1 MET 1 N 0.0181 -0.0033 0.0018 2 MET 1 CA 0.0196 -0.0010 -0.0010 3 MET 1 C 0.0206 -0.0020 -0.0002 4 MET 1 O 0.0187 -0.0036 0.0019 5 MET 1 CB 0.0168 0.0017 -0.0032 6 MET 1 CG 0.0136 0.0020 -0.0027 7 MET 1 SD 0.0101 0.0052 -0.0053 8 MET 1 CE 0.0065 0.0050 -0.0042 9 GLN 2 N 0.0244 -0.0003 -0.0032 10 GLN 2 CA 0.0243 -0.0010 -0.0018 11 GLN 2 C 0.0214 -0.0002 -0.0036 12 GLN 2 O 0.0208 0.0012 -0.0066 13 GLN 2 CB 0.0280 -0.0007 -0.0020 14 GLN 2 CG 0.0285 -0.0010 -0.0015 15 GLN 2 CD 0.0325 -0.0007 -0.0016 16 GLN 2 OE1 0.0341 -0.0019 0.0008 17 GLN 2 NE2 0.0338 0.0008 -0.0046 18 ILE 3 N 0.0193 -0.0010 -0.0007 19 ILE 3 CA 0.0175 -0.0007 -0.0016 20 ILE 3 C 0.0181 -0.0013 -0.0003 21 ILE 3 O 0.0193 -0.0021 0.0014 22 ILE 3 CB 0.0148 -0.0010 -0.0016 23 ILE 3 CG1 0.0140 -0.0023 0.0007 24 ILE 3 CG2 0.0143 -0.0002 -0.0032 25 ILE 3 CD1 0.0111 -0.0027 0.0008 26 PHE 4 N 0.0150 -0.0038 -0.0030 27 PHE 4 CA 0.0139 -0.0041 -0.0008 28 PHE 4 C 0.0107 -0.0051 0.0000 29 PHE 4 O 0.0091 -0.0057 -0.0022 30 PHE 4 CB 0.0144 -0.0040 -0.0024 31 PHE 4 CG 0.0176 -0.0030 -0.0032 32 PHE 4 CD1 0.0187 -0.0027 -0.0063 33 PHE 4 CD2 0.0195 -0.0023 -0.0008 34 PHE 4 CE1 0.0218 -0.0018 -0.0070 35 PHE 4 CE2 0.0226 -0.0013 -0.0015 36 PHE 4 CZ 0.0236 -0.0011 -0.0046 37 VAL 5 N 0.0084 -0.0021 0.0037 38 VAL 5 CA 0.0069 -0.0017 0.0040 39 VAL 5 C 0.0020 -0.0017 0.0047 40 VAL 5 O 0.0007 0.0011 0.0058 41 VAL 5 CB 0.0085 0.0023 0.0051 42 VAL 5 CG1 0.0068 0.0024 0.0054 43 VAL 5 CG2 0.0134 0.0024 0.0045 44 LYS 6 N -0.0017 -0.0048 0.0024 45 LYS 6 CA -0.0193 -0.0052 0.0011 46 LYS 6 C -0.0266 0.0042 0.0044 47 LYS 6 O -0.0231 0.0020 0.0038 48 LYS 6 CB -0.0240 -0.0211 -0.0056 49 LYS 6 CG -0.0413 -0.0246 -0.0080 50 LYS 6 CD -0.0431 -0.0413 -0.0148 51 LYS 6 CE -0.0591 -0.0465 -0.0179 52 LYS 6 NZ -0.0598 -0.0627 -0.0244 53 THR 7 N -0.0254 0.0037 0.0088 54 THR 7 CA -0.0342 0.0160 0.0125 55 THR 7 C -0.0557 0.0078 0.0096 56 THR 7 O -0.0639 -0.0046 0.0056 57 THR 7 CB -0.0361 0.0386 0.0194 58 THR 7 OG1 -0.0545 0.0384 0.0190 59 THR 7 CG2 -0.0172 0.0461 0.0220 60 LEU 8 N -0.0630 0.0170 0.0080 61 LEU 8 CA -0.0922 0.0001 0.0121 62 LEU 8 C -0.1411 0.0152 0.0074 63 LEU 8 O -0.1707 -0.0006 0.0113 64 LEU 8 CB -0.0698 0.0110 0.0095 65 LEU 8 CG -0.0258 -0.0130 0.0165 66 LEU 8 CD1 -0.0135 -0.0082 0.0154 67 LEU 8 CD2 -0.0289 -0.0618 0.0294 68 THR 9 N -0.1770 0.0636 0.0049 69 THR 9 CA -0.2307 0.0788 -0.0005 70 THR 9 C -0.2399 0.0438 -0.0070 71 THR 9 O -0.2734 0.0583 -0.0096 72 THR 9 CB -0.2292 0.1424 0.0091 73 THR 9 OG1 -0.1869 0.1435 0.0153 74 THR 9 CG2 -0.2119 0.1776 0.0168 75 GLY 10 N -0.1711 0.0155 -0.0136 76 GLY 10 CA -0.1540 -0.0092 -0.0300 77 GLY 10 C -0.1150 0.0031 -0.0154 78 GLY 10 O -0.1053 -0.0114 -0.0251 79 LYS 11 N -0.0735 0.0158 -0.0004 80 LYS 11 CA -0.0507 0.0124 0.0136 81 LYS 11 C -0.0387 0.0063 0.0105 82 LYS 11 O -0.0505 0.0114 0.0115 83 LYS 11 CB -0.0516 0.0232 0.0394 84 LYS 11 CG -0.0269 0.0189 0.0532 85 LYS 11 CD -0.0290 0.0302 0.0789 86 LYS 11 CE -0.0095 0.0278 0.0923 87 LYS 11 NZ 0.0139 0.0171 0.0890 88 THR 12 N -0.0186 0.0038 0.0103 89 THR 12 CA -0.0102 0.0002 0.0077 90 THR 12 C 0.0000 0.0041 0.0150 91 THR 12 O 0.0039 0.0047 0.0167 92 THR 12 CB -0.0060 -0.0080 -0.0020 93 THR 12 OG1 -0.0161 -0.0111 -0.0084 94 THR 12 CG2 0.0034 -0.0111 -0.0038 95 ILE 13 N 0.0029 0.0037 0.0159 96 ILE 13 CA 0.0066 0.0079 0.0163 97 ILE 13 C 0.0106 0.0081 0.0118 98 ILE 13 O 0.0104 0.0047 0.0080 99 ILE 13 CB 0.0056 0.0087 0.0184 100 ILE 13 CG1 0.0090 0.0096 0.0154 101 ILE 13 CG2 0.0010 0.0051 0.0199 102 ILE 13 CD1 0.0076 0.0099 0.0175 103 THR 14 N 0.0160 0.0013 0.0101 104 THR 14 CA 0.0170 0.0015 0.0086 105 THR 14 C 0.0168 0.0013 0.0102 106 THR 14 O 0.0174 0.0009 0.0126 107 THR 14 CB 0.0199 0.0017 0.0078 108 THR 14 OG1 0.0211 0.0014 0.0104 109 THR 14 CG2 0.0203 0.0019 0.0066 110 LEU 15 N 0.0157 -0.0017 0.0041 111 LEU 15 CA 0.0161 -0.0015 0.0051 112 LEU 15 C 0.0181 -0.0012 0.0035 113 LEU 15 O 0.0183 -0.0015 0.0013 114 LEU 15 CB 0.0136 -0.0021 0.0047 115 LEU 15 CG 0.0118 -0.0022 0.0065 116 LEU 15 CD1 0.0116 -0.0019 0.0091 117 LEU 15 CD2 0.0093 -0.0029 0.0053 118 GLU 16 N 0.0181 -0.0079 0.0100 119 GLU 16 CA 0.0188 -0.0060 0.0071 120 GLU 16 C 0.0135 -0.0070 0.0068 121 GLU 16 O 0.0116 -0.0097 0.0105 122 GLU 16 CB 0.0233 -0.0062 0.0091 123 GLU 16 CG 0.0289 -0.0045 0.0084 124 GLU 16 CD 0.0336 -0.0040 0.0093 125 GLU 16 OE1 0.0372 -0.0017 0.0068 126 GLU 16 OE2 0.0335 -0.0062 0.0130 127 VAL 17 N 0.0118 -0.0076 0.0033 128 VAL 17 CA 0.0085 -0.0073 0.0037 129 VAL 17 C 0.0077 -0.0058 0.0024 130 VAL 17 O 0.0097 -0.0048 0.0010 131 VAL 17 CB 0.0068 -0.0062 0.0029 132 VAL 17 CG1 0.0071 -0.0076 0.0042 133 VAL 17 CG2 0.0076 -0.0038 0.0005 134 GLU 18 N 0.0009 -0.0072 0.0041 135 GLU 18 CA -0.0018 -0.0048 0.0030 136 GLU 18 C -0.0050 -0.0024 0.0021 137 GLU 18 O -0.0066 -0.0037 0.0031 138 GLU 18 CB -0.0044 -0.0070 0.0048 139 GLU 18 CG -0.0018 -0.0091 0.0057 140 GLU 18 CD 0.0009 -0.0069 0.0039 141 GLU 18 OE1 0.0007 -0.0035 0.0019 142 GLU 18 OE2 0.0038 -0.0089 0.0047 143 PRO 19 N -0.0065 0.0006 0.0019 144 PRO 19 CA -0.0091 0.0036 0.0013 145 PRO 19 C -0.0133 0.0020 0.0029 146 PRO 19 O -0.0154 0.0035 0.0028 147 PRO 19 CB -0.0099 0.0072 -0.0000 148 PRO 19 CG -0.0060 0.0069 -0.0008 149 PRO 19 CD -0.0053 0.0022 0.0010 150 SER 20 N -0.0168 -0.0002 0.0037 151 SER 20 CA -0.0210 -0.0021 0.0047 152 SER 20 C -0.0194 -0.0059 0.0045 153 SER 20 O -0.0225 -0.0078 0.0053 154 SER 20 CB -0.0245 -0.0047 0.0056 155 SER 20 OG -0.0221 -0.0072 0.0052 156 ASP 21 N -0.0136 -0.0060 0.0039 157 ASP 21 CA -0.0126 -0.0093 0.0044 158 ASP 21 C -0.0134 -0.0076 0.0042 159 ASP 21 O -0.0126 -0.0039 0.0032 160 ASP 21 CB -0.0079 -0.0107 0.0040 161 ASP 21 CG -0.0072 -0.0137 0.0045 162 ASP 21 OD1 -0.0103 -0.0156 0.0055 163 ASP 21 OD2 -0.0037 -0.0138 0.0040 164 THR 22 N -0.0142 -0.0086 0.0026 165 THR 22 CA -0.0134 -0.0076 0.0025 166 THR 22 C -0.0087 -0.0081 0.0018 167 THR 22 O -0.0066 -0.0101 0.0014 168 THR 22 CB -0.0159 -0.0107 0.0026 169 THR 22 OG1 -0.0143 -0.0148 0.0020 170 THR 22 CG2 -0.0206 -0.0104 0.0033 171 ILE 23 N -0.0064 -0.0070 0.0011 172 ILE 23 CA -0.0030 -0.0072 0.0006 173 ILE 23 C -0.0022 -0.0106 -0.0001 174 ILE 23 O 0.0003 -0.0118 -0.0007 175 ILE 23 CB -0.0022 -0.0051 0.0009 176 ILE 23 CG1 -0.0030 -0.0017 0.0017 177 ILE 23 CG2 0.0013 -0.0056 0.0004 178 ILE 23 CD1 -0.0013 -0.0006 0.0017 179 GLU 24 N -0.0044 -0.0104 -0.0007 180 GLU 24 CA -0.0038 -0.0153 -0.0009 181 GLU 24 C -0.0025 -0.0164 -0.0007 182 GLU 24 O 0.0003 -0.0194 -0.0004 183 GLU 24 CB -0.0080 -0.0176 -0.0018 184 GLU 24 CG -0.0082 -0.0225 -0.0021 185 GLU 24 CD -0.0128 -0.0240 -0.0030 186 GLU 24 OE1 -0.0157 -0.0242 -0.0035 187 GLU 24 OE2 -0.0134 -0.0250 -0.0031 188 ASN 25 N -0.0045 -0.0139 0.0011 189 ASN 25 CA -0.0037 -0.0159 0.0009 190 ASN 25 C -0.0005 -0.0154 -0.0002 191 ASN 25 O 0.0012 -0.0177 -0.0007 192 ASN 25 CB -0.0058 -0.0155 0.0016 193 ASN 25 CG -0.0047 -0.0176 0.0013 194 ASN 25 OD1 -0.0043 -0.0205 0.0012 195 ASN 25 ND2 -0.0043 -0.0163 0.0011 196 VAL 26 N 0.0016 -0.0125 0.0001 197 VAL 26 CA 0.0036 -0.0118 -0.0001 198 VAL 26 C 0.0057 -0.0130 -0.0011 199 VAL 26 O 0.0070 -0.0140 -0.0017 200 VAL 26 CB 0.0041 -0.0092 0.0008 201 VAL 26 CG1 0.0066 -0.0086 0.0005 202 VAL 26 CG2 0.0022 -0.0080 0.0017 203 LYS 27 N 0.0069 -0.0142 -0.0020 204 LYS 27 CA 0.0086 -0.0146 -0.0034 205 LYS 27 C 0.0083 -0.0167 -0.0045 206 LYS 27 O 0.0096 -0.0174 -0.0057 207 LYS 27 CB 0.0090 -0.0137 -0.0031 208 LYS 27 CG 0.0099 -0.0115 -0.0022 209 LYS 27 CD 0.0105 -0.0106 -0.0021 210 LYS 27 CE 0.0113 -0.0084 -0.0013 211 LYS 27 NZ 0.0119 -0.0076 -0.0012 212 ALA 28 N 0.0056 -0.0158 -0.0067 213 ALA 28 CA 0.0047 -0.0170 -0.0084 214 ALA 28 C 0.0040 -0.0162 -0.0078 215 ALA 28 O 0.0045 -0.0172 -0.0087 216 ALA 28 CB 0.0025 -0.0174 -0.0099 217 LYS 29 N 0.0057 -0.0102 -0.0019 218 LYS 29 CA 0.0048 -0.0118 -0.0028 219 LYS 29 C 0.0043 -0.0113 -0.0047 220 LYS 29 O 0.0037 -0.0119 -0.0061 221 LYS 29 CB 0.0046 -0.0133 -0.0019 222 LYS 29 CG 0.0050 -0.0139 -0.0000 223 LYS 29 CD 0.0050 -0.0152 0.0010 224 LYS 29 CE 0.0049 -0.0166 0.0023 225 LYS 29 NZ 0.0040 -0.0182 0.0014 226 ILE 30 N 0.0061 -0.0106 -0.0041 227 ILE 30 CA 0.0082 -0.0107 -0.0035 228 ILE 30 C 0.0092 -0.0125 -0.0050 229 ILE 30 O 0.0103 -0.0129 -0.0050 230 ILE 30 CB 0.0098 -0.0099 -0.0023 231 ILE 30 CG1 0.0090 -0.0080 -0.0007 232 ILE 30 CG2 0.0121 -0.0104 -0.0020 233 ILE 30 CD1 0.0103 -0.0074 0.0003 234 GLN 31 N 0.0092 -0.0142 -0.0087 235 GLN 31 CA 0.0105 -0.0168 -0.0107 236 GLN 31 C 0.0085 -0.0160 -0.0119 237 GLN 31 O 0.0096 -0.0168 -0.0117 238 GLN 31 CB 0.0104 -0.0190 -0.0139 239 GLN 31 CG 0.0116 -0.0215 -0.0160 240 GLN 31 CD 0.0120 -0.0239 -0.0188 241 GLN 31 OE1 0.0099 -0.0231 -0.0200 242 GLN 31 NE2 0.0144 -0.0265 -0.0197 243 ASP 32 N 0.0053 -0.0129 -0.0134 244 ASP 32 CA 0.0009 -0.0102 -0.0155 245 ASP 32 C -0.0001 -0.0081 -0.0109 246 ASP 32 O -0.0015 -0.0074 -0.0120 247 ASP 32 CB -0.0032 -0.0077 -0.0177 248 ASP 32 CG -0.0065 -0.0065 -0.0226 249 ASP 32 OD1 -0.0046 -0.0091 -0.0270 250 ASP 32 OD2 -0.0104 -0.0031 -0.0212 251 LYS 33 N 0.0056 -0.0012 -0.0026 252 LYS 33 CA 0.0053 0.0016 0.0021 253 LYS 33 C 0.0068 -0.0011 0.0067 254 LYS 33 O 0.0066 0.0011 0.0100 255 LYS 33 CB 0.0042 0.0055 0.0029 256 LYS 33 CG 0.0048 0.0043 0.0046 257 LYS 33 CD 0.0040 0.0083 0.0084 258 LYS 33 CE 0.0021 0.0131 0.0060 259 LYS 33 NZ 0.0014 0.0169 0.0103 260 GLU 34 N 0.0020 0.0035 -0.0051 261 GLU 34 CA 0.0048 -0.0022 0.0036 262 GLU 34 C 0.0109 -0.0092 -0.0018 263 GLU 34 O 0.0135 -0.0143 0.0047 264 GLU 34 CB 0.0079 -0.0083 0.0130 265 GLU 34 CG 0.0023 -0.0022 0.0202 266 GLU 34 CD -0.0028 0.0026 0.0301 267 GLU 34 OE1 -0.0006 -0.0015 0.0356 268 GLU 34 OE2 -0.0092 0.0110 0.0315 269 GLY 35 N 0.0159 -0.0153 -0.0075 270 GLY 35 CA 0.0190 -0.0199 -0.0112 271 GLY 35 C 0.0233 -0.0233 -0.0105 272 GLY 35 O 0.0262 -0.0274 -0.0136 273 ILE 36 N 0.0189 -0.0177 -0.0101 274 ILE 36 CA 0.0204 -0.0182 -0.0097 275 ILE 36 C 0.0189 -0.0189 -0.0112 276 ILE 36 O 0.0166 -0.0176 -0.0113 277 ILE 36 CB 0.0211 -0.0160 -0.0074 278 ILE 36 CG1 0.0226 -0.0152 -0.0060 279 ILE 36 CG2 0.0228 -0.0163 -0.0068 280 ILE 36 CD1 0.0224 -0.0126 -0.0038 281 PRO 37 N 0.0230 -0.0229 -0.0138 282 PRO 37 CA 0.0194 -0.0235 -0.0132 283 PRO 37 C 0.0174 -0.0193 -0.0116 284 PRO 37 O 0.0200 -0.0161 -0.0112 285 PRO 37 CB 0.0218 -0.0250 -0.0142 286 PRO 37 CG 0.0255 -0.0274 -0.0155 287 PRO 37 CD 0.0272 -0.0245 -0.0150 288 PRO 38 N 0.0152 -0.0191 -0.0106 289 PRO 38 CA 0.0139 -0.0162 -0.0087 290 PRO 38 C 0.0153 -0.0140 -0.0084 291 PRO 38 O 0.0156 -0.0111 -0.0073 292 PRO 38 CB 0.0105 -0.0173 -0.0076 293 PRO 38 CG 0.0100 -0.0205 -0.0088 294 PRO 38 CD 0.0128 -0.0218 -0.0106 295 ASP 39 N 0.0184 -0.0137 -0.0062 296 ASP 39 CA 0.0176 -0.0090 -0.0063 297 ASP 39 C 0.0204 -0.0060 -0.0101 298 ASP 39 O 0.0200 -0.0015 -0.0106 299 ASP 39 CB 0.0163 -0.0100 -0.0046 300 ASP 39 CG 0.0179 -0.0072 -0.0070 301 ASP 39 OD1 0.0209 -0.0082 -0.0103 302 ASP 39 OD2 0.0161 -0.0040 -0.0056 303 GLN 40 N 0.0187 -0.0085 -0.0113 304 GLN 40 CA 0.0225 -0.0057 -0.0141 305 GLN 40 C 0.0234 -0.0022 -0.0156 306 GLN 40 O 0.0259 0.0010 -0.0178 307 GLN 40 CB 0.0269 -0.0092 -0.0155 308 GLN 40 CG 0.0263 -0.0126 -0.0142 309 GLN 40 CD 0.0306 -0.0161 -0.0155 310 GLN 40 OE1 0.0303 -0.0197 -0.0143 311 GLN 40 NE2 0.0343 -0.0151 -0.0177 312 GLN 41 N 0.0195 -0.0040 -0.0100 313 GLN 41 CA 0.0189 -0.0035 -0.0090 314 GLN 41 C 0.0186 -0.0010 -0.0070 315 GLN 41 O 0.0174 -0.0005 -0.0052 316 GLN 41 CB 0.0170 -0.0058 -0.0082 317 GLN 41 CG 0.0170 -0.0085 -0.0100 318 GLN 41 CD 0.0151 -0.0106 -0.0091 319 GLN 41 OE1 0.0141 -0.0100 -0.0075 320 GLN 41 NE2 0.0145 -0.0130 -0.0099 321 ARG 42 N 0.0209 0.0001 -0.0113 322 ARG 42 CA 0.0219 0.0006 -0.0082 323 ARG 42 C 0.0192 0.0009 -0.0058 324 ARG 42 O 0.0187 0.0009 -0.0053 325 ARG 42 CB 0.0254 0.0009 -0.0074 326 ARG 42 CG 0.0265 0.0014 -0.0039 327 ARG 42 CD 0.0301 0.0016 -0.0036 328 ARG 42 NE 0.0311 0.0021 -0.0002 329 ARG 42 CZ 0.0318 0.0024 0.0015 330 ARG 42 NH1 0.0320 0.0022 0.0002 331 ARG 42 NH2 0.0322 0.0028 0.0047 332 LEU 43 N 0.0172 -0.0005 -0.0018 333 LEU 43 CA 0.0159 -0.0007 -0.0008 334 LEU 43 C 0.0163 0.0003 0.0011 335 LEU 43 O 0.0167 0.0009 0.0019 336 LEU 43 CB 0.0141 -0.0016 -0.0007 337 LEU 43 CG 0.0133 -0.0028 -0.0024 338 LEU 43 CD1 0.0116 -0.0034 -0.0020 339 LEU 43 CD2 0.0130 -0.0031 -0.0029 340 ILE 44 N 0.0166 -0.0015 0.0015 341 ILE 44 CA 0.0172 -0.0003 0.0042 342 ILE 44 C 0.0150 -0.0009 0.0059 343 ILE 44 O 0.0138 -0.0019 0.0050 344 ILE 44 CB 0.0196 0.0008 0.0037 345 ILE 44 CG1 0.0219 0.0013 0.0016 346 ILE 44 CG2 0.0205 0.0022 0.0065 347 ILE 44 CD1 0.0229 0.0021 0.0026 348 PHE 45 N 0.0121 0.0004 0.0050 349 PHE 45 CA 0.0109 0.0042 0.0058 350 PHE 45 C 0.0100 0.0085 0.0066 351 PHE 45 O 0.0075 0.0083 0.0064 352 PHE 45 CB 0.0066 0.0033 0.0052 353 PHE 45 CG 0.0051 0.0072 0.0059 354 PHE 45 CD1 0.0076 0.0079 0.0063 355 PHE 45 CD2 0.0013 0.0100 0.0062 356 PHE 45 CE1 0.0063 0.0115 0.0070 357 PHE 45 CE2 -0.0002 0.0136 0.0069 358 PHE 45 CZ 0.0022 0.0142 0.0072 359 ALA 46 N 0.0120 0.0068 0.0113 360 ALA 46 CA 0.0125 0.0126 0.0154 361 ALA 46 C 0.0160 0.0142 0.0156 362 ALA 46 O 0.0139 0.0171 0.0183 363 ALA 46 CB 0.0060 0.0140 0.0183 364 GLY 47 N 0.0167 0.0110 0.0147 365 GLY 47 CA 0.0216 0.0140 0.0138 366 GLY 47 C 0.0213 0.0142 0.0144 367 GLY 47 O 0.0250 0.0175 0.0151 368 LYS 48 N 0.0173 0.0131 0.0123 369 LYS 48 CA 0.0159 0.0116 0.0113 370 LYS 48 C 0.0161 0.0084 0.0088 371 LYS 48 O 0.0155 0.0076 0.0081 372 LYS 48 CB 0.0120 0.0121 0.0119 373 LYS 48 CG 0.0112 0.0152 0.0144 374 LYS 48 CD 0.0072 0.0154 0.0148 375 LYS 48 CE 0.0059 0.0169 0.0161 376 LYS 48 NZ 0.0076 0.0198 0.0183 377 GLN 49 N 0.0183 0.0093 0.0090 378 GLN 49 CA 0.0181 0.0063 0.0057 379 GLN 49 C 0.0140 0.0053 0.0052 380 GLN 49 O 0.0128 0.0063 0.0064 381 GLN 49 CB 0.0213 0.0052 0.0041 382 GLN 49 CG 0.0214 0.0022 0.0007 383 GLN 49 CD 0.0247 0.0012 -0.0009 384 GLN 49 OE1 0.0240 -0.0006 -0.0028 385 GLN 49 NE2 0.0283 0.0023 -0.0001 386 LEU 50 N 0.0105 0.0040 0.0025 387 LEU 50 CA 0.0072 0.0026 0.0030 388 LEU 50 C 0.0065 0.0008 0.0021 389 LEU 50 O 0.0084 -0.0006 0.0005 390 LEU 50 CB 0.0064 0.0011 0.0024 391 LEU 50 CG 0.0073 0.0029 0.0031 392 LEU 50 CD1 0.0060 0.0012 0.0025 393 LEU 50 CD2 0.0062 0.0056 0.0052 394 GLU 51 N 0.0008 0.0014 0.0021 395 GLU 51 CA -0.0015 -0.0021 0.0016 396 GLU 51 C -0.0037 -0.0052 0.0013 397 GLU 51 O -0.0056 -0.0037 0.0015 398 GLU 51 CB -0.0048 0.0001 0.0020 399 GLU 51 CG -0.0081 -0.0028 0.0016 400 GLU 51 CD -0.0089 -0.0010 0.0019 401 GLU 51 OE1 -0.0117 -0.0024 0.0017 402 GLU 51 OE2 -0.0062 0.0021 0.0022 403 ASP 52 N -0.0035 -0.0059 0.0016 404 ASP 52 CA -0.0054 -0.0087 0.0007 405 ASP 52 C -0.0092 -0.0087 0.0014 406 ASP 52 O -0.0106 -0.0102 0.0010 407 ASP 52 CB -0.0046 -0.0115 -0.0007 408 ASP 52 CG -0.0012 -0.0127 -0.0019 409 ASP 52 OD1 -0.0001 -0.0149 -0.0032 410 ASP 52 OD2 0.0005 -0.0115 -0.0017 411 GLY 53 N -0.0140 -0.0092 0.0003 412 GLY 53 CA -0.0191 -0.0089 0.0008 413 GLY 53 C -0.0209 -0.0049 0.0023 414 GLY 53 O -0.0252 -0.0047 0.0027 415 ARG 54 N -0.0185 -0.0034 0.0026 416 ARG 54 CA -0.0192 0.0012 0.0028 417 ARG 54 C -0.0172 -0.0002 0.0027 418 ARG 54 O -0.0141 -0.0040 0.0023 419 ARG 54 CB -0.0162 0.0060 0.0028 420 ARG 54 CG -0.0175 0.0075 0.0029 421 ARG 54 CD -0.0231 0.0099 0.0034 422 ARG 54 NE -0.0263 0.0063 0.0035 423 ARG 54 CZ -0.0307 0.0038 0.0037 424 ARG 54 NH1 -0.0335 0.0040 0.0039 425 ARG 54 NH2 -0.0323 0.0005 0.0037 426 THR 55 N -0.0190 0.0021 0.0033 427 THR 55 CA -0.0175 0.0013 0.0031 428 THR 55 C -0.0141 0.0047 0.0026 429 THR 55 O -0.0137 0.0079 0.0026 430 THR 55 CB -0.0212 0.0017 0.0036 431 THR 55 OG1 -0.0226 0.0062 0.0039 432 THR 55 CG2 -0.0250 -0.0012 0.0041 433 LEU 56 N -0.0120 0.0028 0.0024 434 LEU 56 CA -0.0087 0.0056 0.0016 435 LEU 56 C -0.0107 0.0096 0.0014 436 LEU 56 O -0.0093 0.0128 0.0008 437 LEU 56 CB -0.0059 0.0036 0.0014 438 LEU 56 CG -0.0037 -0.0005 0.0015 439 LEU 56 CD1 -0.0011 -0.0020 0.0013 440 LEU 56 CD2 -0.0008 0.0002 0.0010 441 SER 57 N -0.0150 0.0099 0.0024 442 SER 57 CA -0.0169 0.0140 0.0021 443 SER 57 C -0.0184 0.0164 0.0019 444 SER 57 O -0.0184 0.0205 0.0015 445 SER 57 CB -0.0207 0.0134 0.0024 446 SER 57 OG -0.0238 0.0108 0.0028 447 ASP 58 N -0.0198 0.0144 0.0027 448 ASP 58 CA -0.0207 0.0168 0.0029 449 ASP 58 C -0.0175 0.0199 0.0023 450 ASP 58 O -0.0181 0.0231 0.0024 451 ASP 58 CB -0.0216 0.0143 0.0030 452 ASP 58 CG -0.0255 0.0121 0.0037 453 ASP 58 OD1 -0.0259 0.0090 0.0037 454 ASP 58 OD2 -0.0282 0.0135 0.0042 455 TYR 59 N -0.0114 0.0158 0.0035 456 TYR 59 CA -0.0084 0.0176 0.0040 457 TYR 59 C -0.0080 0.0199 0.0046 458 TYR 59 O -0.0054 0.0214 0.0051 459 TYR 59 CB -0.0055 0.0152 0.0035 460 TYR 59 CG -0.0055 0.0131 0.0029 461 TYR 59 CD1 -0.0066 0.0100 0.0021 462 TYR 59 CD2 -0.0042 0.0143 0.0032 463 TYR 59 CE1 -0.0065 0.0081 0.0016 464 TYR 59 CE2 -0.0041 0.0124 0.0027 465 TYR 59 CZ -0.0053 0.0093 0.0019 466 TYR 59 OH -0.0050 0.0075 0.0015 467 ASN 60 N -0.0131 0.0214 0.0006 468 ASN 60 CA -0.0109 0.0251 0.0004 469 ASN 60 C -0.0043 0.0229 -0.0006 470 ASN 60 O -0.0002 0.0269 -0.0011 471 ASN 60 CB -0.0112 0.0324 0.0006 472 ASN 60 CG -0.0115 0.0365 0.0007 473 ASN 60 OD1 -0.0088 0.0419 0.0004 474 ASN 60 ND2 -0.0148 0.0340 0.0011 475 ILE 61 N -0.0051 0.0160 -0.0020 476 ILE 61 CA -0.0005 0.0143 -0.0021 477 ILE 61 C 0.0000 0.0140 -0.0021 478 ILE 61 O -0.0027 0.0115 -0.0013 479 ILE 61 CB 0.0000 0.0096 -0.0012 480 ILE 61 CG1 0.0001 0.0101 -0.0013 481 ILE 61 CG2 0.0043 0.0070 -0.0011 482 ILE 61 CD1 0.0003 0.0054 -0.0004 483 GLN 62 N 0.0047 0.0145 -0.0054 484 GLN 62 CA 0.0040 0.0147 -0.0053 485 GLN 62 C 0.0115 0.0093 -0.0063 486 GLN 62 O 0.0175 0.0065 -0.0070 487 GLN 62 CB 0.0038 0.0242 -0.0052 488 GLN 62 CG -0.0048 0.0294 -0.0042 489 GLN 62 CD -0.0042 0.0374 -0.0042 490 GLN 62 OE1 -0.0078 0.0447 -0.0037 491 GLN 62 NE2 0.0008 0.0364 -0.0048 492 LYS 63 N 0.0137 0.0074 -0.0089 493 LYS 63 CA 0.0179 0.0048 -0.0082 494 LYS 63 C 0.0199 0.0064 -0.0116 495 LYS 63 O 0.0197 0.0092 -0.0153 496 LYS 63 CB 0.0218 0.0028 -0.0080 497 LYS 63 CG 0.0229 0.0050 -0.0117 498 LYS 63 CD 0.0275 0.0027 -0.0118 499 LYS 63 CE 0.0281 0.0039 -0.0138 500 LYS 63 NZ 0.0291 0.0069 -0.0184 501 GLU 64 N 0.0212 0.0032 -0.0112 502 GLU 64 CA 0.0220 0.0035 -0.0119 503 GLU 64 C 0.0186 0.0042 -0.0132 504 GLU 64 O 0.0192 0.0046 -0.0145 505 GLU 64 CB 0.0258 0.0043 -0.0145 506 GLU 64 CG 0.0296 0.0032 -0.0122 507 GLU 64 CD 0.0321 0.0039 -0.0140 508 GLU 64 OE1 0.0326 0.0053 -0.0174 509 GLU 64 OE2 0.0336 0.0029 -0.0117 510 SER 65 N 0.0157 0.0028 -0.0076 511 SER 65 CA 0.0138 0.0044 -0.0082 512 SER 65 C 0.0147 0.0029 -0.0073 513 SER 65 O 0.0158 0.0006 -0.0056 514 SER 65 CB 0.0103 0.0046 -0.0068 515 SER 65 OG 0.0092 0.0063 -0.0078 516 THR 66 N 0.0117 -0.0116 -0.0053 517 THR 66 CA 0.0092 -0.0095 -0.0045 518 THR 66 C 0.0084 -0.0082 -0.0039 519 THR 66 O 0.0079 -0.0096 -0.0049 520 THR 66 CB 0.0063 -0.0104 -0.0060 521 THR 66 OG1 0.0073 -0.0115 -0.0065 522 THR 66 CG2 0.0038 -0.0081 -0.0051 523 LEU 67 N 0.0090 -0.0058 -0.0003 524 LEU 67 CA 0.0087 -0.0058 -0.0002 525 LEU 67 C 0.0080 -0.0056 0.0001 526 LEU 67 O 0.0080 -0.0054 0.0003 527 LEU 67 CB 0.0091 -0.0054 0.0001 528 LEU 67 CG 0.0098 -0.0053 0.0000 529 LEU 67 CD1 0.0101 -0.0049 0.0003 530 LEU 67 CD2 0.0100 -0.0058 -0.0005 531 HIS 68 N 0.0077 -0.0073 0.0001 532 HIS 68 CA 0.0037 -0.0062 0.0014 533 HIS 68 C 0.0057 -0.0023 0.0003 534 HIS 68 O 0.0098 -0.0030 -0.0011 535 HIS 68 CB 0.0025 -0.0112 0.0024 536 HIS 68 CG 0.0002 -0.0149 0.0036 537 HIS 68 ND1 -0.0048 -0.0149 0.0053 538 HIS 68 CD2 0.0023 -0.0187 0.0032 539 HIS 68 CE1 -0.0057 -0.0185 0.0060 540 HIS 68 NE2 -0.0014 -0.0207 0.0048 541 LEU 69 N 0.0097 -0.0010 -0.0023 542 LEU 69 CA 0.0112 0.0016 -0.0041 543 LEU 69 C 0.0107 0.0017 -0.0041 544 LEU 69 O 0.0075 0.0019 -0.0036 545 LEU 69 CB 0.0095 0.0047 -0.0055 546 LEU 69 CG 0.0106 0.0077 -0.0074 547 LEU 69 CD1 0.0144 0.0080 -0.0082 548 LEU 69 CD2 0.0084 0.0105 -0.0085 549 VAL 70 N 0.0164 -0.0007 -0.0064 550 VAL 70 CA 0.0192 -0.0002 -0.0076 551 VAL 70 C 0.0219 0.0036 -0.0137 552 VAL 70 O 0.0248 0.0044 -0.0154 553 VAL 70 CB 0.0244 -0.0033 -0.0034 554 VAL 70 CG1 0.0276 -0.0028 -0.0046 555 VAL 70 CG2 0.0219 -0.0070 0.0027 556 LEU 71 N 0.0237 0.0044 -0.0179 557 LEU 71 CA 0.0251 0.0061 -0.0212 558 LEU 71 C 0.0295 0.0086 -0.0213 559 LEU 71 O 0.0309 0.0093 -0.0211 560 LEU 71 CB 0.0226 0.0060 -0.0257 561 LEU 71 CG 0.0198 0.0048 -0.0271 562 LEU 71 CD1 0.0182 0.0027 -0.0230 563 LEU 71 CD2 0.0165 0.0040 -0.0305 564 ARG 72 N 0.0288 0.0046 -0.0257 565 ARG 72 CA 0.0286 0.0091 -0.0250 566 ARG 72 C 0.0287 0.0079 -0.0254 567 ARG 72 O 0.0275 0.0062 -0.0220 568 ARG 72 CB 0.0269 0.0109 -0.0203 569 ARG 72 CG 0.0261 0.0125 -0.0181 570 ARG 72 CD 0.0244 0.0123 -0.0132 571 ARG 72 NE 0.0240 0.0087 -0.0121 572 ARG 72 CZ 0.0226 0.0092 -0.0083 573 ARG 72 NH1 0.0219 0.0131 -0.0062 574 ARG 72 NH2 0.0221 0.0057 -0.0069 575 LEU 73 N 0.0298 0.0121 -0.0322 576 LEU 73 CA 0.0298 0.0046 -0.0279 577 LEU 73 C 0.0224 0.0072 -0.0245 578 LEU 73 O 0.0194 0.0151 -0.0270 579 LEU 73 CB 0.0386 0.0013 -0.0318 580 LEU 73 CG 0.0453 -0.0061 -0.0319 581 LEU 73 CD1 0.0449 -0.0055 -0.0320 582 LEU 73 CD2 0.0541 -0.0057 -0.0379 583 ARG 74 N 0.0253 0.0068 -0.0188 584 ARG 74 CA 0.0063 0.0073 -0.0094 585 ARG 74 C 0.0089 0.0021 -0.0051 586 ARG 74 O 0.0144 -0.0113 0.0068 587 ARG 74 CB -0.0026 -0.0020 0.0055 588 ARG 74 CG -0.0248 0.0039 0.0106 589 ARG 74 CD -0.0324 -0.0017 0.0207 590 ARG 74 NE -0.0370 -0.0150 0.0378 591 ARG 74 CZ -0.0244 -0.0287 0.0463 592 ARG 74 NH1 -0.0074 -0.0307 0.0396 593 ARG 74 NH2 -0.0284 -0.0404 0.0613 594 GLY 75 N -0.0086 0.0005 -0.0017 595 GLY 75 CA -0.0297 0.0072 0.0079 596 GLY 75 C -0.0545 -0.0028 0.0157 597 GLY 75 O -0.0613 0.0022 0.0193 598 GLY 76 N -0.1083 -0.0627 0.0400 599 GLY 76 CA -0.0440 -0.0313 0.0124 600 GLY 76 C 0.0037 0.0314 0.0158 601 GLY 76 O 0.0341 0.0882 0.0282 602 GLY 76 OXT 0.0072 0.0209 0.0070