 0.0081 827 LEU 5 CD2 -0.0025 -0.0031 0.0006 828 TRP 6 N -0.0390 0.0228 0.0041 829 TRP 6 CA -0.0476 0.0292 -0.0028 830 TRP 6 C -0.0469 0.0221 -0.0159 831 TRP 6 O -0.0543 0.0259 -0.0256 832 TRP 6 CB -0.0488 0.0348 0.0062 833 TRP 6 CG -0.0498 0.0418 0.0187 834 TRP 6 CD1 -0.0426 0.0394 0.0306 835 TRP 6 CD2 -0.0584 0.0522 0.0203 836 TRP 6 NE1 -0.0462 0.0477 0.0398 837 TRP 6 CE2 -0.0559 0.0557 0.0336 838 TRP 6 CE3 -0.0680 0.0589 0.0118 839 TRP 6 CZ2 -0.0627 0.0657 0.0388 840 TRP 6 CZ3 -0.0748 0.0689 0.0168 841 TRP 6 CH2 -0.0721 0.0722 0.0302 842 GLN 7 N -0.0418 0.0070 0.0009 843 GLN 7 CA -0.0359 -0.0012 -0.0206 844 GLN 7 CA -0.0358 -0.0012 -0.0206 845 GLN 7 C -0.0171 0.0013 -0.0154 846 GLN 7 O -0.0056 0.0088 0.0033 847 GLN 7 CB -0.0260 -0.0081 -0.0391 848 GLN 7 CB -0.0252 -0.0079 -0.0388 849 GLN 7 CG -0.0045 -0.0044 -0.0308 850 GLN 7 CG -0.0436 -0.0116 -0.0471 851 GLN 7 CD 0.0009 -0.0104 -0.0469 852 GLN 7 CD -0.0339 -0.0195 -0.0684 853 GLN 7 OE1 -0.0152 -0.0158 -0.0597 854 GLN 7 OE1 -0.0107 -0.0187 -0.0676 855 GLN 7 NE2 0.0238 -0.0095 -0.0458 856 GLN 7 NE2 -0.0517 -0.0267 -0.0859 857 ARG 8 N -0.0107 0.0129 -0.0066 858 ARG 8 CA -0.0062 0.0126 -0.0062 859 ARG 8 C -0.0059 0.0124 -0.0059 860 ARG 8 O -0.0081 0.0138 -0.0076 861 ARG 8 CB -0.0039 0.0151 -0.0092 862 ARG 8 CG -0.0026 0.0151 -0.0091 863 ARG 8 CD -0.0006 0.0177 -0.0123 864 ARG 8 NE 0.0024 0.0176 -0.0121 865 ARG 8 CZ 0.0020 0.0187 -0.0135 866 ARG 8 NH1 -0.0014 0.0201 -0.0152 867 ARG 8 NH2 0.0049 0.0185 -0.0131 868 PRO 9 N 0.0027 0.0013 -0.0020 869 PRO 9 CA 0.0045 -0.0021 0.0017 870 PRO 9 C 0.0067 -0.0057 -0.0007 871 PRO 9 O 0.0089 -0.0092 -0.0018 872 PRO 9 CB 0.0054 -0.0036 0.0034 873 PRO 9 CG 0.0052 -0.0030 -0.0012 874 PRO 9 CD 0.0029 0.0011 -0.0038 875 LEU 10 N 0.0019 -0.0047 0.0035 876 LEU 10 CA 0.0018 -0.0077 0.0033 877 LEU 10 C 0.0029 -0.0096 0.0061 878 LEU 10 O 0.0038 -0.0083 0.0086 879 LEU 10 CB 0.0017 -0.0071 0.0030 880 LEU 10 CG 0.0007 -0.0058 0.0000 881 LEU 10 CD1 0.0008 -0.0046 0.0003 882 LEU 10 CD2 -0.0002 -0.0084 -0.0024 883 VAL 11 N 0.0006 -0.0166 0.0152 884 VAL 11 CA 0.0008 -0.0166 0.0152 885 VAL 11 C 0.0008 -0.0167 0.0152 886 VAL 11 O 0.0007 -0.0168 0.0151 887 VAL 11 CB 0.0008 -0.0165 0.0153 888 VAL 11 CG1 0.0008 -0.0163 0.0153 889 VAL 11 CG2 0.0007 -0.0165 0.0153 890 THR 12 N -0.0059 -0.0175 0.0134 891 THR 12 CA -0.0053 -0.0137 0.0127 892 THR 12 C -0.0040 -0.0106 0.0139 893 THR 12 O -0.0043 -0.0108 0.0132 894 THR 12 CB -0.0068 -0.0129 0.0085 895 THR 12 OG1 -0.0079 -0.0158 0.0075 896 THR 12 CG2 -0.0061 -0.0089 0.0077 897 ILE 13 N -0.0033 -0.0068 0.0142 898 ILE 13 CA -0.0020 -0.0054 0.0149 899 ILE 13 C -0.0016 -0.0030 0.0138 900 ILE 13 O -0.0019 -0.0024 0.0131 901 ILE 13 CB -0.0004 -0.0057 0.0171 902 ILE 13 CG1 0.0005 -0.0049 0.0177 903 ILE 13 CG2 -0.0009 -0.0082 0.0182 904 ILE 13 CD1 0.0022 -0.0048 0.0199 905 LYS 14 N 0.0009 0.0079 0.0131 906 LYS 14 CA 0.0024 0.0153 0.0108 907 LYS 14 C 0.0060 0.0207 0.0167 908 LYS 14 O 0.0068 0.0215 0.0183 909 LYS 14 CB 0.0007 0.0182 0.0025 910 LYS 14 CG 0.0021 0.0256 -0.0004 911 LYS 14 CD 0.0006 0.0289 -0.0083 912 LYS 14 CE 0.0021 0.0362 -0.0108 913 LYS 14 NZ 0.0006 0.0393 -0.0186 914 ILE 15 N 0.0064 0.0175 0.0150 915 ILE 15 CA 0.0071 0.0174 0.0150 916 ILE 15 C 0.0072 0.0187 0.0155 917 ILE 15 O 0.0076 0.0197 0.0160 918 ILE 15 CB 0.0086 0.0166 0.0148 919 ILE 15 CG1 0.0091 0.0163 0.0147 920 ILE 15 CG2 0.0096 0.0174 0.0152 921 ILE 15 CD1 0.0106 0.0156 0.0146 922 GLY 16 N 0.0102 0.0240 0.0137 923 GLY 16 CA 0.0122 0.0227 0.0101 924 GLY 16 C 0.0108 0.0246 0.0103 925 GLY 16 O 0.0112 0.0257 0.0065 926 GLY 17 N 0.0095 0.0353 0.0100 927 GLY 17 CA 0.0032 0.0401 0.0053 928 GLY 17 C 0.0044 0.0357 0.0058 929 GLY 17 O -0.0004 0.0396 0.0022 930 GLN 18 N 0.0056 0.0208 0.0107 931 GLN 18 CA 0.0048 0.0196 0.0106 932 GLN 18 C 0.0041 0.0185 0.0108 933 GLN 18 O 0.0042 0.0186 0.0116 934 GLN 18 CB 0.0049 0.0195 0.0118 935 GLN 18 CG 0.0055 0.0205 0.0117 936 GLN 18 CD 0.0057 0.0204 0.0129 937 GLN 18 OE1 0.0051 0.0195 0.0131 938 GLN 18 NE2 0.0064 0.0214 0.0138 939 LEU 19 N 0.0016 0.0141 0.0080 940 LEU 19 CA -0.0010 0.0071 0.0072 941 LEU 19 C -0.0015 0.0015 0.0128 942 LEU 19 O -0.0017 0.0007 0.0130 943 LEU 19 CB -0.0040 0.0046 -0.0005 944 LEU 19 CG -0.0039 0.0101 -0.0068 945 LEU 19 CD1 -0.0070 0.0070 -0.0143 946 LEU 19 CD2 -0.0029 0.0125 -0.0063 947 LYS 20 N -0.0032 -0.0047 0.0157 948 LYS 20 CA -0.0035 -0.0056 0.0167 949 LYS 20 C -0.0049 -0.0072 0.0176 950 LYS 20 O -0.0053 -0.0075 0.0176 951 LYS 20 CB -0.0018 -0.0053 0.0182 952 LYS 20 CG -0.0004 -0.0038 0.0174 953 LYS 20 CD 0.0013 -0.0037 0.0190 954 LYS 20 CE 0.0027 -0.0022 0.0183 955 LYS 20 NZ 0.0021 -0.0021 0.0176 956 GLU 21 N -0.0025 -0.0153 0.0201 957 GLU 21 CA -0.0008 -0.0167 0.0181 958 GLU 21 C -0.0008 -0.0167 0.0180 959 GLU 21 O -0.0008 -0.0164 0.0202 960 GLU 21 CB 0.0015 -0.0181 0.0192 961 GLU 21 CG 0.0018 -0.0183 0.0191 962 GLU 21 CD 0.0028 -0.0194 0.0166 963 GLU 21 OE1 0.0027 -0.0196 0.0146 964 GLU 21 OE2 0.0039 -0.0201 0.0168 965 ALA 22 N 0.0032 -0.0147 0.0122 966 ALA 22 CA 0.0029 -0.0146 0.0115 967 ALA 22 C 0.0044 -0.0154 0.0093 968 ALA 22 O 0.0050 -0.0157 0.0075 969 ALA 22 CB 0.0004 -0.0132 0.0109 970 LEU 23 N 0.0058 -0.0136 0.0057 971 LEU 23 CA 0.0060 -0.0120 0.0055 972 LEU 23 C 0.0059 -0.0134 0.0053 973 LEU 23 O 0.0057 -0.0150 0.0038 974 LEU 23 CB 0.0062 -0.0105 0.0032 975 LEU 23 CG 0.0065 -0.0085 0.0024 976 LEU 23 CD1 0.0066 -0.0064 0.0041 977 LEU 23 CD2 0.0066 -0.0078 -0.0002 978 LEU 24 N 0.0077 -0.0116 0.0072 979 LEU 24 CA 0.0075 -0.0128 0.0069 980 LEU 24 C 0.0081 -0.0122 0.0053 981 LEU 24 O 0.0083 -0.0108 0.0053 982 LEU 24 CB 0.0071 -0.0128 0.0084 983 LEU 24 CG 0.0066 -0.0133 0.0102 984 LEU 24 CD1 0.0062 -0.0131 0.0116 985 LEU 24 CD2 0.0063 -0.0151 0.0102 986 ASP 25 N 0.0075 -0.0113 0.0075 987 ASP 25 CA 0.0068 -0.0110 0.0075 988 ASP 25 C 0.0067 -0.0103 0.0075 989 ASP 25 O 0.0064 -0.0103 0.0075 990 ASP 25 CB 0.0063 -0.0116 0.0073 991 ASP 25 CG 0.0056 -0.0114 0.0073 992 ASP 25 OD1 0.0055 -0.0108 0.0074 993 ASP 25 OD2 0.0051 -0.0118 0.0072 994 THR 26 N 0.0094 -0.0101 0.0062 995 THR 26 CA 0.0091 -0.0093 0.0056 996 THR 26 C 0.0087 -0.0092 0.0070 997 THR 26 O 0.0081 -0.0083 0.0068 998 THR 26 CB 0.0098 -0.0099 0.0041 999 THR 26 OG1 0.0107 -0.0114 0.0046 1000 THR 26 CG2 0.0102 -0.0099 0.0027 1001 GLY 27 N 0.0101 -0.0100 0.0069 1002 GLY 27 CA 0.0093 -0.0100 0.0083 1003 GLY 27 C 0.0050 -0.0089 0.0115 1004 GLY 27 O 0.0040 -0.0087 0.0128 1005 ALA 28 N 0.0012 -0.0075 0.0137 1006 ALA 28 CA -0.0001 -0.0080 0.0142 1007 ALA 28 C -0.0001 -0.0062 0.0138 1008 ALA 28 O 0.0015 -0.0057 0.0132 1009 ALA 28 CB 0.0008 -0.0101 0.0144 1010 ASP 29 N -0.0033 -0.0046 0.0201 1011 ASP 29 CA -0.0026 -0.0010 0.0201 1012 ASP 29 C -0.0009 -0.0010 0.0185 1013 ASP 29 O 0.0010 0.0013 0.0171 1014 ASP 29 CB -0.0051 0.0008 0.0227 1015 ASP 29 CG -0.0067 0.0014 0.0243 1016 ASP 29 OD1 -0.0058 0.0011 0.0233 1017 ASP 29 OD2 -0.0090 0.0022 0.0266 1018 ASP 30 N -0.0004 -0.0045 0.0159 1019 ASP 30 N -0.0003 -0.0045 0.0159 1020 ASP 30 CA 0.0012 -0.0055 0.0145 1021 ASP 30 CA 0.0015 -0.0053 0.0147 1022 ASP 30 C 0.0011 -0.0065 0.0130 1023 ASP 30 C 0.0011 -0.0065 0.0129 1024 ASP 30 O -0.0006 -0.0067 0.0127 1025 ASP 30 O -0.0007 -0.0069 0.0123 1026 ASP 30 CB 0.0009 -0.0061 0.0136 1027 ASP 30 CB 0.0021 -0.0056 0.0143 1028 ASP 30 CG 0.0004 -0.0051 0.0150 1029 ASP 30 CG 0.0028 -0.0045 0.0160 1030 ASP 30 OD1 0.0012 -0.0041 0.0165 1031 ASP 30 OD1 0.0043 -0.0038 0.0170 1032 ASP 30 OD2 -0.0009 -0.0055 0.0145 1033 ASP 30 OD2 0.0018 -0.0042 0.0163 1034 THR 31 N 0.0017 -0.0049 0.0111 1035 THR 31 CA 0.0017 -0.0061 0.0093 1036 THR 31 C 0.0011 -0.0072 0.0081 1037 THR 31 O 0.0018 -0.0069 0.0082 1038 THR 31 CB 0.0039 -0.0060 0.0086 1039 THR 31 OG1 0.0043 -0.0051 0.0096 1040 THR 31 CG2 0.0043 -0.0073 0.0065 1041 VAL 32 N 0.0020 -0.0157 0.0072 1042 VAL 32 CA 0.0012 -0.0168 0.0057 1043 VAL 32 C 0.0013 -0.0177 0.0046 1044 VAL 32 O 0.0005 -0.0174 0.0048 1045 VAL 32 CB -0.0010 -0.0163 0.0055 1046 VAL 32 CG1 -0.0015 -0.0174 0.0042 1047 VAL 32 CG2 -0.0015 -0.0150 0.0068 1048 LEU 33 N 0.0038 -0.0105 0.0076 1049 LEU 33 CA 0.0037 -0.0110 0.0065 1050 LEU 33 C 0.0031 -0.0114 0.0057 1051 LEU 33 O 0.0034 -0.0113 0.0057 1052 LEU 33 CB 0.0049 -0.0110 0.0061 1053 LEU 33 CG 0.0055 -0.0107 0.0069 1054 LEU 33 CD1 0.0067 -0.0108 0.0063 1055 LEU 33 CD2 0.0047 -0.0106 0.0072 1056 GLU 34 N 0.0022 -0.0167 0.0057 1057 GLU 34 CA 0.0015 -0.0177 0.0058 1058 GLU 34 C 0.0019 -0.0175 0.0056 1059 GLU 34 O 0.0028 -0.0167 0.0051 1060 GLU 34 CB 0.0016 -0.0191 0.0053 1061 GLU 34 CG 0.0012 -0.0194 0.0055 1062 GLU 34 CD 0.0012 -0.0208 0.0049 1063 GLU 34 OE1 0.0008 -0.0218 0.0050 1064 GLU 34 OE2 0.0018 -0.0210 0.0044 1065 GLU 35 N 0.0023 -0.0143 0.0037 1066 GLU 35 CA 0.0024 -0.0128 0.0038 1067 GLU 35 C 0.0028 -0.0121 0.0018 1068 GLU 35 O 0.0029 -0.0133 0.0006 1069 GLU 35 CB 0.0022 -0.0135 0.0050 1070 GLU 35 CG 0.0022 -0.0118 0.0058 1071 GLU 35 CD 0.0021 -0.0103 0.0069 1072 GLU 35 OE1 0.0019 -0.0108 0.0082 1073 GLU 35 OE2 0.0023 -0.0085 0.0065 1074 MET 36 N 0.0012 0.0011 -0.0009 1075 MET 36 CA 0.0041 0.0008 -0.0024 1076 MET 36 C 0.0057 0.0018 -0.0021 1077 MET 36 O 0.0049 0.0031 -0.0005 1078 MET 36 CB 0.0055 0.0019 -0.0019 1079 MET 36 CG 0.0059 0.0044 0.0004 1080 MET 36 SD 0.0081 0.0056 0.0007 1081 MET 36 CE 0.0112 0.0048 -0.0015 1082 ASN 37 N 0.0027 0.0058 -0.0068 1083 ASN 37 CA 0.0076 0.0085 -0.0064 1084 ASN 37 C 0.0089 0.0089 -0.0041 1085 ASN 37 O 0.0080 0.0088 -0.0066 1086 ASN 37 CB 0.0094 0.0104 -0.0116 1087 ASN 37 CG 0.0105 0.0112 -0.0132 1088 ASN 37 OD1 0.0092 0.0101 -0.0107 1089 ASN 37 ND2 0.0128 0.0131 -0.0173 1090 LEU 38 N 0.0066 0.0115 -0.0055 1091 LEU 38 CA 0.0069 0.0118 -0.0053 1092 LEU 38 C 0.0073 0.0120 -0.0054 1093 LEU 38 O 0.0071 0.0120 -0.0053 1094 LEU 38 CB 0.0068 0.0120 -0.0049 1095 LEU 38 CG 0.0066 0.0120 -0.0049 1096 LEU 38 CD1 0.0064 0.0122 -0.0044 1097 LEU 38 CD2 0.0069 0.0120 -0.0051 1098 PRO 39 N 0.0116 0.0137 -0.0081 1099 PRO 39 CA 0.0104 0.0115 -0.0084 1100 PRO 39 C 0.0077 0.0172 -0.0082 1101 PRO 39 O 0.0091 0.0230 -0.0076 1102 PRO 39 CB 0.0173 0.0092 -0.0079 1103 PRO 39 CG 0.0222 0.0125 -0.0072 1104 PRO 39 CD 0.0187 0.0150 -0.0073 1105 GLY 40 N -0.0187 0.0320 -0.0009 1106 GLY 40 CA -0.0192 0.0309 -0.0022 1107 GLY 40 C -0.0185 0.0310 -0.0039 1108 GLY 40 O -0.0178 0.0319 -0.0040 1109 ARG 41 N 0.0039 0.0106 -0.0108 1110 ARG 41 CA -0.0096 0.0162 -0.0135 1111 ARG 41 C -0.0197 0.0285 -0.0108 1112 ARG 41 O -0.0142 0.0380 -0.0030 1113 ARG 41 CB -0.0055 0.0214 -0.0087 1114 ARG 41 CG 0.0026 0.0100 -0.0117 1115 ARG 41 CD -0.0084 0.0030 -0.0205 1116 ARG 41 NE -0.0010 -0.0102 -0.0248 1117 ARG 41 CZ 0.0041 -0.0225 -0.0296 1118 ARG 41 NH1 0.0029 -0.0235 -0.0307 1119 ARG 41 NH2 0.0106 -0.0338 -0.0333 1120 TRP 42 N -0.0206 0.0258 -0.0104 1121 TRP 42 CA -0.0162 0.0215 -0.0113 1122 TRP 42 C -0.0160 0.0218 -0.0084 1123 TRP 42 O -0.0190 0.0251 -0.0048 1124 TRP 42 CB -0.0119 0.0179 -0.0085 1125 TRP 42 CG -0.0122 0.0191 -0.0016 1126 TRP 42 CD1 -0.0145 0.0216 0.0006 1127 TRP 42 CD2 -0.0101 0.0179 0.0040 1128 TRP 42 NE1 -0.0140 0.0220 0.0072 1129 TRP 42 CE2 -0.0113 0.0198 0.0094 1130 TRP 42 CE3 -0.0074 0.0155 0.0049 1131 TRP 42 CZ2 -0.0098 0.0193 0.0158 1132 TRP 42 CZ3 -0.0059 0.0150 0.0113 1133 TRP 42 CH2 -0.0071 0.0169 0.0166 1134 LYS 43 N -0.0166 0.0208 -0.0141 1135 LYS 43 CA -0.0154 0.0202 -0.0080 1136 LYS 43 C -0.0028 0.0093 -0.0023 1137 LYS 43 O 0.0052 0.0014 -0.0097 1138 LYS 43 CB -0.0190 0.0223 -0.0208 1139 LYS 43 CG -0.0316 0.0333 -0.0273 1140 LYS 43 CD -0.0399 0.0416 -0.0166 1141 LYS 43 CE -0.0525 0.0525 -0.0229 1142 LYS 43 NZ -0.0566 0.0560 -0.0251 1143 PRO 44 N -0.0004 0.0076 -0.0092 1144 PRO 44 CA 0.0100 0.0017 -0.0057 1145 PRO 44 C 0.0142 -0.0057 -0.0141 1146 PRO 44 O 0.0105 -0.0056 -0.0193 1147 PRO 44 CB 0.0126 0.0049 0.0042 1148 PRO 44 CG 0.0035 0.0130 0.0070 1149 PRO 44 CD -0.0042 0.0136 -0.0029 1150 LYS 45 N 0.0204 -0.0174 -0.0162 1151 LYS 45 CA 0.0189 -0.0191 -0.0137 1152 LYS 45 C 0.0161 -0.0210 -0.0137 1153 LYS 45 O 0.0151 -0.0212 -0.0163 1154 LYS 45 CB 0.0183 -0.0193 -0.0144 1155 LYS 45 CG 0.0184 -0.0200 -0.0114 1156 LYS 45 CD 0.0165 -0.0212 -0.0121 1157 LYS 45 CE 0.0160 -0.0223 -0.0090 1158 LYS 45 NZ 0.0137 -0.0237 -0.0097 1159 MET 46 N 0.0205 -0.0339 -0.0178 1160 MET 46 CA 0.0124 -0.0316 -0.0189 1161 MET 46 C 0.0066 -0.0323 -0.0112 1162 MET 46 O 0.0093 -0.0348 -0.0042 1163 MET 46 CB 0.0132 -0.0311 -0.0216 1164 MET 46 CG 0.0167 -0.0296 -0.0305 1165 MET 46 SD 0.0150 -0.0281 -0.0348 1166 MET 46 CE 0.0255 -0.0305 -0.0352 1167 ILE 47 N -0.0031 -0.0234 -0.0124 1168 ILE 47 CA -0.0041 -0.0215 -0.0097 1169 ILE 47 C -0.0062 -0.0187 -0.0109 1170 ILE 47 O -0.0069 -0.0179 -0.0130 1171 ILE 47 CB -0.0038 -0.0216 -0.0068 1172 ILE 47 CG1 -0.0043 -0.0210 -0.0079 1173 ILE 47 CG2 -0.0018 -0.0243 -0.0051 1174 ILE 47 CD1 -0.0046 -0.0202 -0.0052 1175 GLY 48 N -0.0082 -0.0187 -0.0154 1176 GLY 48 CA -0.0093 -0.0164 -0.0163 1177 GLY 48 C -0.0071 -0.0138 -0.0146 1178 GLY 48 O -0.0052 -0.0124 -0.0131 1179 GLY 49 N -0.0047 -0.0136 -0.0162 1180 GLY 49 CA -0.0013 -0.0126 -0.0167 1181 GLY 49 C 0.0019 -0.0116 -0.0175 1182 GLY 49 O 0.0015 -0.0116 -0.0191 1183 ILE 50 N 0.0049 -0.0161 -0.0109 1184 ILE 50 CA 0.0062 -0.0134 -0.0122 1185 ILE 50 C 0.0073 -0.0116 -0.0133 1186 ILE 50 O 0.0064 -0.0108 -0.0120 1187 ILE 50 CB 0.0050 -0.0113 -0.0101 1188 ILE 50 CG1 0.0055 -0.0110 -0.0109 1189 ILE 50 CG2 0.0049 -0.0080 -0.0095 1190 ILE 50 CD1 0.0041 -0.0097 -0.0086 1191 GLY 51 N 0.0091 -0.0108 -0.0167 1192 GLY 51 CA 0.0105 -0.0084 -0.0180 1193 GLY 51 C 0.0101 -0.0135 -0.0208 1194 GLY 51 O 0.0117 -0.0119 -0.0230 1195 GLY 52 N -0.0003 -0.0142 -0.0245 1196 GLY 52 CA -0.0076 -0.0170 -0.0257 1197 GLY 52 C -0.0110 -0.0199 -0.0231 1198 GLY 52 O -0.0085 -0.0190 -0.0227 1199 PHE 53 N -0.0258 -0.0162 -0.0260 1200 PHE 53 CA -0.0210 -0.0227 -0.0234 1201 PHE 53 CA -0.0209 -0.0226 -0.0233 1202 PHE 53 C -0.0183 -0.0304 -0.0236 1203 PHE 53 O -0.0215 -0.0326 -0.0279 1204 PHE 53 CB -0.0236 -0.0256 -0.0274 1205 PHE 53 CB -0.0232 -0.0250 -0.0267 1206 PHE 53 CG -0.0276 -0.0315 -0.0339 1207 PHE 53 CG -0.0238 -0.0183 -0.0247 1208 PHE 53 CD1 -0.0340 -0.0285 -0.0394 1209 PHE 53 CD1 -0.0195 -0.0195 -0.0206 1210 PHE 53 CD2 -0.0249 -0.0402 -0.0345 1211 PHE 53 CD2 -0.0287 -0.0110 -0.0270 1212 PHE 53 CE1 -0.0377 -0.0339 -0.0455 1213 PHE 53 CE1 -0.0199 -0.0135 -0.0187 1214 PHE 53 CE2 -0.0285 -0.0457 -0.0405 1215 PHE 53 CE2 -0.0292 -0.0049 -0.0251 1216 PHE 53 CZ -0.0349 -0.0426 -0.0461 1217 PHE 53 CZ -0.0248 -0.0061 -0.0210 1218 ILE 54 N -0.0115 -0.0219 -0.0219 1219 ILE 54 CA -0.0104 -0.0267 -0.0216 1220 ILE 54 C -0.0093 -0.0316 -0.0214 1221 ILE 54 O -0.0083 -0.0313 -0.0196 1222 ILE 54 CB -0.0082 -0.0262 -0.0175 1223 ILE 54 CG1 -0.0057 -0.0252 -0.0126 1224 ILE 54 CG2 -0.0095 -0.0218 -0.0183 1225 ILE 54 CD1 -0.0030 -0.0264 -0.0083 1226 LYS 55 N -0.0302 -0.0081 -0.0199 1227 LYS 55 CA 0.0039 -0.0286 -0.0203 1228 LYS 55 C 0.0075 -0.0319 -0.0099 1229 LYS 55 O -0.0090 -0.0206 -0.0233 1230 LYS 55 CB 0.0189 -0.0339 -0.0579 1231 LYS 55 CG 0.0233 -0.0354 -0.0693 1232 LYS 55 CD 0.0397 -0.0415 -0.1066 1233 LYS 55 CE 0.0160 -0.0242 -0.1354 1234 LYS 55 NZ 0.0283 -0.0280 -0.1709 1235 VAL 56 N 0.0065 -0.0194 -0.0090 1236 VAL 56 CA 0.0061 -0.0191 -0.0099 1237 VAL 56 C 0.0082 -0.0184 -0.0101 1238 VAL 56 O 0.0097 -0.0182 -0.0092 1239 VAL 56 CB 0.0048 -0.0200 -0.0087 1240 VAL 56 CG1 0.0026 -0.0207 -0.0087 1241 VAL 56 CG2 0.0058 -0.0206 -0.0066 1242 ARG 57 N 0.0052 -0.0037 -0.0037 1243 ARG 57 CA 0.0015 -0.0018 -0.0042 1244 ARG 57 C -0.0003 -0.0029 -0.0082 1245 ARG 57 O 0.0003 -0.0039 -0.0096 1246 ARG 57 CB -0.0003 0.0005 -0.0016 1247 ARG 57 CG 0.0012 0.0017 0.0024 1248 ARG 57 CD -0.0001 0.0038 0.0050 1249 ARG 57 NE 0.0002 0.0031 0.0041 1250 ARG 57 CZ -0.0013 0.0047 0.0055 1251 ARG 57 NH1 -0.0034 0.0071 0.0078 1252 ARG 57 NH2 -0.0008 0.0039 0.0045 1253 GLN 58 N -0.0003 0.0050 -0.0071 1254 GLN 58 CA -0.0009 0.0054 -0.0114 1255 GLN 58 C -0.0023 0.0097 -0.0142 1256 GLN 58 O -0.0031 0.0138 -0.0123 1257 GLN 58 CB -0.0008 0.0058 -0.0099 1258 GLN 58 CG -0.0013 0.0060 -0.0142 1259 GLN 58 CD -0.0014 0.0069 -0.0128 1260 GLN 58 OE1 -0.0005 0.0045 -0.0097 1261 GLN 58 NE2 -0.0025 0.0102 -0.0152 1262 TYR 59 N -0.0001 0.0166 -0.0063 1263 TYR 59 CA 0.0005 0.0181 -0.0080 1264 TYR 59 C 0.0011 0.0194 -0.0097 1265 TYR 59 O 0.0018 0.0182 -0.0108 1266 TYR 59 CB 0.0014 0.0164 -0.0092 1267 TYR 59 CG 0.0009 0.0152 -0.0078 1268 TYR 59 CD1 0.0007 0.0164 -0.0078 1269 TYR 59 CD2 0.0007 0.0130 -0.0066 1270 TYR 59 CE1 0.0002 0.0153 -0.0065 1271 TYR 59 CE2 0.0002 0.0119 -0.0053 1272 TYR 59 CZ 0.0000 0.0130 -0.0052 1273 TYR 59 OH -0.0004 0.0119 -0.0040 1274 ASP 60 N -0.0004 0.0235 -0.0020 1275 ASP 60 CA 0.0008 0.0272 -0.0054 1276 ASP 60 C 0.0037 0.0265 -0.0050 1277 ASP 60 O 0.0031 0.0235 -0.0022 1278 ASP 60 CB -0.0042 0.0298 -0.0075 1279 ASP 60 CG -0.0069 0.0308 -0.0083 1280 ASP 60 OD1 -0.0040 0.0316 -0.0092 1281 ASP 60 OD2 -0.0118 0.0308 -0.0080 1282 GLN 61 N 0.0134 0.0271 0.0033 1283 GLN 61 CA 0.0144 0.0295 -0.0032 1284 GLN 61 C 0.0196 0.0230 0.0030 1285 GLN 61 O 0.0155 0.0248 0.0051 1286 GLN 61 CB 0.0033 0.0382 -0.0052 1287 GLN 61 CG -0.0023 0.0443 -0.0098 1288 GLN 61 CD -0.0145 0.0513 -0.0065 1289 GLN 61 OE1 -0.0203 0.0516 0.0015 1290 GLN 61 NE2 -0.0186 0.0570 -0.0126 1291 ILE 62 N 0.0112 0.0220 0.0053 1292 ILE 62 CA 0.0109 0.0214 0.0041 1293 ILE 62 C 0.0114 0.0224 0.0061 1294 ILE 62 O 0.0103 0.0241 0.0077 1295 ILE 62 CB 0.0082 0.0217 0.0022 1296 ILE 62 CG1 0.0078 0.0205 -0.0001 1297 ILE 62 CG2 0.0077 0.0214 0.0013 1298 ILE 62 CD1 0.0096 0.0183 -0.0018 1299 LEU 63 N 0.0096 0.0287 0.0168 1300 LEU 63 CA 0.0079 0.0278 0.0158 1301 LEU 63 C 0.0083 0.0277 0.0159 1302 LEU 63 O 0.0087 0.0293 0.0166 1303 LEU 63 CB 0.0059 0.0293 0.0152 1304 LEU 63 CG 0.0040 0.0287 0.0141 1305 LEU 63 CD1 0.0034 0.0264 0.0132 1306 LEU 63 CD2 0.0022 0.0304 0.0137 1307 ILE 64 N 0.0068 0.0164 0.0146 1308 ILE 64 CA 0.0055 0.0157 0.0140 1309 ILE 64 C 0.0046 0.0151 0.0135 1310 ILE 64 O 0.0047 0.0148 0.0142 1311 ILE 64 CB 0.0051 0.0147 0.0151 1312 ILE 64 CG1 0.0061 0.0151 0.0159 1313 ILE 64 CG2 0.0039 0.0141 0.0144 1314 ILE 64 CD1 0.0054 0.0142 0.0165 1315 GLU 65 N 0.0047 0.0164 0.0187 1316 GLU 65 CA 0.0018 0.0142 0.0165 1317 GLU 65 C 0.0015 0.0110 0.0171 1318 GLU 65 O 0.0020 0.0117 0.0174 1319 GLU 65 CB -0.0004 0.0167 0.0136 1320 GLU 65 CG -0.0032 0.0150 0.0113 1321 GLU 65 CD -0.0053 0.0179 0.0085 1322 GLU 65 OE1 -0.0049 0.0204 0.0081 1323 GLU 65 OE2 -0.0072 0.0175 0.0067 1324 ILE 66 N -0.0020 0.0009 0.0174 1325 ILE 66 CA -0.0005 -0.0013 0.0176 1326 ILE 66 C -0.0017 -0.0027 0.0157 1327 ILE 66 O -0.0026 -0.0036 0.0142 1328 ILE 66 CB 0.0009 -0.0029 0.0182 1329 ILE 66 CG1 0.0020 -0.0014 0.0202 1330 ILE 66 CG2 0.0023 -0.0053 0.0183 1331 ILE 66 CD1 0.0027 -0.0023 0.0204 1332 CYS 67 N -0.0018 -0.0078 0.0191 1333 CYS 67 CA -0.0010 -0.0090 0.0170 1334 CYS 67 C -0.0017 -0.0074 0.0149 1335 CYS 67 O -0.0013 -0.0079 0.0129 1336 CYS 67 CB -0.0001 -0.0107 0.0166 1337 CYS 67 SG 0.0011 -0.0127 0.0146 1338 GLY 68 N -0.0062 -0.0002 0.0118 1339 GLY 68 CA -0.0081 0.0032 0.0075 1340 GLY 68 C -0.0078 0.0048 0.0083 1341 GLY 68 O -0.0094 0.0072 0.0046 1342 HIS 69 N -0.0058 0.0042 0.0151 1343 HIS 69 CA -0.0046 0.0029 0.0160 1344 HIS 69 C -0.0022 0.0047 0.0166 1345 HIS 69 O -0.0005 0.0051 0.0173 1346 HIS 69 CB -0.0039 0.0001 0.0170 1347 HIS 69 CG -0.0061 -0.0020 0.0166 1348 HIS 69 ND1 -0.0079 -0.0019 0.0157 1349 HIS 69 CD2 -0.0069 -0.0042 0.0168 1350 HIS 69 CE1 -0.0096 -0.0040 0.0155 1351 HIS 69 NE2 -0.0090 -0.0054 0.0161 1352 LYS 70 N -0.0060 0.0117 0.0112 1353 LYS 70 CA -0.0051 0.0160 0.0149 1354 LYS 70 C -0.0029 0.0144 0.0173 1355 LYS 70 O -0.0037 0.0119 0.0148 1356 LYS 70 CB -0.0083 0.0210 0.0129 1357 LYS 70 CG -0.0102 0.0233 0.0112 1358 LYS 70 CD -0.0133 0.0284 0.0093 1359 LYS 70 CE -0.0160 0.0294 0.0057 1360 LYS 70 NZ -0.0147 0.0299 0.0080 1361 ALA 71 N -0.0048 0.0152 0.0120 1362 ALA 71 CA -0.0024 0.0140 0.0140 1363 ALA 71 C -0.0000 0.0168 0.0147 1364 ALA 71 O 0.0000 0.0192 0.0140 1365 ALA 71 CB -0.0016 0.0115 0.0153 1366 ILE 72 N 0.0007 0.0232 0.0087 1367 ILE 72 CA 0.0038 0.0250 0.0087 1368 ILE 72 C 0.0067 0.0231 0.0099 1369 ILE 72 O 0.0067 0.0201 0.0110 1370 ILE 72 CB 0.0042 0.0256 0.0085 1371 ILE 72 CG1 0.0019 0.0282 0.0071 1372 ILE 72 CG2 0.0079 0.0268 0.0089 1373 ILE 72 CD1 0.0020 0.0288 0.0069 1374 GLY 73 N 0.0084 0.0234 0.0039 1375 GLY 73 CA 0.0098 0.0228 0.0033 1376 GLY 73 C 0.0110 0.0241 0.0022 1377 GLY 73 O 0.0109 0.0253 0.0018 1378 THR 74 N 0.0117 0.0178 0.0011 1379 THR 74 CA 0.0099 0.0164 0.0018 1380 THR 74 C 0.0093 0.0140 0.0012 1381 THR 74 O 0.0091 0.0137 0.0012 1382 THR 74 CB 0.0081 0.0177 0.0035 1383 THR 74 OG1 0.0085 0.0197 0.0040 1384 THR 74 CG2 0.0060 0.0161 0.0043 1385 VAL 75 N 0.0083 0.0109 0.0007 1386 VAL 75 CA 0.0070 0.0099 -0.0002 1387 VAL 75 C 0.0051 0.0091 -0.0010 1388 VAL 75 O 0.0054 0.0082 -0.0017 1389 VAL 75 CB 0.0086 0.0084 -0.0010 1390 VAL 75 CG1 0.0072 0.0073 -0.0020 1391 VAL 75 CG2 0.0104 0.0093 -0.0001 1392 LEU 76 N 0.0025 -0.0094 -0.0017 1393 LEU 76 CA 0.0031 -0.0095 -0.0003 1394 LEU 76 C 0.0032 -0.0097 -0.0000 1395 LEU 76 O 0.0032 -0.0104 -0.0008 1396 LEU 76 CB 0.0037 -0.0107 0.0002 1397 LEU 76 CG 0.0038 -0.0105 0.0006 1398 LEU 76 CD1 0.0032 -0.0095 0.0001 1399 LEU 76 CD2 0.0042 -0.0119 0.0005 1400 VAL 77 N 0.0034 -0.0096 -0.0018 1401 VAL 77 CA 0.0038 -0.0106 -0.0010 1402 VAL 77 C 0.0036 -0.0112 0.0004 1403 VAL 77 O 0.0028 -0.0106 0.0012 1404 VAL 77 CB 0.0034 -0.0102 -0.0008 1405 VAL 77 CG1 0.0039 -0.0113 -0.0000 1406 VAL 77 CG2 0.0035 -0.0094 -0.0022 1407 GLY 78 N 0.0032 -0.0195 0.0005 1408 GLY 78 CA 0.0012 -0.0201 0.0003 1409 GLY 78 C 0.0010 -0.0205 0.0002 1410 GLY 78 O 0.0026 -0.0204 0.0003 1411 PRO 79 N 0.0000 -0.0216 -0.0014 1412 PRO 79 CA -0.0013 -0.0207 -0.0019 1413 PRO 79 C -0.0023 -0.0197 -0.0006 1414 PRO 79 O -0.0034 -0.0190 -0.0010 1415 PRO 79 CB -0.0018 -0.0207 -0.0035 1416 PRO 79 CG -0.0011 -0.0212 -0.0034 1417 PRO 79 CD 0.0003 -0.0220 -0.0023 1418 THR 80 N -0.0029 -0.0205 0.0039 1419 THR 80 CA -0.0026 -0.0192 0.0043 1420 THR 80 C -0.0022 -0.0191 0.0047 1421 THR 80 O -0.0018 -0.0200 0.0051 1422 THR 80 CB -0.0019 -0.0189 0.0050 1423 THR 80 OG1 -0.0016 -0.0178 0.0055 1424 THR 80 CG2 -0.0012 -0.0200 0.0057 1425 PRO 81 N -0.0015 -0.0185 0.0055 1426 PRO 81 CA 0.0001 -0.0186 0.0069 1427 PRO 81 C 0.0025 -0.0184 0.0088 1428 PRO 81 O 0.0039 -0.0189 0.0101 1429 PRO 81 CB -0.0001 -0.0161 0.0059 1430 PRO 81 CG -0.0009 -0.0142 0.0046 1431 PRO 81 CD -0.0024 -0.0159 0.0039 1432 VAL 82 N -0.0020 -0.0180 0.0044 1433 VAL 82 CA -0.0003 -0.0175 0.0052 1434 VAL 82 C 0.0004 -0.0176 0.0056 1435 VAL 82 O -0.0005 -0.0170 0.0053 1436 VAL 82 CB -0.0004 -0.0156 0.0055 1437 VAL 82 CG1 0.0012 -0.0148 0.0064 1438 VAL 82 CG2 -0.0009 -0.0157 0.0053 1439 ASN 83 N 0.0038 -0.0152 0.0085 1440 ASN 83 CA 0.0034 -0.0161 0.0087 1441 ASN 83 C 0.0034 -0.0163 0.0086 1442 ASN 83 O 0.0034 -0.0158 0.0090 1443 ASN 83 CB 0.0029 -0.0162 0.0097 1444 ASN 83 CG 0.0028 -0.0161 0.0100 1445 ASN 83 OD1 0.0029 -0.0164 0.0094 1446 ASN 83 ND2 0.0026 -0.0157 0.0108 1447 ILE 84 N 0.0026 -0.0158 0.0083 1448 ILE 84 N 0.0027 -0.0158 0.0083 1449 ILE 84 CA 0.0028 -0.0148 0.0085 1450 ILE 84 CA 0.0027 -0.0148 0.0085 1451 ILE 84 C 0.0034 -0.0138 0.0085 1452 ILE 84 C 0.0035 -0.0138 0.0084 1453 ILE 84 O 0.0031 -0.0134 0.0087 1454 ILE 84 O 0.0034 -0.0135 0.0085 1455 ILE 84 CB 0.0017 -0.0146 0.0091 1456 ILE 84 CB 0.0016 -0.0144 0.0092 1457 ILE 84 CG1 0.0009 -0.0142 0.0096 1458 ILE 84 CG1 0.0009 -0.0153 0.0094 1459 ILE 84 CG2 0.0012 -0.0156 0.0091 1460 ILE 84 CG2 0.0016 -0.0132 0.0095 1461 ILE 84 CD1 -0.0001 -0.0139 0.0102 1462 ILE 84 CD1 -0.0003 -0.0152 0.0100 1463 ILE 85 N 0.0052 -0.0108 0.0125 1464 ILE 85 CA 0.0049 -0.0104 0.0120 1465 ILE 85 C 0.0048 -0.0097 0.0112 1466 ILE 85 O 0.0055 -0.0094 0.0109 1467 ILE 85 CB 0.0057 -0.0103 0.0120 1468 ILE 85 CG1 0.0059 -0.0110 0.0127 1469 ILE 85 CG2 0.0053 -0.0099 0.0114 1470 ILE 85 CD1 0.0050 -0.0114 0.0132 1471 GLY 86 N 0.0031 -0.0078 0.0121 1472 GLY 86 CA 0.0026 -0.0069 0.0123 1473 GLY 86 C 0.0030 -0.0054 0.0115 1474 GLY 86 O 0.0036 -0.0051 0.0108 1475 ARG 87 N 0.0017 -0.0038 0.0144 1476 ARG 87 CA 0.0018 -0.0010 0.0110 1477 ARG 87 C -0.0004 0.0017 0.0105 1478 ARG 87 O 0.0004 0.0034 0.0076 1479 ARG 87 CB 0.0012 0.0003 0.0102 1480 ARG 87 CG 0.0038 -0.0021 0.0099 1481 ARG 87 CD 0.0032 -0.0006 0.0088 1482 ARG 87 NE 0.0000 0.0004 0.0114 1483 ARG 87 CZ -0.0027 0.0034 0.0111 1484 ARG 87 NH1 -0.0028 0.0059 0.0084 1485 ARG 87 NH2 -0.0053 0.0039 0.0137 1486 ASN 88 N -0.0015 -0.0016 0.0134 1487 ASN 88 CA -0.0009 -0.0001 0.0131 1488 ASN 88 C -0.0022 0.0008 0.0114 1489 ASN 88 O -0.0022 0.0014 0.0110 1490 ASN 88 CB 0.0007 0.0015 0.0136 1491 ASN 88 CG 0.0004 0.0029 0.0125 1492 ASN 88 OD1 -0.0003 0.0023 0.0122 1493 ASN 88 ND2 0.0010 0.0048 0.0118 1494 LEU 89 N 0.0029 0.0001 0.0141 1495 LEU 89 CA 0.0018 0.0008 0.0115 1496 LEU 89 C 0.0003 -0.0013 0.0102 1497 LEU 89 O -0.0005 -0.0008 0.0083 1498 LEU 89 CB 0.0017 0.0019 0.0104 1499 LEU 89 CG 0.0031 0.0043 0.0112 1500 LEU 89 CD1 0.0028 0.0053 0.0100 1501 LEU 89 CD2 0.0037 0.0064 0.0107 1502 LEU 90 N 0.0016 -0.0050 0.0083 1503 LEU 90 CA 0.0032 -0.0055 0.0066 1504 LEU 90 C 0.0026 -0.0043 0.0044 1505 LEU 90 O 0.0034 -0.0044 0.0030 1506 LEU 90 CB 0.0047 -0.0064 0.0067 1507 LEU 90 CG 0.0057 -0.0077 0.0087 1508 LEU 90 CD1 0.0069 -0.0084 0.0086 1509 LEU 90 CD2 0.0069 -0.0085 0.0089 1510 THR 91 N -0.0002 -0.0014 0.0036 1511 THR 91 CA -0.0010 0.0030 -0.0008 1512 THR 91 C -0.0008 0.0032 -0.0011 1513 THR 91 O 0.0016 0.0055 -0.0047 1514 THR 91 CB -0.0066 0.0062 -0.0018 1515 THR 91 OG1 -0.0114 0.0048 0.0018 1516 THR 91 CG2 -0.0064 0.0067 -0.0025 1517 GLN 92 N -0.0022 0.0013 0.0054 1518 GLN 92 CA -0.0039 0.0012 0.0062 1519 GLN 92 C -0.0019 0.0009 0.0070 1520 GLN 92 O -0.0029 0.0010 0.0068 1521 GLN 92 CB -0.0062 0.0006 0.0090 1522 GLN 92 CG -0.0080 0.0007 0.0090 1523 GLN 92 CD -0.0104 0.0014 0.0065 1524 GLN 92 OE1 -0.0097 0.0020 0.0040 1525 GLN 92 NE2 -0.0132 0.0014 0.0071 1526 ILE 93 N -0.0017 -0.0045 0.0117 1527 ILE 93 CA -0.0021 -0.0051 0.0102 1528 ILE 93 C -0.0015 -0.0076 0.0078 1529 ILE 93 O -0.0015 -0.0086 0.0064 1530 ILE 93 CB -0.0010 -0.0050 0.0122 1531 ILE 93 CG1 0.0017 -0.0071 0.0133 1532 ILE 93 CG2 -0.0018 -0.0023 0.0145 1533 ILE 93 CD1 0.0030 -0.0072 0.0152 1534 GLY 94 N -0.0015 -0.0032 -0.0017 1535 GLY 94 CA -0.0019 -0.0055 -0.0026 1536 GLY 94 C -0.0015 -0.0080 -0.0023 1537 GLY 94 O -0.0022 -0.0098 -0.0038 1538 CYS 95 N -0.0009 -0.0109 -0.0017 1539 CYS 95 CA 0.0030 -0.0101 -0.0013 1540 CYS 95 C 0.0037 -0.0075 -0.0055 1541 CYS 95 O 0.0003 -0.0072 -0.0078 1542 CYS 95 CB 0.0023 -0.0121 0.0020 1543 CYS 95 SG 0.0073 -0.0113 0.0030 1544 THR 96 N -0.0011 -0.0082 -0.0078 1545 THR 96 CA 0.0008 -0.0080 -0.0110 1546 THR 96 C 0.0049 -0.0084 -0.0102 1547 THR 96 O 0.0068 -0.0088 -0.0079 1548 THR 96 CB 0.0007 -0.0076 -0.0147 1549 THR 96 OG1 0.0032 -0.0078 -0.0142 1550 THR 96 CG2 -0.0033 -0.0072 -0.0156 1551 LEU 97 N 0.0037 -0.0055 -0.0159 1552 LEU 97 CA 0.0075 -0.0069 -0.0158 1553 LEU 97 C 0.0087 -0.0078 -0.0198 1554 LEU 97 O 0.0072 -0.0075 -0.0225 1555 LEU 97 CB 0.0089 -0.0073 -0.0146 1556 LEU 97 CG 0.0090 -0.0069 -0.0105 1557 LEU 97 CD1 0.0098 -0.0072 -0.0104 1558 LEU 97 CD2 0.0119 -0.0078 -0.0084 1559 ASN 98 N 0.0071 -0.0021 -0.0177 1560 ASN 98 CA 0.0087 -0.0015 -0.0198 1561 ASN 98 C 0.0121 -0.0006 -0.0198 1562 ASN 98 O 0.0135 -0.0004 -0.0174 1563 ASN 98 CB 0.0079 -0.0018 -0.0191 1564 ASN 98 CG 0.0091 -0.0013 -0.0216 1565 ASN 98 OD1 0.0116 -0.0005 -0.0228 1566 ASN 98 ND2 0.0072 -0.0018 -0.0223 1567 PHE 99 N 0.0052 -0.0031 -0.0238 1568 PHE 99 CA 0.0057 -0.0039 -0.0238 1569 PHE 99 C 0.0057 -0.0044 -0.0243 1570 PHE 99 O 0.0060 -0.0050 -0.0245 1571 PHE 99 CB 0.0061 -0.0040 -0.0230 1572 PHE 99 CG 0.0063 -0.0040 -0.0227 1573 PHE 99 CD1 0.0060 -0.0034 -0.0223 1574 PHE 99 CD2 0.0066 -0.0046 -0.0227 1575 PHE 99 CE1 0.0062 -0.0034 -0.0220 1576 PHE 99 CE2 0.0067 -0.0046 -0.0224 1577 PHE 99 CZ 0.0065 -0.0040 -0.0221 1578 PHE 99 OXT 0.0054 -0.0041 -0.0246