1 PRO 1 N -0.0126 -0.0080 0.0157 2 PRO 1 CA -0.0111 -0.0096 0.0168 3 PRO 1 C -0.0098 -0.0088 0.0146 4 PRO 1 O -0.0103 -0.0069 0.0123 5 PRO 1 CB -0.0085 -0.0115 0.0174 6 PRO 1 CG -0.0077 -0.0104 0.0151 7 PRO 1 CD -0.0107 -0.0083 0.0146 8 GLN 2 N -0.0117 -0.0107 0.0128 9 GLN 2 CA -0.0108 -0.0081 0.0114 10 GLN 2 C -0.0082 -0.0068 0.0131 11 GLN 2 O -0.0072 -0.0073 0.0147 12 GLN 2 CB -0.0116 -0.0069 0.0095 13 GLN 2 CG -0.0110 -0.0042 0.0077 14 GLN 2 CD -0.0109 -0.0029 0.0066 15 GLN 2 OE1 -0.0094 -0.0024 0.0078 16 GLN 2 NE2 -0.0124 -0.0022 0.0042 17 ILE 3 N -0.0084 -0.0036 0.0127 18 ILE 3 CA -0.0054 -0.0038 0.0124 19 ILE 3 C -0.0043 -0.0022 0.0110 20 ILE 3 O -0.0050 -0.0002 0.0097 21 ILE 3 CB -0.0040 -0.0039 0.0123 22 ILE 3 CG1 -0.0035 -0.0016 0.0105 23 ILE 3 CG2 -0.0056 -0.0050 0.0134 24 ILE 3 CD1 -0.0019 -0.0017 0.0103 25 THR 4 N -0.0034 0.0052 0.0135 26 THR 4 CA -0.0009 0.0070 0.0116 27 THR 4 C -0.0004 0.0072 0.0121 28 THR 4 O -0.0017 0.0060 0.0142 29 THR 4 CB 0.0020 0.0085 0.0130 30 THR 4 OG1 0.0023 0.0080 0.0167 31 THR 4 CG2 0.0021 0.0087 0.0121 32 LEU 5 N 0.0023 0.0074 0.0082 33 LEU 5 CA 0.0018 0.0071 0.0080 34 LEU 5 C 0.0031 0.0080 0.0087 35 LEU 5 O 0.0031 0.0079 0.0082 36 LEU 5 CB 0.0014 0.0062 0.0059 37 LEU 5 CG -0.0003 0.0051 0.0053 38 LEU 5 CD1 -0.0003 0.0044 0.0031 39 LEU 5 CD2 -0.0020 0.0044 0.0064 40 TRP 6 N 0.0058 0.0139 0.0120 41 TRP 6 CA 0.0072 0.0142 0.0125 42 TRP 6 C 0.0069 0.0141 0.0132 43 TRP 6 O 0.0078 0.0143 0.0130 44 TRP 6 CB 0.0082 0.0143 0.0137 45 TRP 6 CG 0.0085 0.0144 0.0130 46 TRP 6 CD1 0.0077 0.0142 0.0132 47 TRP 6 CD2 0.0098 0.0147 0.0119 48 TRP 6 NE1 0.0083 0.0144 0.0124 49 TRP 6 CE2 0.0096 0.0147 0.0116 50 TRP 6 CE3 0.0111 0.0150 0.0112 51 TRP 6 CZ2 0.0107 0.0150 0.0105 52 TRP 6 CZ3 0.0121 0.0153 0.0102 53 TRP 6 CH2 0.0119 0.0153 0.0099 54 GLN 7 N 0.0075 0.0135 0.0065 55 GLN 7 CA 0.0015 0.0132 0.0095 56 GLN 7 C -0.0017 0.0080 0.0081 57 GLN 7 O 0.0007 0.0057 0.0054 58 GLN 7 CB 0.0002 0.0182 0.0132 59 GLN 7 CG 0.0036 0.0235 0.0146 60 GLN 7 CD 0.0007 0.0256 0.0174 61 GLN 7 OE1 0.0012 0.0240 0.0162 62 GLN 7 NE2 -0.0020 0.0295 0.0212 63 ARG 8 N -0.0041 0.0075 0.0035 64 ARG 8 CA -0.0036 0.0088 0.0035 65 ARG 8 C -0.0028 0.0104 0.0039 66 ARG 8 O -0.0029 0.0109 0.0032 67 ARG 8 CB -0.0041 0.0092 0.0019 68 ARG 8 CG -0.0046 0.0079 0.0017 69 ARG 8 CD -0.0053 0.0080 -0.0000 70 ARG 8 NE -0.0056 0.0072 -0.0001 71 ARG 8 CZ -0.0064 0.0065 -0.0013 72 ARG 8 NH1 -0.0070 0.0064 -0.0026 73 ARG 8 NH2 -0.0066 0.0059 -0.0012 74 PRO 9 N -0.0002 0.0028 0.0018 75 PRO 9 CA 0.0004 0.0025 0.0011 76 PRO 9 C 0.0016 0.0023 0.0009 77 PRO 9 O 0.0025 0.0025 0.0013 78 PRO 9 CB 0.0004 0.0028 0.0019 79 PRO 9 CG 0.0005 0.0032 0.0030 80 PRO 9 CD -0.0002 0.0033 0.0029 81 LEU 10 N 0.0045 0.0035 -0.0025 82 LEU 10 CA 0.0051 0.0041 -0.0035 83 LEU 10 C 0.0046 0.0043 -0.0028 84 LEU 10 O 0.0042 0.0032 -0.0020 85 LEU 10 CB 0.0059 0.0031 -0.0047 86 LEU 10 CG 0.0065 0.0031 -0.0057 87 LEU 10 CD1 0.0072 0.0017 -0.0066 88 LEU 10 CD2 0.0069 0.0047 -0.0065 89 VAL 11 N 0.0054 0.0044 -0.0041 90 VAL 11 CA 0.0043 0.0056 -0.0021 91 VAL 11 C 0.0033 0.0068 -0.0031 92 VAL 11 O 0.0032 0.0071 -0.0053 93 VAL 11 CB 0.0031 0.0069 -0.0011 94 VAL 11 CG1 0.0040 0.0057 0.0003 95 VAL 11 CG2 0.0021 0.0082 -0.0031 96 THR 12 N 0.0026 0.0086 -0.0004 97 THR 12 N 0.0025 0.0086 -0.0004 98 THR 12 CA 0.0008 0.0101 -0.0010 99 THR 12 CA 0.0009 0.0101 -0.0010 100 THR 12 C -0.0016 0.0123 -0.0016 101 THR 12 C -0.0017 0.0123 -0.0013 102 THR 12 O -0.0023 0.0128 -0.0000 103 THR 12 O -0.0026 0.0130 0.0007 104 THR 12 CB 0.0008 0.0101 0.0018 105 THR 12 CB 0.0010 0.0099 0.0017 106 THR 12 OG1 0.0032 0.0080 0.0023 107 THR 12 OG1 0.0004 0.0104 0.0047 108 THR 12 CG2 -0.0009 0.0116 0.0012 109 THR 12 CG2 0.0036 0.0077 0.0019 110 ILE 13 N -0.0009 0.0125 -0.0044 111 ILE 13 CA -0.0024 0.0135 -0.0048 112 ILE 13 C -0.0036 0.0145 -0.0047 113 ILE 13 O -0.0034 0.0142 -0.0050 114 ILE 13 CB -0.0026 0.0133 -0.0067 115 ILE 13 CG1 -0.0028 0.0131 -0.0083 116 ILE 13 CG2 -0.0013 0.0123 -0.0069 117 ILE 13 CD1 -0.0031 0.0129 -0.0103 118 LYS 14 N -0.0123 0.0154 -0.0040 119 LYS 14 CA -0.0107 0.0158 -0.0053 120 LYS 14 C -0.0085 0.0153 -0.0032 121 LYS 14 O -0.0071 0.0150 -0.0021 122 LYS 14 CB -0.0093 0.0165 -0.0079 123 LYS 14 CG -0.0080 0.0170 -0.0094 124 LYS 14 CD -0.0064 0.0177 -0.0120 125 LYS 14 CE -0.0052 0.0181 -0.0134 126 LYS 14 NZ -0.0037 0.0188 -0.0159 127 ILE 15 N -0.0050 0.0104 -0.0071 128 ILE 15 CA -0.0053 0.0085 -0.0068 129 ILE 15 C -0.0061 0.0078 -0.0049 130 ILE 15 O -0.0066 0.0089 -0.0036 131 ILE 15 CB -0.0052 0.0086 -0.0070 132 ILE 15 CG1 -0.0056 0.0065 -0.0068 133 ILE 15 CG2 -0.0055 0.0102 -0.0058 134 ILE 15 CD1 -0.0054 0.0064 -0.0071 135 GLY 16 N -0.0019 0.0029 -0.0054 136 GLY 16 CA 0.0004 -0.0001 -0.0017 137 GLY 16 C -0.0002 0.0007 -0.0033 138 GLY 16 O -0.0001 0.0009 0.0010 139 GLY 17 N 0.0003 0.0094 -0.0079 140 GLY 17 CA -0.0016 0.0158 -0.0089 141 GLY 17 C -0.0049 0.0170 -0.0091 142 GLY 17 O -0.0067 0.0223 -0.0099 143 GLN 18 N -0.0008 0.0107 -0.0070 144 GLN 18 CA -0.0030 0.0136 -0.0059 145 GLN 18 C -0.0052 0.0159 -0.0080 146 GLN 18 O -0.0052 0.0157 -0.0090 147 GLN 18 CB -0.0029 0.0145 -0.0018 148 GLN 18 CG -0.0008 0.0124 0.0006 149 GLN 18 CD -0.0007 0.0132 0.0045 150 GLN 18 OE1 -0.0023 0.0156 0.0061 151 GLN 18 NE2 0.0011 0.0112 0.0061 152 LEU 19 N -0.0082 0.0201 -0.0088 153 LEU 19 CA -0.0065 0.0202 -0.0090 154 LEU 19 C -0.0077 0.0187 -0.0088 155 LEU 19 O -0.0100 0.0191 -0.0086 156 LEU 19 CB -0.0062 0.0230 -0.0093 157 LEU 19 CG -0.0054 0.0250 -0.0095 158 LEU 19 CD1 -0.0056 0.0277 -0.0097 159 LEU 19 CD2 -0.0026 0.0243 -0.0097 160 LYS 20 N 0.0022 0.0130 -0.0099 161 LYS 20 CA 0.0019 0.0142 -0.0091 162 LYS 20 C 0.0009 0.0150 -0.0098 163 LYS 20 O 0.0005 0.0146 -0.0109 164 LYS 20 CB 0.0023 0.0143 -0.0082 165 LYS 20 CG 0.0033 0.0135 -0.0073 166 LYS 20 CD 0.0038 0.0137 -0.0064 167 LYS 20 CE 0.0047 0.0130 -0.0055 168 LYS 20 NZ 0.0049 0.0134 -0.0048 169 GLU 21 N 0.0055 0.0106 -0.0127 170 GLU 21 CA 0.0065 0.0087 -0.0111 171 GLU 21 C 0.0063 0.0092 -0.0125 172 GLU 21 O 0.0063 0.0097 -0.0153 173 GLU 21 CB 0.0081 0.0058 -0.0118 174 GLU 21 CG 0.0085 0.0048 -0.0101 175 GLU 21 CD 0.0091 0.0033 -0.0071 176 GLU 21 OE1 0.0086 0.0040 -0.0056 177 GLU 21 OE2 0.0101 0.0015 -0.0063 178 ALA 22 N 0.0044 0.0071 -0.0108 179 ALA 22 CA 0.0044 0.0071 -0.0110 180 ALA 22 C 0.0050 0.0059 -0.0097 181 ALA 22 O 0.0053 0.0056 -0.0083 182 ALA 22 CB 0.0039 0.0088 -0.0108 183 LEU 23 N 0.0034 0.0040 -0.0085 184 LEU 23 CA 0.0029 0.0038 -0.0080 185 LEU 23 C 0.0034 0.0039 -0.0075 186 LEU 23 O 0.0040 0.0040 -0.0070 187 LEU 23 CB 0.0024 0.0036 -0.0075 188 LEU 23 CG 0.0017 0.0033 -0.0070 189 LEU 23 CD1 0.0010 0.0032 -0.0075 190 LEU 23 CD2 0.0015 0.0032 -0.0064 191 LEU 24 N 0.0017 0.0010 -0.0064 192 LEU 24 CA 0.0015 0.0018 -0.0050 193 LEU 24 C 0.0015 0.0012 -0.0050 194 LEU 24 O 0.0016 -0.0003 -0.0047 195 LEU 24 CB 0.0013 0.0014 -0.0033 196 LEU 24 CG 0.0012 0.0019 -0.0032 197 LEU 24 CD1 0.0010 0.0012 -0.0015 198 LEU 24 CD2 0.0011 0.0037 -0.0034 199 ASP 25 N 0.0002 -0.0000 -0.0067 200 ASP 25 CA 0.0002 0.0000 -0.0065 201 ASP 25 C 0.0002 0.0001 -0.0063 202 ASP 25 O 0.0004 0.0002 -0.0062 203 ASP 25 CB 0.0003 0.0001 -0.0065 204 ASP 25 CG 0.0002 0.0001 -0.0063 205 ASP 25 OD1 0.0000 0.0001 -0.0062 206 ASP 25 OD2 0.0002 0.0001 -0.0064 207 THR 26 N -0.0038 -0.0047 -0.0023 208 THR 26 CA -0.0032 -0.0049 -0.0014 209 THR 26 C -0.0034 -0.0054 -0.0007 210 THR 26 O -0.0028 -0.0055 -0.0000 211 THR 26 CB -0.0032 -0.0051 -0.0011 212 THR 26 OG1 -0.0041 -0.0056 -0.0010 213 THR 26 CG2 -0.0029 -0.0045 -0.0017 214 GLY 27 N -0.0031 -0.0051 -0.0012 215 GLY 27 CA -0.0039 -0.0068 -0.0007 216 GLY 27 C -0.0040 -0.0056 -0.0018 217 GLY 27 O -0.0045 -0.0068 -0.0014 218 ALA 28 N -0.0017 -0.0021 -0.0094 219 ALA 28 CA 0.0005 -0.0026 -0.0088 220 ALA 28 C 0.0017 -0.0030 -0.0089 221 ALA 28 O 0.0017 -0.0038 -0.0106 222 ALA 28 CB 0.0013 -0.0035 -0.0102 223 ASP 29 N -0.0024 -0.0089 -0.0105 224 ASP 29 CA 0.0012 -0.0075 -0.0093 225 ASP 29 C 0.0028 -0.0050 -0.0121 226 ASP 29 O 0.0054 -0.0034 -0.0123 227 ASP 29 CB 0.0020 -0.0084 -0.0067 228 ASP 29 CG 0.0008 -0.0108 -0.0036 229 ASP 29 OD1 0.0000 -0.0116 -0.0030 230 ASP 29 OD2 0.0006 -0.0119 -0.0017 231 ASP 30 N 0.0047 -0.0024 -0.0202 232 ASP 30 CA 0.0038 -0.0026 -0.0193 233 ASP 30 CA 0.0038 -0.0027 -0.0193 234 ASP 30 C 0.0045 -0.0026 -0.0180 235 ASP 30 O 0.0056 -0.0024 -0.0180 236 ASP 30 CB 0.0032 -0.0027 -0.0198 237 ASP 30 CB 0.0029 -0.0028 -0.0198 238 ASP 30 CG 0.0031 -0.0026 -0.0212 239 ASP 30 CG 0.0021 -0.0029 -0.0209 240 ASP 30 OD1 0.0027 -0.0026 -0.0218 241 ASP 30 OD1 0.0015 -0.0030 -0.0208 242 ASP 30 OD2 0.0034 -0.0025 -0.0218 243 ASP 30 OD2 0.0021 -0.0027 -0.0219 244 THR 31 N 0.0018 -0.0007 -0.0176 245 THR 31 CA 0.0029 -0.0016 -0.0162 246 THR 31 C 0.0040 -0.0015 -0.0160 247 THR 31 O 0.0034 -0.0013 -0.0164 248 THR 31 CB 0.0016 -0.0028 -0.0152 249 THR 31 OG1 0.0007 -0.0030 -0.0153 250 THR 31 CG2 0.0025 -0.0039 -0.0137 251 VAL 32 N 0.0109 0.0014 -0.0154 252 VAL 32 CA 0.0118 0.0015 -0.0138 253 VAL 32 C 0.0125 0.0014 -0.0124 254 VAL 32 O 0.0128 0.0025 -0.0125 255 VAL 32 CB 0.0125 0.0033 -0.0137 256 VAL 32 CG1 0.0131 0.0030 -0.0123 257 VAL 32 CG2 0.0119 0.0040 -0.0154 258 LEU 33 N 0.0089 0.0047 -0.0129 259 LEU 33 CA 0.0102 0.0038 -0.0106 260 LEU 33 C 0.0122 0.0044 -0.0088 261 LEU 33 O 0.0121 0.0044 -0.0089 262 LEU 33 CB 0.0088 0.0010 -0.0098 263 LEU 33 CG 0.0067 0.0001 -0.0115 264 LEU 33 CD1 0.0056 -0.0027 -0.0104 265 LEU 33 CD2 0.0072 0.0017 -0.0122 266 GLU 34 N 0.0158 0.0061 -0.0065 267 GLU 34 CA 0.0171 0.0065 -0.0040 268 GLU 34 C 0.0179 0.0039 -0.0028 269 GLU 34 O 0.0174 0.0018 -0.0039 270 GLU 34 CB 0.0174 0.0078 -0.0033 271 GLU 34 CG 0.0165 0.0102 -0.0046 272 GLU 34 CD 0.0167 0.0111 -0.0041 273 GLU 34 OE1 0.0169 0.0094 -0.0040 274 GLU 34 OE2 0.0167 0.0135 -0.0039 275 GLU 35 N 0.0182 0.0065 0.0052 276 GLU 35 CA 0.0177 0.0022 0.0084 277 GLU 35 C 0.0167 -0.0012 0.0090 278 GLU 35 O 0.0176 0.0001 0.0103 279 GLU 35 CB 0.0197 0.0036 0.0133 280 GLU 35 CG 0.0193 -0.0005 0.0166 281 GLU 35 CD 0.0174 -0.0035 0.0138 282 GLU 35 OE1 0.0174 -0.0014 0.0115 283 GLU 35 OE2 0.0159 -0.0079 0.0139 284 MET 36 N 0.0089 0.0050 0.0134 285 MET 36 CA 0.0080 0.0009 0.0142 286 MET 36 C 0.0066 -0.0045 0.0145 287 MET 36 O 0.0060 -0.0048 0.0127 288 MET 36 CB 0.0069 0.0013 0.0097 289 MET 36 CG 0.0052 0.0002 0.0042 290 MET 36 SD 0.0038 0.0003 -0.0008 291 MET 36 CE 0.0033 -0.0046 0.0022 292 ASN 37 N 0.0061 -0.0039 0.0236 293 ASN 37 CA 0.0067 -0.0128 0.0235 294 ASN 37 C 0.0006 -0.0174 0.0139 295 ASN 37 O -0.0019 -0.0219 0.0096 296 ASN 37 CB 0.0116 -0.0219 0.0299 297 ASN 37 CG 0.0133 -0.0299 0.0315 298 ASN 37 OD1 0.0106 -0.0290 0.0276 299 ASN 37 ND2 0.0178 -0.0379 0.0373 300 LEU 38 N 0.0005 -0.0131 0.0092 301 LEU 38 CA -0.0010 -0.0164 0.0047 302 LEU 38 C -0.0002 -0.0216 0.0065 303 LEU 38 O 0.0009 -0.0215 0.0095 304 LEU 38 CB -0.0026 -0.0136 0.0008 305 LEU 38 CG -0.0040 -0.0095 -0.0026 306 LEU 38 CD1 -0.0056 -0.0078 -0.0068 307 LEU 38 CD2 -0.0048 -0.0119 -0.0049 308 PRO 39 N 0.0016 -0.0368 0.0085 309 PRO 39 CA 0.0063 -0.0431 0.0112 310 PRO 39 C -0.0036 -0.0337 0.0057 311 PRO 39 O -0.0168 -0.0278 -0.0010 312 PRO 39 CB 0.0022 -0.0630 0.0111 313 PRO 39 CG -0.0097 -0.0656 0.0058 314 PRO 39 CD -0.0107 -0.0485 0.0037 315 GLY 40 N -0.0027 -0.0031 -0.0044 316 GLY 40 CA -0.0103 0.0107 -0.0025 317 GLY 40 C -0.0067 0.0199 -0.0101 318 GLY 40 O 0.0029 0.0172 -0.0187 319 ARG 41 N -0.0043 0.0487 -0.0278 320 ARG 41 CA -0.0074 0.0305 -0.0240 321 ARG 41 C -0.0082 0.0048 -0.0140 322 ARG 41 O 0.0006 0.0021 -0.0017 323 ARG 41 CB 0.0056 0.0387 -0.0111 324 ARG 41 CG 0.0236 0.0429 0.0097 325 ARG 41 CD 0.0358 0.0591 0.0181 326 ARG 41 NE 0.0512 0.0523 0.0404 327 ARG 41 CZ 0.0642 0.0620 0.0526 328 ARG 41 NH1 0.0639 0.0795 0.0447 329 ARG 41 NH2 0.0775 0.0541 0.0727 330 TRP 42 N -0.0034 -0.0047 -0.0096 331 TRP 42 CA -0.0030 -0.0088 -0.0086 332 TRP 42 C -0.0037 -0.0128 -0.0083 333 TRP 42 O -0.0051 -0.0124 -0.0092 334 TRP 42 CB -0.0056 -0.0092 -0.0101 335 TRP 42 CG -0.0098 -0.0090 -0.0127 336 TRP 42 CD1 -0.0117 -0.0053 -0.0145 337 TRP 42 CD2 -0.0126 -0.0126 -0.0137 338 TRP 42 NE1 -0.0155 -0.0064 -0.0166 339 TRP 42 CE2 -0.0161 -0.0108 -0.0162 340 TRP 42 CE3 -0.0125 -0.0172 -0.0128 341 TRP 42 CZ2 -0.0196 -0.0135 -0.0178 342 TRP 42 CZ3 -0.0159 -0.0198 -0.0144 343 TRP 42 CH2 -0.0194 -0.0179 -0.0168 344 LYS 43 N -0.0010 -0.0149 -0.0064 345 LYS 43 CA -0.0026 -0.0251 -0.0027 346 LYS 43 C -0.0091 -0.0285 -0.0016 347 LYS 43 O -0.0078 -0.0250 -0.0029 348 LYS 43 CB 0.0074 -0.0303 -0.0006 349 LYS 43 CG 0.0136 -0.0285 -0.0011 350 LYS 43 CD 0.0219 -0.0361 0.0019 351 LYS 43 CE 0.0276 -0.0341 0.0013 352 LYS 43 NZ 0.0215 -0.0371 0.0022 353 PRO 44 N -0.0044 -0.0337 -0.0039 354 PRO 44 CA -0.0050 -0.0318 -0.0031 355 PRO 44 C 0.0004 -0.0332 -0.0073 356 PRO 44 O 0.0031 -0.0382 -0.0103 357 PRO 44 CB -0.0103 -0.0369 -0.0002 358 PRO 44 CG -0.0133 -0.0397 0.0015 359 PRO 44 CD -0.0087 -0.0399 -0.0020 360 LYS 45 N 0.0105 -0.0200 -0.0061 361 LYS 45 CA 0.0113 -0.0173 -0.0108 362 LYS 45 C 0.0165 -0.0133 -0.0102 363 LYS 45 O 0.0192 -0.0130 -0.0058 364 LYS 45 CB 0.0092 -0.0188 -0.0114 365 LYS 45 CG 0.0082 -0.0172 -0.0170 366 LYS 45 CD 0.0077 -0.0177 -0.0167 367 LYS 45 CE 0.0093 -0.0145 -0.0212 368 LYS 45 NZ 0.0068 -0.0142 -0.0268 369 MET 46 N 0.0254 -0.0087 -0.0009 370 MET 46 CA 0.0255 -0.0046 -0.0001 371 MET 46 C 0.0207 -0.0030 -0.0031 372 MET 46 O 0.0176 -0.0020 -0.0051 373 MET 46 CB 0.0275 0.0003 0.0021 374 MET 46 CG 0.0300 0.0031 0.0043 375 MET 46 SD 0.0350 0.0054 0.0082 376 MET 46 CE 0.0374 -0.0006 0.0088 377 ILE 47 N 0.0238 -0.0038 -0.0028 378 ILE 47 CA 0.0233 -0.0023 -0.0049 379 ILE 47 C 0.0210 -0.0002 -0.0037 380 ILE 47 O 0.0195 0.0007 -0.0022 381 ILE 47 CB 0.0238 -0.0013 -0.0081 382 ILE 47 CG1 0.0224 0.0002 -0.0081 383 ILE 47 CG2 0.0263 -0.0034 -0.0095 384 ILE 47 CD1 0.0225 0.0016 -0.0111 385 GLY 48 N 0.0264 -0.0061 0.0044 386 GLY 48 CA 0.0222 -0.0078 0.0055 387 GLY 48 C 0.0205 -0.0075 0.0042 388 GLY 48 O 0.0228 -0.0069 0.0041 389 GLY 49 N 0.0147 -0.0093 0.0070 390 GLY 49 CA 0.0126 -0.0098 0.0064 391 GLY 49 C 0.0073 -0.0134 0.0083 392 GLY 49 O 0.0063 -0.0161 0.0116 393 ILE 50 N 0.0031 -0.0119 0.0095 394 ILE 50 CA 0.0019 -0.0117 0.0100 395 ILE 50 C -0.0010 -0.0116 0.0114 396 ILE 50 O -0.0019 -0.0101 0.0115 397 ILE 50 CB 0.0026 -0.0090 0.0092 398 ILE 50 CG1 0.0040 -0.0096 0.0086 399 ILE 50 CG2 0.0004 -0.0069 0.0098 400 ILE 50 CD1 0.0052 -0.0072 0.0076 401 GLY 51 N -0.0031 -0.0186 0.0111 402 GLY 51 CA -0.0127 -0.0186 0.0123 403 GLY 51 C -0.0144 -0.0232 0.0137 404 GLY 51 O -0.0221 -0.0250 0.0152 405 GLY 52 N -0.0046 -0.0178 0.0158 406 GLY 52 CA -0.0011 -0.0182 0.0176 407 GLY 52 C 0.0045 -0.0139 0.0144 408 GLY 52 O 0.0075 -0.0113 0.0124 409 PHE 53 N 0.0090 -0.0034 0.0124 410 PHE 53 CA 0.0149 -0.0039 0.0097 411 PHE 53 CA 0.0150 -0.0039 0.0098 412 PHE 53 C 0.0157 -0.0032 0.0057 413 PHE 53 O 0.0126 -0.0029 0.0064 414 PHE 53 CB 0.0195 -0.0056 0.0146 415 PHE 53 CB 0.0194 -0.0056 0.0147 416 PHE 53 CG 0.0202 -0.0062 0.0176 417 PHE 53 CG 0.0191 -0.0062 0.0182 418 PHE 53 CD1 0.0253 -0.0069 0.0164 419 PHE 53 CD1 0.0154 -0.0065 0.0232 420 PHE 53 CD2 0.0159 -0.0063 0.0216 421 PHE 53 CD2 0.0225 -0.0064 0.0164 422 PHE 53 CE1 0.0260 -0.0075 0.0191 423 PHE 53 CE1 0.0151 -0.0070 0.0264 424 PHE 53 CE2 0.0166 -0.0069 0.0243 425 PHE 53 CE2 0.0222 -0.0070 0.0196 426 PHE 53 CZ 0.0216 -0.0075 0.0231 427 PHE 53 CZ 0.0185 -0.0073 0.0246 428 ILE 54 N 0.0208 0.0013 0.0015 429 ILE 54 CA 0.0208 0.0020 0.0003 430 ILE 54 C 0.0240 0.0009 0.0002 431 ILE 54 O 0.0265 0.0002 0.0000 432 ILE 54 CB 0.0200 0.0043 -0.0027 433 ILE 54 CG1 0.0224 0.0049 -0.0048 434 ILE 54 CG2 0.0165 0.0055 -0.0026 435 ILE 54 CD1 0.0224 0.0070 -0.0079 436 LYS 55 N 0.0269 -0.0011 -0.0007 437 LYS 55 CA 0.0298 -0.0018 -0.0009 438 LYS 55 C 0.0277 -0.0113 -0.0036 439 LYS 55 O 0.0296 -0.0177 -0.0054 440 LYS 55 CB 0.0401 -0.0000 -0.0007 441 LYS 55 CG 0.0433 0.0098 0.0020 442 LYS 55 CD 0.0538 0.0110 0.0020 443 LYS 55 CE 0.0585 0.0079 0.0010 444 LYS 55 NZ 0.0682 0.0101 0.0013 445 VAL 56 N 0.0181 -0.0061 -0.0054 446 VAL 56 CA 0.0174 -0.0071 -0.0042 447 VAL 56 C 0.0144 -0.0113 -0.0038 448 VAL 56 O 0.0129 -0.0135 -0.0055 449 VAL 56 CB 0.0186 -0.0055 -0.0076 450 VAL 56 CG1 0.0216 -0.0012 -0.0075 451 VAL 56 CG2 0.0176 -0.0071 -0.0125 452 ARG 57 N 0.0084 -0.0109 -0.0085 453 ARG 57 CA 0.0055 -0.0121 -0.0081 454 ARG 57 C 0.0055 -0.0122 -0.0087 455 ARG 57 O 0.0071 -0.0114 -0.0074 456 ARG 57 CB 0.0044 -0.0123 -0.0048 457 ARG 57 CG 0.0040 -0.0124 -0.0043 458 ARG 57 CD 0.0029 -0.0125 -0.0010 459 ARG 57 NE 0.0051 -0.0113 0.0011 460 ARG 57 CZ 0.0055 -0.0109 0.0035 461 ARG 57 NH1 0.0038 -0.0116 0.0041 462 ARG 57 NH2 0.0076 -0.0098 0.0052 463 GLN 58 N 0.0005 -0.0145 -0.0106 464 GLN 58 CA 0.0004 -0.0145 -0.0105 465 GLN 58 C -0.0020 -0.0146 -0.0087 466 GLN 58 O -0.0044 -0.0150 -0.0092 467 GLN 58 CB 0.0001 -0.0149 -0.0134 468 GLN 58 CG 0.0000 -0.0149 -0.0135 469 GLN 58 CD -0.0005 -0.0154 -0.0163 470 GLN 58 OE1 0.0008 -0.0155 -0.0184 471 GLN 58 NE2 -0.0022 -0.0157 -0.0165 472 TYR 59 N -0.0072 -0.0073 -0.0093 473 TYR 59 CA -0.0092 -0.0089 -0.0078 474 TYR 59 C -0.0115 -0.0091 -0.0080 475 TYR 59 O -0.0111 -0.0092 -0.0079 476 TYR 59 CB -0.0077 -0.0107 -0.0055 477 TYR 59 CG -0.0057 -0.0109 -0.0050 478 TYR 59 CD1 -0.0065 -0.0119 -0.0040 479 TYR 59 CD2 -0.0028 -0.0102 -0.0054 480 TYR 59 CE1 -0.0047 -0.0121 -0.0035 481 TYR 59 CE2 -0.0010 -0.0104 -0.0049 482 TYR 59 CZ -0.0019 -0.0114 -0.0039 483 TYR 59 OH -0.0001 -0.0116 -0.0034 484 ASP 60 N -0.0154 -0.0035 -0.0029 485 ASP 60 CA -0.0132 -0.0025 0.0015 486 ASP 60 C -0.0121 0.0007 0.0015 487 ASP 60 O -0.0126 0.0034 -0.0018 488 ASP 60 CB -0.0117 -0.0006 0.0036 489 ASP 60 CG -0.0126 -0.0039 0.0042 490 ASP 60 OD1 -0.0138 -0.0081 0.0049 491 ASP 60 OD2 -0.0123 -0.0025 0.0039 492 GLN 61 N -0.0216 -0.0057 0.0021 493 GLN 61 CA -0.0189 0.0022 0.0057 494 GLN 61 C -0.0211 -0.0027 -0.0117 495 GLN 61 O -0.0174 0.0097 -0.0204 496 GLN 61 CB -0.0117 0.0238 0.0097 497 GLN 61 CG -0.0096 0.0285 0.0259 498 GLN 61 CD -0.0026 0.0496 0.0275 499 GLN 61 OE1 -0.0000 0.0592 0.0127 500 GLN 61 NE2 0.0005 0.0571 0.0456 501 ILE 62 N -0.0240 -0.0053 -0.0098 502 ILE 62 CA -0.0230 -0.0060 -0.0086 503 ILE 62 C -0.0234 -0.0065 -0.0084 504 ILE 62 O -0.0236 -0.0058 -0.0092 505 ILE 62 CB -0.0213 -0.0052 -0.0085 506 ILE 62 CG1 -0.0208 -0.0049 -0.0084 507 ILE 62 CG2 -0.0203 -0.0058 -0.0073 508 ILE 62 CD1 -0.0210 -0.0061 -0.0074 509 LEU 63 N -0.0338 0.0100 -0.0113 510 LEU 63 CA -0.0300 0.0111 -0.0066 511 LEU 63 C -0.0253 0.0104 -0.0056 512 LEU 63 O -0.0265 0.0108 -0.0052 513 LEU 63 CB -0.0334 0.0140 -0.0016 514 LEU 63 CG -0.0298 0.0154 0.0037 515 LEU 63 CD1 -0.0270 0.0149 0.0041 516 LEU 63 CD2 -0.0330 0.0182 0.0085 517 ILE 64 N -0.0236 0.0116 -0.0038 518 ILE 64 CA -0.0196 0.0119 -0.0023 519 ILE 64 C -0.0173 0.0126 0.0004 520 ILE 64 O -0.0173 0.0124 -0.0004 521 ILE 64 CB -0.0165 0.0111 -0.0058 522 ILE 64 CG1 -0.0184 0.0102 -0.0093 523 ILE 64 CG2 -0.0130 0.0115 -0.0042 524 ILE 64 CD1 -0.0150 0.0096 -0.0115 525 GLU 65 N -0.0238 0.0190 -0.0031 526 GLU 65 CA -0.0206 0.0188 0.0013 527 GLU 65 C -0.0151 0.0164 0.0001 528 GLU 65 O -0.0136 0.0157 -0.0007 529 GLU 65 CB -0.0218 0.0204 0.0066 530 GLU 65 CG -0.0195 0.0205 0.0113 531 GLU 65 CD -0.0217 0.0225 0.0166 532 GLU 65 OE1 -0.0260 0.0241 0.0165 533 GLU 65 OE2 -0.0191 0.0224 0.0208 534 ILE 66 N -0.0118 0.0156 0.0004 535 ILE 66 CA -0.0094 0.0132 -0.0002 536 ILE 66 C -0.0072 0.0134 0.0027 537 ILE 66 O -0.0063 0.0138 0.0043 538 ILE 66 CB -0.0086 0.0114 -0.0021 539 ILE 66 CG1 -0.0109 0.0114 -0.0049 540 ILE 66 CG2 -0.0060 0.0090 -0.0026 541 ILE 66 CD1 -0.0108 0.0104 -0.0063 542 CYS 67 N -0.0085 0.0130 0.0037 543 CYS 67 CA -0.0077 0.0108 0.0068 544 CYS 67 C -0.0096 0.0125 0.0101 545 CYS 67 O -0.0096 0.0116 0.0131 546 CYS 67 CB -0.0062 0.0084 0.0073 547 CYS 67 SG -0.0048 0.0051 0.0105 548 GLY 68 N -0.0106 0.0168 0.0133 549 GLY 68 CA -0.0128 0.0212 0.0188 550 GLY 68 C -0.0145 0.0220 0.0181 551 GLY 68 O -0.0159 0.0254 0.0227 552 HIS 69 N -0.0135 0.0183 0.0103 553 HIS 69 CA -0.0147 0.0185 0.0092 554 HIS 69 C -0.0176 0.0189 0.0067 555 HIS 69 O -0.0174 0.0178 0.0042 556 HIS 69 CB -0.0124 0.0166 0.0076 557 HIS 69 CG -0.0097 0.0162 0.0100 558 HIS 69 ND1 -0.0076 0.0158 0.0119 559 HIS 69 CD2 -0.0087 0.0160 0.0108 560 HIS 69 CE1 -0.0055 0.0155 0.0137 561 HIS 69 NE2 -0.0061 0.0156 0.0131 562 LYS 70 N -0.0155 0.0208 0.0104 563 LYS 70 CA -0.0232 0.0198 0.0065 564 LYS 70 C -0.0227 0.0145 0.0008 565 LYS 70 O -0.0185 0.0133 0.0010 566 LYS 70 CB -0.0286 0.0246 0.0100 567 LYS 70 CG -0.0303 0.0298 0.0152 568 LYS 70 CD -0.0356 0.0345 0.0185 569 LYS 70 CE -0.0338 0.0400 0.0253 570 LYS 70 NZ -0.0355 0.0418 0.0267 571 ALA 71 N -0.0214 0.0123 -0.0017 572 ALA 71 CA -0.0216 0.0097 -0.0042 573 ALA 71 C -0.0252 0.0087 -0.0045 574 ALA 71 O -0.0271 0.0097 -0.0032 575 ALA 71 CB -0.0194 0.0086 -0.0056 576 ILE 72 N -0.0261 0.0026 -0.0017 577 ILE 72 CA -0.0291 0.0012 -0.0019 578 ILE 72 C -0.0289 -0.0018 -0.0034 579 ILE 72 O -0.0268 -0.0032 -0.0043 580 ILE 72 CB -0.0301 0.0014 -0.0017 581 ILE 72 CG1 -0.0311 0.0044 -0.0002 582 ILE 72 CG2 -0.0328 -0.0006 -0.0023 583 ILE 72 CD1 -0.0317 0.0048 0.0001 584 GLY 73 N -0.0264 -0.0070 -0.0013 585 GLY 73 CA -0.0263 -0.0071 -0.0019 586 GLY 73 C -0.0259 -0.0072 -0.0044 587 GLY 73 O -0.0258 -0.0070 -0.0056 588 THR 74 N -0.0149 -0.0090 -0.0096 589 THR 74 CA -0.0137 -0.0086 -0.0103 590 THR 74 C -0.0114 -0.0087 -0.0095 591 THR 74 O -0.0103 -0.0086 -0.0096 592 THR 74 CB -0.0138 -0.0074 -0.0124 593 THR 74 OG1 -0.0158 -0.0073 -0.0130 594 THR 74 CG2 -0.0122 -0.0069 -0.0132 595 VAL 75 N -0.0077 -0.0085 -0.0129 596 VAL 75 CA -0.0064 -0.0074 -0.0118 597 VAL 75 C -0.0055 -0.0067 -0.0109 598 VAL 75 O -0.0057 -0.0078 -0.0103 599 VAL 75 CB -0.0061 -0.0085 -0.0103 600 VAL 75 CG1 -0.0047 -0.0073 -0.0090 601 VAL 75 CG2 -0.0069 -0.0090 -0.0112 602 LEU 76 N 0.0094 -0.0069 -0.0128 603 LEU 76 CA 0.0097 -0.0067 -0.0124 604 LEU 76 C 0.0104 -0.0059 -0.0103 605 LEU 76 O 0.0114 -0.0049 -0.0098 606 LEU 76 CB 0.0106 -0.0059 -0.0142 607 LEU 76 CG 0.0102 -0.0063 -0.0164 608 LEU 76 CD1 0.0113 -0.0053 -0.0180 609 LEU 76 CD2 0.0086 -0.0079 -0.0169 610 VAL 77 N 0.0123 -0.0054 -0.0093 611 VAL 77 CA 0.0137 -0.0048 -0.0063 612 VAL 77 C 0.0151 -0.0033 -0.0059 613 VAL 77 O 0.0143 -0.0040 -0.0064 614 VAL 77 CB 0.0126 -0.0071 -0.0039 615 VAL 77 CG1 0.0141 -0.0065 -0.0007 616 VAL 77 CG2 0.0111 -0.0087 -0.0044 617 GLY 78 N 0.0196 -0.0005 -0.0056 618 GLY 78 CA 0.0212 0.0022 -0.0032 619 GLY 78 C 0.0225 0.0061 -0.0024 620 GLY 78 O 0.0221 0.0065 -0.0034 621 PRO 79 N 0.0241 0.0075 -0.0043 622 PRO 79 CA 0.0224 0.0102 -0.0038 623 PRO 79 C 0.0203 0.0125 -0.0056 624 PRO 79 O 0.0191 0.0150 -0.0040 625 PRO 79 CB 0.0229 0.0111 0.0000 626 PRO 79 CG 0.0241 0.0099 0.0012 627 PRO 79 CD 0.0251 0.0072 -0.0013 628 THR 80 N 0.0197 0.0116 -0.0069 629 THR 80 CA 0.0186 0.0130 -0.0083 630 THR 80 C 0.0187 0.0137 -0.0080 631 THR 80 O 0.0193 0.0124 -0.0074 632 THR 80 CB 0.0176 0.0119 -0.0105 633 THR 80 OG1 0.0167 0.0133 -0.0118 634 THR 80 CG2 0.0179 0.0097 -0.0107 635 PRO 81 N 0.0150 0.0163 -0.0067 636 PRO 81 CA 0.0145 0.0167 -0.0069 637 PRO 81 C 0.0125 0.0136 -0.0113 638 PRO 81 O 0.0126 0.0128 -0.0116 639 PRO 81 CB 0.0122 0.0224 -0.0062 640 PRO 81 CG 0.0102 0.0242 -0.0075 641 PRO 81 CD 0.0125 0.0211 -0.0066 642 VAL 82 N 0.0153 0.0125 -0.0100 643 VAL 82 CA 0.0132 0.0104 -0.0108 644 VAL 82 C 0.0118 0.0093 -0.0113 645 VAL 82 O 0.0114 0.0111 -0.0115 646 VAL 82 CB 0.0111 0.0120 -0.0115 647 VAL 82 CG1 0.0084 0.0105 -0.0125 648 VAL 82 CG2 0.0123 0.0123 -0.0111 649 ASN 83 N 0.0076 0.0076 -0.0124 650 ASN 83 CA 0.0077 0.0070 -0.0128 651 ASN 83 C 0.0074 0.0073 -0.0134 652 ASN 83 O 0.0072 0.0076 -0.0137 653 ASN 83 CB 0.0078 0.0066 -0.0131 654 ASN 83 CG 0.0081 0.0063 -0.0126 655 ASN 83 OD1 0.0083 0.0061 -0.0121 656 ASN 83 ND2 0.0080 0.0063 -0.0127 657 ILE 84 N 0.0058 0.0045 -0.0131 658 ILE 84 N 0.0058 0.0044 -0.0130 659 ILE 84 CA 0.0053 0.0049 -0.0142 660 ILE 84 CA 0.0053 0.0048 -0.0142 661 ILE 84 C 0.0043 0.0041 -0.0148 662 ILE 84 C 0.0043 0.0039 -0.0147 663 ILE 84 O 0.0039 0.0036 -0.0148 664 ILE 84 O 0.0039 0.0033 -0.0146 665 ILE 84 CB 0.0057 0.0060 -0.0149 666 ILE 84 CB 0.0055 0.0056 -0.0148 667 ILE 84 CG1 0.0055 0.0059 -0.0150 668 ILE 84 CG1 0.0065 0.0067 -0.0145 669 ILE 84 CG2 0.0067 0.0069 -0.0144 670 ILE 84 CG2 0.0048 0.0059 -0.0161 671 ILE 84 CD1 0.0058 0.0069 -0.0157 672 ILE 84 CD1 0.0068 0.0073 -0.0147 673 ILE 85 N 0.0010 0.0012 -0.0132 674 ILE 85 CA 0.0004 0.0019 -0.0125 675 ILE 85 C 0.0006 0.0017 -0.0125 676 ILE 85 O 0.0012 0.0009 -0.0121 677 ILE 85 CB 0.0005 0.0019 -0.0111 678 ILE 85 CG1 0.0004 0.0020 -0.0110 679 ILE 85 CG2 -0.0002 0.0027 -0.0103 680 ILE 85 CD1 -0.0004 0.0028 -0.0117 681 GLY 86 N 0.0018 -0.0021 -0.0125 682 GLY 86 CA 0.0019 -0.0021 -0.0132 683 GLY 86 C 0.0017 -0.0022 -0.0134 684 GLY 86 O 0.0015 -0.0023 -0.0130 685 ARG 87 N -0.0005 -0.0089 -0.0094 686 ARG 87 CA 0.0017 -0.0086 -0.0086 687 ARG 87 C 0.0051 -0.0076 -0.0091 688 ARG 87 O 0.0068 -0.0069 -0.0098 689 ARG 87 CB 0.0014 -0.0099 -0.0053 690 ARG 87 CG -0.0019 -0.0110 -0.0046 691 ARG 87 CD -0.0018 -0.0121 -0.0014 692 ARG 87 NE -0.0011 -0.0127 0.0009 693 ARG 87 CZ 0.0017 -0.0126 0.0024 694 ARG 87 NH1 0.0041 -0.0118 0.0021 695 ARG 87 NH2 0.0020 -0.0132 0.0043 696 ASN 88 N -0.0020 -0.0066 -0.0152 697 ASN 88 CA -0.0051 -0.0059 -0.0146 698 ASN 88 C -0.0059 -0.0067 -0.0113 699 ASN 88 O -0.0086 -0.0063 -0.0101 700 ASN 88 CB -0.0059 -0.0050 -0.0166 701 ASN 88 CG -0.0047 -0.0058 -0.0154 702 ASN 88 OD1 -0.0020 -0.0067 -0.0151 703 ASN 88 ND2 -0.0067 -0.0054 -0.0147 704 LEU 89 N -0.0067 -0.0042 -0.0136 705 LEU 89 CA -0.0069 -0.0031 -0.0112 706 LEU 89 C -0.0045 -0.0029 -0.0100 707 LEU 89 O -0.0046 -0.0021 -0.0083 708 LEU 89 CB -0.0076 -0.0025 -0.0101 709 LEU 89 CG -0.0101 -0.0025 -0.0108 710 LEU 89 CD1 -0.0107 -0.0019 -0.0097 711 LEU 89 CD2 -0.0120 -0.0020 -0.0104 712 LEU 90 N -0.0029 -0.0037 -0.0083 713 LEU 90 CA -0.0020 -0.0037 -0.0080 714 LEU 90 C -0.0016 -0.0036 -0.0078 715 LEU 90 O -0.0011 -0.0032 -0.0073 716 LEU 90 CB -0.0014 -0.0043 -0.0084 717 LEU 90 CG -0.0016 -0.0043 -0.0085 718 LEU 90 CD1 -0.0010 -0.0050 -0.0089 719 LEU 90 CD2 -0.0015 -0.0036 -0.0079 720 THR 91 N -0.0008 -0.0077 -0.0064 721 THR 91 CA 0.0027 -0.0077 -0.0057 722 THR 91 C 0.0036 -0.0043 -0.0059 723 THR 91 O 0.0065 -0.0030 -0.0056 724 THR 91 CB 0.0032 -0.0108 -0.0052 725 THR 91 OG1 0.0008 -0.0107 -0.0057 726 THR 91 CG2 0.0030 -0.0141 -0.0048 727 GLN 92 N -0.0024 -0.0030 -0.0071 728 GLN 92 CA -0.0045 -0.0007 -0.0047 729 GLN 92 C -0.0022 0.0029 -0.0015 730 GLN 92 O -0.0025 0.0048 0.0004 731 GLN 92 CB -0.0097 -0.0007 -0.0041 732 GLN 92 CG -0.0118 -0.0042 -0.0072 733 GLN 92 CD -0.0168 -0.0047 -0.0070 734 GLN 92 OE1 -0.0186 -0.0075 -0.0095 735 GLN 92 NE2 -0.0192 -0.0020 -0.0042 736 ILE 93 N -0.0064 0.0040 -0.0016 737 ILE 93 CA -0.0052 0.0051 0.0001 738 ILE 93 C -0.0024 0.0039 0.0014 739 ILE 93 O -0.0011 0.0044 0.0028 740 ILE 93 CB -0.0060 0.0051 -0.0006 741 ILE 93 CG1 -0.0051 0.0025 -0.0018 742 ILE 93 CG2 -0.0088 0.0063 -0.0018 743 ILE 93 CD1 -0.0057 0.0023 -0.0024 744 GLY 94 N 0.0009 -0.0030 -0.0032 745 GLY 94 CA -0.0002 -0.0045 0.0003 746 GLY 94 C -0.0034 -0.0081 0.0004 747 GLY 94 O -0.0048 -0.0097 0.0017 748 CYS 95 N -0.0049 -0.0084 -0.0011 749 CYS 95 CA -0.0046 -0.0085 -0.0012 750 CYS 95 C -0.0030 -0.0106 -0.0019 751 CYS 95 O -0.0035 -0.0127 -0.0025 752 CYS 95 CB -0.0072 -0.0088 -0.0012 753 CYS 95 SG -0.0070 -0.0083 -0.0010 754 THR 96 N -0.0072 -0.0156 0.0001 755 THR 96 CA -0.0077 -0.0141 -0.0008 756 THR 96 C -0.0084 -0.0112 -0.0000 757 THR 96 O -0.0087 -0.0101 0.0003 758 THR 96 CB -0.0078 -0.0143 -0.0039 759 THR 96 OG1 -0.0082 -0.0132 -0.0053 760 THR 96 CG2 -0.0070 -0.0172 -0.0048 761 LEU 97 N -0.0098 -0.0080 -0.0014 762 LEU 97 CA -0.0097 -0.0055 -0.0013 763 LEU 97 C -0.0106 -0.0045 -0.0037 764 LEU 97 O -0.0113 -0.0051 -0.0052 765 LEU 97 CB -0.0093 -0.0041 -0.0002 766 LEU 97 CG -0.0083 -0.0038 0.0023 767 LEU 97 CD1 -0.0081 -0.0026 0.0028 768 LEU 97 CD2 -0.0079 -0.0023 0.0033 769 ASN 98 N -0.0115 -0.0012 -0.0021 770 ASN 98 CA -0.0125 0.0001 -0.0053 771 ASN 98 C -0.0120 0.0040 -0.0052 772 ASN 98 O -0.0111 0.0050 -0.0030 773 ASN 98 CB -0.0131 -0.0017 -0.0061 774 ASN 98 CG -0.0132 -0.0056 -0.0054 775 ASN 98 OD1 -0.0124 -0.0069 -0.0028 776 ASN 98 ND2 -0.0143 -0.0075 -0.0078 777 PHE 99 N -0.0110 0.0056 -0.0048 778 PHE 99 CA -0.0116 0.0086 -0.0050 779 PHE 99 C -0.0140 0.0102 -0.0074 780 PHE 99 O -0.0150 0.0126 -0.0081 781 PHE 99 CB -0.0100 0.0112 -0.0026 782 PHE 99 CG -0.0101 0.0128 -0.0023 783 PHE 99 CD1 -0.0089 0.0112 -0.0013 784 PHE 99 CD2 -0.0113 0.0159 -0.0032 785 PHE 99 CE1 -0.0090 0.0127 -0.0011 786 PHE 99 CE2 -0.0114 0.0174 -0.0030 787 PHE 99 CZ -0.0102 0.0158 -0.0019 788 PHE 99 OXT -0.0150 0.0091 -0.0087 789 PRO 1 N -0.0239 0.0083 -0.0140 790 PRO 1 CA -0.0232 0.0039 -0.0159 791 PRO 1 C -0.0207 0.0003 -0.0137 792 PRO 1 O -0.0196 0.0014 -0.0108 793 PRO 1 CB -0.0229 0.0040 -0.0153 794 PRO 1 CG -0.0218 0.0069 -0.0112 795 PRO 1 CD -0.0230 0.0104 -0.0109 796 GLN 2 N -0.0221 -0.0035 -0.0182 797 GLN 2 CA -0.0198 -0.0067 -0.0162 798 GLN 2 C -0.0178 -0.0085 -0.0129 799 GLN 2 O -0.0176 -0.0093 -0.0138 800 GLN 2 CB -0.0190 -0.0102 -0.0199 801 GLN 2 CG -0.0168 -0.0133 -0.0181 802 GLN 2 CD -0.0155 -0.0176 -0.0210 803 GLN 2 OE1 -0.0142 -0.0200 -0.0210 804 GLN 2 NE2 -0.0157 -0.0186 -0.0235 805 ILE 3 N -0.0138 -0.0089 -0.0092 806 ILE 3 CA -0.0122 -0.0097 -0.0063 807 ILE 3 C -0.0100 -0.0130 -0.0051 808 ILE 3 O -0.0095 -0.0131 -0.0040 809 ILE 3 CB -0.0125 -0.0067 -0.0031 810 ILE 3 CG1 -0.0146 -0.0033 -0.0042 811 ILE 3 CG2 -0.0108 -0.0074 0.0001 812 ILE 3 CD1 -0.0153 -0.0000 -0.0018 813 THR 4 N -0.0081 -0.0162 -0.0090 814 THR 4 CA -0.0039 -0.0189 -0.0081 815 THR 4 C -0.0028 -0.0182 -0.0027 816 THR 4 O -0.0049 -0.0158 0.0004 817 THR 4 CB -0.0005 -0.0216 -0.0090 818 THR 4 OG1 -0.0012 -0.0204 -0.0067 819 THR 4 CG2 -0.0005 -0.0232 -0.0146 820 LEU 5 N 0.0023 -0.0134 -0.0034 821 LEU 5 CA 0.0018 -0.0135 -0.0004 822 LEU 5 C 0.0047 -0.0152 0.0018 823 LEU 5 O 0.0049 -0.0156 0.0039 824 LEU 5 CB 0.0005 -0.0127 -0.0016 825 LEU 5 CG -0.0029 -0.0108 -0.0029 826 LEU 5 CD1 -0.0036 -0.0102 -0.0051 827 LEU 5 CD2 -0.0053 -0.0099 0.0002 828 TRP 6 N 0.0157 -0.0211 0.0015 829 TRP 6 CA 0.0208 -0.0236 0.0054 830 TRP 6 C 0.0201 -0.0206 0.0125 831 TRP 6 O 0.0241 -0.0221 0.0172 832 TRP 6 CB 0.0222 -0.0259 0.0018 833 TRP 6 CG 0.0230 -0.0289 -0.0051 834 TRP 6 CD1 0.0192 -0.0280 -0.0109 835 TRP 6 CD2 0.0279 -0.0333 -0.0068 836 TRP 6 NE1 0.0214 -0.0315 -0.0162 837 TRP 6 CE2 0.0268 -0.0348 -0.0138 838 TRP 6 CE3 0.0332 -0.0360 -0.0030 839 TRP 6 CZ2 0.0307 -0.0390 -0.0172 840 TRP 6 CZ3 0.0371 -0.0402 -0.0064 841 TRP 6 CH2 0.0359 -0.0417 -0.0134 842 GLN 7 N 0.0171 -0.0164 0.0079 843 GLN 7 CA 0.0124 -0.0149 0.0205 844 GLN 7 CA 0.0124 -0.0149 0.0204 845 GLN 7 C 0.0001 -0.0136 0.0185 846 GLN 7 O -0.0057 -0.0138 0.0080 847 GLN 7 CB 0.0103 -0.0139 0.0291 848 GLN 7 CB 0.0098 -0.0139 0.0289 849 GLN 7 CG 0.0021 -0.0135 0.0229 850 GLN 7 CG 0.0217 -0.0149 0.0327 851 GLN 7 CD 0.0027 -0.0129 0.0300 852 GLN 7 CD 0.0191 -0.0138 0.0431 853 GLN 7 OE1 0.0120 -0.0135 0.0369 854 GLN 7 OE1 0.0087 -0.0127 0.0416 855 GLN 7 NE2 -0.0072 -0.0119 0.0282 856 GLN 7 NE2 0.0286 -0.0141 0.0529 857 ARG 8 N -0.0001 -0.0125 0.0162 858 ARG 8 CA -0.0023 -0.0139 0.0154 859 ARG 8 C -0.0036 -0.0149 0.0163 860 ARG 8 O -0.0033 -0.0149 0.0184 861 ARG 8 CB -0.0029 -0.0145 0.0165 862 ARG 8 CG -0.0023 -0.0138 0.0151 863 ARG 8 CD -0.0029 -0.0144 0.0164 864 ARG 8 NE -0.0033 -0.0145 0.0149 865 ARG 8 CZ -0.0022 -0.0137 0.0149 866 ARG 8 NH1 -0.0005 -0.0128 0.0165 867 ARG 8 NH2 -0.0027 -0.0138 0.0134 868 PRO 9 N -0.0053 -0.0074 0.0117 869 PRO 9 CA -0.0081 -0.0061 0.0098 870 PRO 9 C -0.0103 -0.0039 0.0121 871 PRO 9 O -0.0122 -0.0026 0.0121 872 PRO 9 CB -0.0087 -0.0065 0.0073 873 PRO 9 CG -0.0074 -0.0068 0.0090 874 PRO 9 CD -0.0046 -0.0079 0.0112 875 LEU 10 N -0.0108 -0.0002 0.0158 876 LEU 10 CA -0.0119 0.0018 0.0173 877 LEU 10 C -0.0152 0.0019 0.0174 878 LEU 10 O -0.0165 0.0016 0.0171 879 LEU 10 CB -0.0107 0.0041 0.0191 880 LEU 10 CG -0.0074 0.0046 0.0194 881 LEU 10 CD1 -0.0063 0.0066 0.0210 882 LEU 10 CD2 -0.0069 0.0050 0.0198 883 VAL 11 N -0.0133 0.0068 0.0157 884 VAL 11 CA -0.0151 0.0075 0.0150 885 VAL 11 C -0.0155 0.0095 0.0158 886 VAL 11 O -0.0144 0.0102 0.0168 887 VAL 11 CB -0.0159 0.0066 0.0141 888 VAL 11 CG1 -0.0157 0.0046 0.0132 889 VAL 11 CG2 -0.0149 0.0069 0.0148 890 THR 12 N -0.0100 0.0143 0.0190 891 THR 12 CA -0.0109 0.0134 0.0199 892 THR 12 C -0.0118 0.0096 0.0187 893 THR 12 O -0.0128 0.0074 0.0189 894 THR 12 CB -0.0127 0.0142 0.0236 895 THR 12 OG1 -0.0118 0.0177 0.0246 896 THR 12 CG2 -0.0136 0.0134 0.0247 897 ILE 13 N -0.0072 0.0103 0.0166 898 ILE 13 CA -0.0069 0.0059 0.0157 899 ILE 13 C -0.0067 0.0032 0.0161 900 ILE 13 O -0.0068 0.0047 0.0157 901 ILE 13 CB -0.0067 0.0054 0.0112 902 ILE 13 CG1 -0.0066 0.0063 0.0076 903 ILE 13 CG2 -0.0069 0.0083 0.0107 904 ILE 13 CD1 -0.0064 0.0052 0.0030 905 LYS 14 N 0.0038 0.0178 0.0175 906 LYS 14 CA 0.0018 0.0002 0.0214 907 LYS 14 C -0.0034 -0.0151 0.0065 908 LYS 14 O -0.0044 -0.0194 0.0050 909 LYS 14 CB 0.0049 -0.0073 0.0431 910 LYS 14 CG 0.0031 -0.0250 0.0481 911 LYS 14 CD 0.0059 -0.0335 0.0690 912 LYS 14 CE 0.0040 -0.0510 0.0730 913 LYS 14 NZ 0.0068 -0.0590 0.0935 914 ILE 15 N 0.0053 -0.0126 0.0052 915 ILE 15 CA 0.0046 -0.0163 0.0008 916 ILE 15 C 0.0049 -0.0227 -0.0037 917 ILE 15 O 0.0032 -0.0224 -0.0064 918 ILE 15 CB 0.0000 -0.0115 -0.0033 919 ILE 15 CG1 -0.0003 -0.0155 -0.0071 920 ILE 15 CG2 -0.0039 -0.0088 -0.0080 921 ILE 15 CD1 -0.0046 -0.0112 -0.0111 922 GLY 16 N 0.0123 -0.0239 -0.0051 923 GLY 16 CA 0.0145 -0.0332 -0.0119 924 GLY 16 C 0.0183 -0.0386 -0.0146 925 GLY 16 O 0.0157 -0.0449 -0.0216 926 GLY 17 N 0.0245 -0.0573 0.0017 927 GLY 17 CA 0.0350 -0.0657 0.0086 928 GLY 17 C 0.0204 -0.0486 0.0031 929 GLY 17 O 0.0276 -0.0548 0.0074 930 GLN 18 N 0.0148 -0.0336 -0.0002 931 GLN 18 CA 0.0063 -0.0260 -0.0049 932 GLN 18 C 0.0009 -0.0177 0.0038 933 GLN 18 O 0.0019 -0.0169 0.0103 934 GLN 18 CB 0.0025 -0.0253 -0.0158 935 GLN 18 CG 0.0074 -0.0332 -0.0252 936 GLN 18 CD 0.0040 -0.0325 -0.0353 937 GLN 18 OE1 -0.0032 -0.0266 -0.0407 938 GLN 18 NE2 0.0090 -0.0386 -0.0380 939 LEU 19 N -0.0048 -0.0007 0.0119 940 LEU 19 CA -0.0088 0.0089 0.0189 941 LEU 19 C -0.0084 0.0206 0.0074 942 LEU 19 O -0.0083 0.0286 0.0002 943 LEU 19 CB -0.0141 0.0174 0.0317 944 LEU 19 CG -0.0150 0.0074 0.0434 945 LEU 19 CD1 -0.0204 0.0173 0.0553 946 LEU 19 CD2 -0.0139 -0.0051 0.0501 947 LYS 20 N -0.0076 0.0033 0.0122 948 LYS 20 CA -0.0098 0.0090 0.0068 949 LYS 20 C -0.0119 0.0145 0.0114 950 LYS 20 O -0.0114 0.0133 0.0183 951 LYS 20 CB -0.0083 0.0052 0.0002 952 LYS 20 CG -0.0063 0.0000 -0.0053 953 LYS 20 CD -0.0048 -0.0039 -0.0111 954 LYS 20 CE -0.0029 -0.0089 -0.0169 955 LYS 20 NZ -0.0047 -0.0040 -0.0222 956 GLU 21 N -0.0129 0.0134 0.0128 957 GLU 21 CA -0.0135 0.0137 0.0135 958 GLU 21 C -0.0099 0.0106 0.0094 959 GLU 21 O -0.0066 0.0115 0.0054 960 GLU 21 CB -0.0137 0.0204 0.0133 961 GLU 21 CG -0.0173 0.0240 0.0175 962 GLU 21 CD -0.0204 0.0244 0.0211 963 GLU 21 OE1 -0.0202 0.0204 0.0212 964 GLU 21 OE2 -0.0228 0.0288 0.0238 965 ALA 22 N -0.0091 0.0074 0.0131 966 ALA 22 CA -0.0070 0.0052 0.0113 967 ALA 22 C -0.0076 0.0046 0.0120 968 ALA 22 O -0.0099 0.0045 0.0144 969 ALA 22 CB -0.0063 0.0014 0.0112 970 LEU 23 N -0.0055 -0.0007 0.0067 971 LEU 23 CA -0.0056 -0.0012 0.0068 972 LEU 23 C -0.0056 -0.0016 0.0069 973 LEU 23 O -0.0052 -0.0016 0.0070 974 LEU 23 CB -0.0052 -0.0012 0.0069 975 LEU 23 CG -0.0052 -0.0016 0.0070 976 LEU 23 CD1 -0.0057 -0.0016 0.0069 977 LEU 23 CD2 -0.0047 -0.0016 0.0071 978 LEU 24 N -0.0077 0.0011 0.0078 979 LEU 24 CA -0.0079 0.0005 0.0071 980 LEU 24 C -0.0069 -0.0002 0.0070 981 LEU 24 O -0.0064 -0.0007 0.0068 982 LEU 24 CB -0.0087 0.0000 0.0064 983 LEU 24 CG -0.0097 0.0006 0.0064 984 LEU 24 CD1 -0.0102 0.0000 0.0057 985 LEU 24 CD2 -0.0104 0.0011 0.0066 986 ASP 25 N -0.0033 -0.0028 0.0020 987 ASP 25 CA -0.0034 -0.0024 0.0013 988 ASP 25 C -0.0035 -0.0026 0.0008 989 ASP 25 O -0.0037 -0.0032 0.0004 990 ASP 25 CB -0.0035 -0.0026 0.0008 991 ASP 25 CG -0.0035 -0.0022 0.0001 992 ASP 25 OD1 -0.0034 -0.0019 -0.0001 993 ASP 25 OD2 -0.0035 -0.0023 -0.0003 994 THR 26 N -0.0028 -0.0003 0.0008 995 THR 26 CA -0.0027 -0.0005 0.0007 996 THR 26 C -0.0024 -0.0006 0.0007 997 THR 26 O -0.0024 -0.0008 0.0006 998 THR 26 CB -0.0028 -0.0007 0.0006 999 THR 26 OG1 -0.0027 -0.0007 0.0006 1000 THR 26 CG2 -0.0031 -0.0007 0.0006 1001 GLY 27 N -0.0024 -0.0003 -0.0016 1002 GLY 27 CA -0.0024 -0.0003 -0.0018 1003 GLY 27 C -0.0040 -0.0004 -0.0009 1004 GLY 27 O -0.0043 -0.0004 -0.0010 1005 ALA 28 N -0.0035 0.0007 0.0005 1006 ALA 28 CA -0.0037 -0.0003 0.0002 1007 ALA 28 C -0.0029 0.0005 0.0005 1008 ALA 28 O -0.0014 0.0007 0.0008 1009 ALA 28 CB -0.0030 -0.0020 -0.0003 1010 ASP 29 N -0.0041 0.0010 0.0017 1011 ASP 29 CA -0.0024 0.0020 0.0025 1012 ASP 29 C -0.0002 0.0004 0.0014 1013 ASP 29 O 0.0021 0.0011 0.0019 1014 ASP 29 CB -0.0041 0.0026 0.0028 1015 ASP 29 CG -0.0061 0.0044 0.0041 1016 ASP 29 OD1 -0.0060 0.0055 0.0048 1017 ASP 29 OD2 -0.0078 0.0047 0.0042 1018 ASP 30 N 0.0011 -0.0051 -0.0016 1019 ASP 30 N 0.0011 -0.0052 -0.0016 1020 ASP 30 CA 0.0013 -0.0046 -0.0020 1021 ASP 30 CA 0.0012 -0.0047 -0.0019 1022 ASP 30 C 0.0004 -0.0037 -0.0023 1023 ASP 30 C 0.0006 -0.0036 -0.0024 1024 ASP 30 O -0.0001 -0.0032 -0.0024 1025 ASP 30 O 0.0004 -0.0031 -0.0027 1026 ASP 30 CB 0.0024 -0.0043 -0.0026 1027 ASP 30 CB 0.0024 -0.0048 -0.0023 1028 ASP 30 CG 0.0033 -0.0051 -0.0024 1029 ASP 30 CG 0.0030 -0.0058 -0.0018 1030 ASP 30 OD1 0.0033 -0.0060 -0.0018 1031 ASP 30 OD1 0.0026 -0.0065 -0.0013 1032 ASP 30 OD2 0.0042 -0.0048 -0.0028 1033 ASP 30 OD2 0.0040 -0.0061 -0.0020 1034 THR 31 N 0.0017 -0.0034 -0.0033 1035 THR 31 CA 0.0015 -0.0036 -0.0041 1036 THR 31 C 0.0015 -0.0037 -0.0047 1037 THR 31 O 0.0020 -0.0035 -0.0047 1038 THR 31 CB 0.0021 -0.0035 -0.0044 1039 THR 31 OG1 0.0020 -0.0034 -0.0039 1040 THR 31 CG2 0.0020 -0.0036 -0.0054 1041 VAL 32 N 0.0028 -0.0072 -0.0035 1042 VAL 32 CA 0.0030 -0.0070 -0.0035 1043 VAL 32 C 0.0026 -0.0070 -0.0044 1044 VAL 32 O 0.0021 -0.0077 -0.0047 1045 VAL 32 CB 0.0029 -0.0076 -0.0027 1046 VAL 32 CG1 0.0034 -0.0071 -0.0025 1047 VAL 32 CG2 0.0030 -0.0079 -0.0018 1048 LEU 33 N 0.0038 -0.0087 -0.0060 1049 LEU 33 CA 0.0036 -0.0089 -0.0071 1050 LEU 33 C 0.0032 -0.0091 -0.0081 1051 LEU 33 O 0.0037 -0.0091 -0.0082 1052 LEU 33 CB 0.0047 -0.0090 -0.0075 1053 LEU 33 CG 0.0052 -0.0088 -0.0066 1054 LEU 33 CD1 0.0063 -0.0089 -0.0072 1055 LEU 33 CD2 0.0042 -0.0087 -0.0062 1056 GLU 34 N 0.0038 -0.0107 -0.0068 1057 GLU 34 CA 0.0029 -0.0113 -0.0101 1058 GLU 34 C 0.0050 -0.0140 -0.0114 1059 GLU 34 O 0.0071 -0.0154 -0.0096 1060 GLU 34 CB 0.0013 -0.0099 -0.0106 1061 GLU 34 CG -0.0008 -0.0072 -0.0092 1062 GLU 34 CD -0.0023 -0.0058 -0.0098 1063 GLU 34 OE1 -0.0031 -0.0062 -0.0125 1064 GLU 34 OE2 -0.0027 -0.0044 -0.0075 1065 GLU 35 N 0.0043 -0.0232 -0.0093 1066 GLU 35 CA 0.0045 -0.0231 -0.0094 1067 GLU 35 C 0.0072 -0.0233 -0.0115 1068 GLU 35 O 0.0085 -0.0253 -0.0129 1069 GLU 35 CB 0.0027 -0.0257 -0.0086 1070 GLU 35 CG 0.0021 -0.0251 -0.0080 1071 GLU 35 CD 0.0010 -0.0219 -0.0066 1072 GLU 35 OE1 -0.0007 -0.0212 -0.0051 1073 GLU 35 OE2 0.0020 -0.0201 -0.0070 1074 MET 36 N 0.0053 -0.0223 -0.0102 1075 MET 36 CA 0.0060 -0.0216 -0.0117 1076 MET 36 C 0.0060 -0.0198 -0.0112 1077 MET 36 O 0.0056 -0.0190 -0.0100 1078 MET 36 CB 0.0065 -0.0215 -0.0131 1079 MET 36 CG 0.0065 -0.0203 -0.0127 1080 MET 36 SD 0.0072 -0.0201 -0.0145 1081 MET 36 CE 0.0079 -0.0192 -0.0159 1082 ASN 37 N 0.0066 -0.0262 -0.0097 1083 ASN 37 CA 0.0065 -0.0244 -0.0096 1084 ASN 37 C 0.0087 -0.0207 -0.0104 1085 ASN 37 O 0.0120 -0.0209 -0.0119 1086 ASN 37 CB 0.0079 -0.0271 -0.0103 1087 ASN 37 CG 0.0050 -0.0297 -0.0091 1088 ASN 37 OD1 0.0021 -0.0301 -0.0078 1089 ASN 37 ND2 0.0059 -0.0317 -0.0096 1090 LEU 38 N 0.0009 -0.0130 -0.0045 1091 LEU 38 CA 0.0020 -0.0069 -0.0083 1092 LEU 38 C 0.0004 -0.0008 -0.0063 1093 LEU 38 O -0.0025 0.0002 -0.0007 1094 LEU 38 CB 0.0014 -0.0054 -0.0073 1095 LEU 38 CG 0.0038 -0.0099 -0.0113 1096 LEU 38 CD1 0.0031 -0.0077 -0.0103 1097 LEU 38 CD2 0.0072 -0.0094 -0.0183 1098 PRO 39 N 0.0023 -0.0074 -0.0086 1099 PRO 39 CA -0.0054 -0.0039 -0.0059 1100 PRO 39 C -0.0145 0.0149 -0.0055 1101 PRO 39 O -0.0097 0.0268 -0.0100 1102 PRO 39 CB 0.0097 -0.0055 -0.0123 1103 PRO 39 CG 0.0250 -0.0030 -0.0196 1104 PRO 39 CD 0.0206 -0.0056 -0.0172 1105 GLY 40 N -0.0900 0.0693 0.0195 1106 GLY 40 CA -0.0858 0.0567 0.0167 1107 GLY 40 C -0.0676 0.0515 0.0161 1108 GLY 40 O -0.0564 0.0599 0.0185 1109 ARG 41 N -0.0128 0.0049 0.0091 1110 ARG 41 CA -0.0274 0.0112 -0.0008 1111 ARG 41 C -0.0477 0.0350 0.0048 1112 ARG 41 O -0.0458 0.0492 0.0254 1113 ARG 41 CB -0.0150 0.0076 0.0099 1114 ARG 41 CG 0.0039 -0.0159 0.0030 1115 ARG 41 CD -0.0047 -0.0266 -0.0213 1116 ARG 41 NE 0.0118 -0.0503 -0.0313 1117 ARG 41 CZ 0.0176 -0.0636 -0.0413 1118 ARG 41 NH1 0.0083 -0.0557 -0.0426 1119 ARG 41 NH2 0.0327 -0.0849 -0.0499 1120 TRP 42 N -0.0347 0.0359 0.0007 1121 TRP 42 CA -0.0246 0.0256 -0.0012 1122 TRP 42 C -0.0196 0.0244 0.0041 1123 TRP 42 O -0.0230 0.0318 0.0108 1124 TRP 42 CB -0.0168 0.0221 0.0043 1125 TRP 42 CG -0.0151 0.0288 0.0173 1126 TRP 42 CD1 -0.0213 0.0371 0.0217 1127 TRP 42 CD2 -0.0066 0.0278 0.0277 1128 TRP 42 NE1 -0.0172 0.0414 0.0342 1129 TRP 42 CE2 -0.0082 0.0358 0.0382 1130 TRP 42 CE3 0.0022 0.0209 0.0293 1131 TRP 42 CZ2 -0.0013 0.0372 0.0501 1132 TRP 42 CZ3 0.0091 0.0222 0.0412 1133 TRP 42 CH2 0.0073 0.0303 0.0514 1134 LYS 43 N -0.0177 0.0233 0.0055 1135 LYS 43 CA -0.0122 0.0211 0.0108 1136 LYS 43 C 0.0084 0.0089 0.0178 1137 LYS 43 O 0.0184 -0.0008 0.0087 1138 LYS 43 CB -0.0175 0.0191 -0.0085 1139 LYS 43 CG -0.0378 0.0308 -0.0169 1140 LYS 43 CD -0.0472 0.0411 -0.0038 1141 LYS 43 CE -0.0676 0.0530 -0.0118 1142 LYS 43 NZ -0.0771 0.0596 -0.0117 1143 PRO 44 N 0.0202 0.0102 0.0176 1144 PRO 44 CA 0.0345 0.0038 0.0216 1145 PRO 44 C 0.0399 -0.0078 0.0111 1146 PRO 44 O 0.0357 -0.0101 0.0045 1147 PRO 44 CB 0.0405 0.0086 0.0331 1148 PRO 44 CG 0.0291 0.0189 0.0367 1149 PRO 44 CD 0.0173 0.0176 0.0249 1150 LYS 45 N 0.0368 -0.0101 0.0110 1151 LYS 45 CA 0.0376 -0.0134 0.0097 1152 LYS 45 C 0.0398 -0.0147 0.0104 1153 LYS 45 O 0.0400 -0.0133 0.0114 1154 LYS 45 CB 0.0349 -0.0145 0.0072 1155 LYS 45 CG 0.0348 -0.0173 0.0056 1156 LYS 45 CD 0.0331 -0.0190 0.0034 1157 LYS 45 CE 0.0336 -0.0222 0.0019 1158 LYS 45 NZ 0.0324 -0.0241 -0.0000 1159 MET 46 N 0.0508 -0.0188 0.0207 1160 MET 46 CA 0.0402 -0.0181 0.0197 1161 MET 46 C 0.0310 -0.0228 0.0290 1162 MET 46 O 0.0346 -0.0277 0.0385 1163 MET 46 CB 0.0445 -0.0178 0.0189 1164 MET 46 CG 0.0505 -0.0122 0.0079 1165 MET 46 SD 0.0515 -0.0108 0.0051 1166 MET 46 CE 0.0679 -0.0118 0.0065 1167 ILE 47 N 0.0203 -0.0049 0.0201 1168 ILE 47 CA 0.0159 -0.0051 0.0251 1169 ILE 47 C 0.0076 -0.0062 0.0247 1170 ILE 47 O 0.0048 -0.0070 0.0188 1171 ILE 47 CB 0.0166 -0.0052 0.0232 1172 ILE 47 CG1 0.0145 -0.0061 0.0149 1173 ILE 47 CG2 0.0246 -0.0040 0.0251 1174 ILE 47 CD1 0.0126 -0.0064 0.0134 1175 GLY 48 N 0.0015 0.0171 0.0198 1176 GLY 48 CA -0.0045 0.0148 0.0208 1177 GLY 48 C -0.0009 0.0149 0.0198 1178 GLY 48 O 0.0046 0.0201 0.0200 1179 GLY 49 N -0.0054 0.0104 0.0124 1180 GLY 49 CA -0.0002 0.0122 0.0118 1181 GLY 49 C -0.0006 0.0128 0.0115 1182 GLY 49 O -0.0051 0.0136 0.0106 1183 ILE 50 N 0.0072 0.0123 -0.0018 1184 ILE 50 CA 0.0076 0.0104 -0.0008 1185 ILE 50 C 0.0048 0.0055 0.0032 1186 ILE 50 O 0.0060 0.0022 0.0048 1187 ILE 50 CB 0.0140 0.0092 -0.0022 1188 ILE 50 CG1 0.0153 0.0122 -0.0045 1189 ILE 50 CG2 0.0161 0.0034 0.0006 1190 ILE 50 CD1 0.0216 0.0121 -0.0066 1191 GLY 51 N 0.0041 0.0085 0.0027 1192 GLY 51 CA -0.0010 -0.0000 0.0085 1193 GLY 51 C -0.0129 -0.0037 0.0089 1194 GLY 51 O -0.0187 -0.0097 0.0125 1195 GLY 52 N -0.0196 0.0013 0.0139 1196 GLY 52 CA -0.0319 0.0000 0.0140 1197 GLY 52 C -0.0296 -0.0022 0.0152 1198 GLY 52 O -0.0196 0.0018 0.0137 1199 PHE 53 N -0.0385 -0.0057 0.0171 1200 PHE 53 CA -0.0250 -0.0064 0.0164 1201 PHE 53 CA -0.0249 -0.0063 0.0165 1202 PHE 53 C -0.0183 -0.0198 0.0081 1203 PHE 53 O -0.0264 -0.0294 0.0024 1204 PHE 53 CB -0.0288 -0.0020 0.0191 1205 PHE 53 CB -0.0279 -0.0007 0.0199 1206 PHE 53 CG -0.0369 -0.0120 0.0132 1207 PHE 53 CG -0.0292 0.0138 0.0289 1208 PHE 53 CD1 -0.0525 -0.0126 0.0131 1209 PHE 53 CD1 -0.0175 0.0214 0.0333 1210 PHE 53 CD2 -0.0289 -0.0209 0.0076 1211 PHE 53 CD2 -0.0421 0.0199 0.0328 1212 PHE 53 CE1 -0.0601 -0.0218 0.0076 1213 PHE 53 CE1 -0.0186 0.0348 0.0415 1214 PHE 53 CE2 -0.0363 -0.0302 0.0021 1215 PHE 53 CE2 -0.0432 0.0333 0.0410 1216 PHE 53 CZ -0.0520 -0.0306 0.0021 1217 PHE 53 CZ -0.0315 0.0407 0.0453 1218 ILE 54 N -0.0021 -0.0124 0.0063 1219 ILE 54 CA 0.0019 -0.0162 0.0005 1220 ILE 54 C 0.0092 -0.0169 0.0014 1221 ILE 54 O 0.0123 -0.0146 0.0067 1222 ILE 54 CB 0.0028 -0.0174 -0.0015 1223 ILE 54 CG1 0.0070 -0.0152 0.0039 1224 ILE 54 CG2 -0.0046 -0.0173 -0.0036 1225 ILE 54 CD1 0.0102 -0.0169 0.0017 1226 LYS 55 N -0.0052 0.0005 0.0001 1227 LYS 55 CA 0.0314 -0.0146 -0.0009 1228 LYS 55 C 0.0304 -0.0153 0.0035 1229 LYS 55 O 0.0106 -0.0029 -0.0137 1230 LYS 55 CB 0.0510 -0.0143 -0.0373 1231 LYS 55 CG 0.0609 -0.0172 -0.0425 1232 LYS 55 CD 0.0816 -0.0174 -0.0788 1233 LYS 55 CE 0.0564 0.0004 -0.1094 1234 LYS 55 NZ 0.0732 0.0013 -0.1431 1235 VAL 56 N 0.0303 -0.0115 0.0072 1236 VAL 56 CA 0.0283 -0.0108 0.0057 1237 VAL 56 C 0.0295 -0.0092 0.0055 1238 VAL 56 O 0.0317 -0.0092 0.0066 1239 VAL 56 CB 0.0262 -0.0132 0.0059 1240 VAL 56 CG1 0.0247 -0.0146 0.0058 1241 VAL 56 CG2 0.0274 -0.0149 0.0075 1242 ARG 57 N 0.0113 -0.0075 0.0113 1243 ARG 57 CA 0.0079 0.0005 0.0094 1244 ARG 57 C 0.0082 0.0024 0.0006 1245 ARG 57 O 0.0108 -0.0017 -0.0050 1246 ARG 57 CB 0.0069 0.0022 0.0105 1247 ARG 57 CG 0.0063 0.0011 0.0195 1248 ARG 57 CD 0.0059 0.0017 0.0201 1249 ARG 57 NE 0.0088 -0.0029 0.0141 1250 ARG 57 CZ 0.0088 -0.0023 0.0122 1251 ARG 57 NH1 0.0060 0.0026 0.0158 1252 ARG 57 NH2 0.0116 -0.0067 0.0067 1253 GLN 58 N 0.0062 0.0033 0.0006 1254 GLN 58 CA 0.0032 0.0018 -0.0076 1255 GLN 58 C -0.0035 0.0076 -0.0101 1256 GLN 58 O -0.0068 0.0129 -0.0073 1257 GLN 58 CB 0.0040 -0.0003 -0.0094 1258 GLN 58 CG 0.0011 -0.0023 -0.0180 1259 GLN 58 CD 0.0013 -0.0036 -0.0199 1260 GLN 58 OE1 0.0060 -0.0072 -0.0172 1261 GLN 58 NE2 -0.0038 -0.0008 -0.0246 1262 TYR 59 N -0.0056 0.0062 -0.0109 1263 TYR 59 CA -0.0087 0.0093 -0.0136 1264 TYR 59 C -0.0094 0.0095 -0.0197 1265 TYR 59 O -0.0068 0.0062 -0.0229 1266 TYR 59 CB -0.0076 0.0082 -0.0133 1267 TYR 59 CG -0.0074 0.0085 -0.0076 1268 TYR 59 CD1 -0.0105 0.0122 -0.0055 1269 TYR 59 CD2 -0.0040 0.0051 -0.0042 1270 TYR 59 CE1 -0.0102 0.0125 -0.0002 1271 TYR 59 CE2 -0.0037 0.0054 0.0010 1272 TYR 59 CZ -0.0068 0.0091 0.0030 1273 TYR 59 OH -0.0064 0.0093 0.0083 1274 ASP 60 N -0.0195 0.0060 -0.0178 1275 ASP 60 CA -0.0192 0.0092 -0.0241 1276 ASP 60 C -0.0180 0.0086 -0.0228 1277 ASP 60 O -0.0199 0.0058 -0.0173 1278 ASP 60 CB -0.0265 0.0115 -0.0283 1279 ASP 60 CG -0.0274 0.0125 -0.0302 1280 ASP 60 OD1 -0.0216 0.0133 -0.0319 1281 ASP 60 OD2 -0.0339 0.0124 -0.0299 1282 GLN 61 N -0.0075 0.0119 -0.0153 1283 GLN 61 CA 0.0015 0.0099 -0.0109 1284 GLN 61 C 0.0012 0.0063 -0.0185 1285 GLN 61 O 0.0096 0.0007 -0.0217 1286 GLN 61 CB 0.0129 0.0056 -0.0088 1287 GLN 61 CG 0.0126 0.0089 -0.0027 1288 GLN 61 CD 0.0212 0.0036 -0.0051 1289 GLN 61 OE1 0.0183 0.0019 -0.0112 1290 GLN 61 NE2 0.0320 0.0010 -0.0004 1291 ILE 62 N 0.0000 0.0051 -0.0126 1292 ILE 62 CA 0.0002 0.0043 -0.0132 1293 ILE 62 C 0.0009 0.0051 -0.0121 1294 ILE 62 O 0.0004 0.0063 -0.0113 1295 ILE 62 CB -0.0015 0.0043 -0.0142 1296 ILE 62 CG1 -0.0021 0.0034 -0.0153 1297 ILE 62 CG2 -0.0014 0.0038 -0.0145 1298 ILE 62 CD1 -0.0011 0.0019 -0.0161 1299 LEU 63 N 0.0035 0.0031 -0.0045 1300 LEU 63 CA 0.0050 0.0042 -0.0026 1301 LEU 63 C 0.0043 0.0052 -0.0028 1302 LEU 63 O 0.0039 0.0037 -0.0039 1303 LEU 63 CB 0.0072 0.0023 -0.0015 1304 LEU 63 CG 0.0089 0.0032 0.0004 1305 LEU 63 CD1 0.0094 0.0055 0.0018 1306 LEU 63 CD2 0.0108 0.0010 0.0012 1307 ILE 64 N 0.0008 0.0055 -0.0005 1308 ILE 64 CA -0.0007 0.0066 -0.0009 1309 ILE 64 C -0.0012 0.0070 0.0008 1310 ILE 64 O -0.0008 0.0068 0.0023 1311 ILE 64 CB -0.0020 0.0074 -0.0011 1312 ILE 64 CG1 -0.0017 0.0071 -0.0025 1313 ILE 64 CG2 -0.0035 0.0085 -0.0018 1314 ILE 64 CD1 -0.0032 0.0082 -0.0032 1315 GLU 65 N -0.0021 0.0109 0.0079 1316 GLU 65 CA -0.0006 0.0119 0.0089 1317 GLU 65 C -0.0022 0.0128 0.0088 1318 GLU 65 O -0.0033 0.0116 0.0079 1319 GLU 65 CB 0.0014 0.0103 0.0088 1320 GLU 65 CG 0.0034 0.0115 0.0099 1321 GLU 65 CD 0.0055 0.0098 0.0098 1322 GLU 65 OE1 0.0052 0.0079 0.0088 1323 GLU 65 OE2 0.0074 0.0105 0.0107 1324 ILE 66 N -0.0074 0.0138 0.0089 1325 ILE 66 CA -0.0071 0.0151 0.0085 1326 ILE 66 C -0.0080 0.0156 0.0098 1327 ILE 66 O -0.0084 0.0146 0.0105 1328 ILE 66 CB -0.0064 0.0145 0.0073 1329 ILE 66 CG1 -0.0056 0.0140 0.0060 1330 ILE 66 CG2 -0.0063 0.0158 0.0071 1331 ILE 66 CD1 -0.0051 0.0127 0.0051 1332 CYS 67 N -0.0088 0.0182 0.0094 1333 CYS 67 CA -0.0111 0.0171 0.0081 1334 CYS 67 C -0.0115 0.0176 0.0072 1335 CYS 67 O -0.0129 0.0161 0.0071 1336 CYS 67 CB -0.0120 0.0144 0.0094 1337 CYS 67 SG -0.0150 0.0130 0.0078 1338 GLY 68 N -0.0067 0.0163 0.0116 1339 GLY 68 CA -0.0053 0.0159 0.0125 1340 GLY 68 C -0.0059 0.0170 0.0119 1341 GLY 68 O -0.0047 0.0170 0.0125 1342 HIS 69 N -0.0078 0.0218 0.0062 1343 HIS 69 CA -0.0081 0.0211 0.0054 1344 HIS 69 C -0.0076 0.0227 0.0069 1345 HIS 69 O -0.0057 0.0229 0.0084 1346 HIS 69 CB -0.0065 0.0187 0.0048 1347 HIS 69 CG -0.0070 0.0169 0.0031 1348 HIS 69 ND1 -0.0068 0.0166 0.0030 1349 HIS 69 CD2 -0.0078 0.0153 0.0013 1350 HIS 69 CE1 -0.0074 0.0149 0.0013 1351 HIS 69 NE2 -0.0080 0.0141 0.0003 1352 LYS 70 N 0.0011 0.0176 0.0095 1353 LYS 70 CA 0.0011 0.0151 0.0071 1354 LYS 70 C 0.0004 0.0155 0.0058 1355 LYS 70 O 0.0007 0.0165 0.0075 1356 LYS 70 CB 0.0030 0.0120 0.0084 1357 LYS 70 CG 0.0037 0.0112 0.0092 1358 LYS 70 CD 0.0056 0.0081 0.0104 1359 LYS 70 CE 0.0066 0.0079 0.0126 1360 LYS 70 NZ 0.0057 0.0082 0.0109 1361 ALA 71 N 0.0011 0.0140 0.0035 1362 ALA 71 CA 0.0013 0.0136 0.0027 1363 ALA 71 C 0.0019 0.0124 0.0011 1364 ALA 71 O 0.0019 0.0124 0.0003 1365 ALA 71 CB 0.0004 0.0152 0.0020 1366 ILE 72 N 0.0031 0.0121 -0.0014 1367 ILE 72 CA 0.0036 0.0107 -0.0034 1368 ILE 72 C 0.0030 0.0113 -0.0046 1369 ILE 72 O 0.0030 0.0117 -0.0036 1370 ILE 72 CB 0.0049 0.0086 -0.0028 1371 ILE 72 CG1 0.0055 0.0079 -0.0021 1372 ILE 72 CG2 0.0053 0.0073 -0.0048 1373 ILE 72 CD1 0.0068 0.0058 -0.0014 1374 GLY 73 N 0.0017 0.0102 -0.0092 1375 GLY 73 CA 0.0008 0.0110 -0.0107 1376 GLY 73 C 0.0000 0.0107 -0.0130 1377 GLY 73 O 0.0003 0.0096 -0.0136 1378 THR 74 N 0.0008 0.0059 -0.0154 1379 THR 74 CA 0.0002 0.0053 -0.0140 1380 THR 74 C 0.0020 0.0043 -0.0129 1381 THR 74 O 0.0037 0.0043 -0.0137 1382 THR 74 CB -0.0006 0.0059 -0.0148 1383 THR 74 OG1 -0.0025 0.0067 -0.0155 1384 THR 74 CG2 -0.0009 0.0052 -0.0134 1385 VAL 75 N 0.0021 0.0008 -0.0133 1386 VAL 75 CA 0.0030 0.0001 -0.0126 1387 VAL 75 C 0.0027 -0.0001 -0.0115 1388 VAL 75 O 0.0019 0.0003 -0.0108 1389 VAL 75 CB 0.0031 -0.0001 -0.0124 1390 VAL 75 CG1 0.0040 -0.0009 -0.0115 1391 VAL 75 CG2 0.0034 -0.0000 -0.0135 1392 LEU 76 N 0.0071 -0.0066 -0.0088 1393 LEU 76 CA 0.0077 -0.0067 -0.0068 1394 LEU 76 C 0.0078 -0.0071 -0.0069 1395 LEU 76 O 0.0076 -0.0084 -0.0081 1396 LEU 76 CB 0.0083 -0.0085 -0.0059 1397 LEU 76 CG 0.0086 -0.0082 -0.0048 1398 LEU 76 CD1 0.0081 -0.0064 -0.0056 1399 LEU 76 CD2 0.0090 -0.0102 -0.0048 1400 VAL 77 N 0.0072 -0.0100 -0.0045 1401 VAL 77 CA 0.0073 -0.0107 -0.0044 1402 VAL 77 C 0.0077 -0.0115 -0.0022 1403 VAL 77 O 0.0077 -0.0104 -0.0006 1404 VAL 77 CB 0.0070 -0.0089 -0.0049 1405 VAL 77 CG1 0.0071 -0.0098 -0.0050 1406 VAL 77 CG2 0.0066 -0.0080 -0.0071 1407 GLY 78 N 0.0075 -0.0121 -0.0057 1408 GLY 78 CA 0.0078 -0.0116 -0.0064 1409 GLY 78 C 0.0053 -0.0113 -0.0069 1410 GLY 78 O 0.0033 -0.0114 -0.0068 1411 PRO 79 N 0.0072 -0.0130 -0.0123 1412 PRO 79 CA 0.0036 -0.0117 -0.0135 1413 PRO 79 C 0.0010 -0.0102 -0.0104 1414 PRO 79 O -0.0018 -0.0092 -0.0107 1415 PRO 79 CB 0.0025 -0.0118 -0.0165 1416 PRO 79 CG 0.0047 -0.0124 -0.0155 1417 PRO 79 CD 0.0081 -0.0135 -0.0135 1418 THR 80 N 0.0010 -0.0077 -0.0060 1419 THR 80 CA -0.0005 -0.0075 -0.0046 1420 THR 80 C -0.0020 -0.0072 -0.0057 1421 THR 80 O -0.0016 -0.0072 -0.0070 1422 THR 80 CB 0.0002 -0.0078 -0.0029 1423 THR 80 OG1 -0.0013 -0.0076 -0.0018 1424 THR 80 CG2 0.0014 -0.0079 -0.0036 1425 PRO 81 N -0.0021 -0.0056 -0.0026 1426 PRO 81 CA -0.0052 -0.0049 -0.0049 1427 PRO 81 C -0.0069 -0.0051 -0.0051 1428 PRO 81 O -0.0091 -0.0044 -0.0073 1429 PRO 81 CB -0.0077 -0.0059 -0.0036 1430 PRO 81 CG -0.0068 -0.0073 -0.0003 1431 PRO 81 CD -0.0029 -0.0070 0.0002 1432 VAL 82 N -0.0046 -0.0045 -0.0027 1433 VAL 82 CA -0.0033 -0.0041 -0.0013 1434 VAL 82 C -0.0014 -0.0043 -0.0004 1435 VAL 82 O -0.0017 -0.0039 -0.0001 1436 VAL 82 CB -0.0044 -0.0022 -0.0000 1437 VAL 82 CG1 -0.0030 -0.0015 0.0017 1438 VAL 82 CG2 -0.0061 -0.0020 -0.0009 1439 ASN 83 N -0.0014 0.0009 -0.0046 1440 ASN 83 CA -0.0004 -0.0014 -0.0029 1441 ASN 83 C -0.0011 -0.0020 -0.0006 1442 ASN 83 O -0.0029 -0.0008 0.0010 1443 ASN 83 CB -0.0008 -0.0015 -0.0018 1444 ASN 83 CG -0.0001 -0.0011 -0.0039 1445 ASN 83 OD1 0.0016 -0.0019 -0.0058 1446 ASN 83 ND2 -0.0013 0.0001 -0.0035 1447 ILE 84 N -0.0011 -0.0042 -0.0017 1448 ILE 84 N -0.0010 -0.0042 -0.0017 1449 ILE 84 CA -0.0012 -0.0041 -0.0010 1450 ILE 84 CA -0.0011 -0.0041 -0.0010 1451 ILE 84 C -0.0006 -0.0043 -0.0005 1452 ILE 84 C -0.0005 -0.0043 -0.0005 1453 ILE 84 O -0.0001 -0.0044 -0.0006 1454 ILE 84 O 0.0000 -0.0045 -0.0007 1455 ILE 84 CB -0.0016 -0.0039 -0.0008 1456 ILE 84 CB -0.0013 -0.0041 -0.0009 1457 ILE 84 CG1 -0.0013 -0.0041 -0.0011 1458 ILE 84 CG1 -0.0020 -0.0039 -0.0013 1459 ILE 84 CG2 -0.0023 -0.0037 -0.0012 1460 ILE 84 CG2 -0.0013 -0.0040 -0.0002 1461 ILE 84 CD1 -0.0016 -0.0039 -0.0009 1462 ILE 84 CD1 -0.0021 -0.0039 -0.0015 1463 ILE 85 N -0.0006 -0.0007 0.0030 1464 ILE 85 CA -0.0010 -0.0006 0.0026 1465 ILE 85 C -0.0009 -0.0006 0.0021 1466 ILE 85 O -0.0005 -0.0007 0.0018 1467 ILE 85 CB -0.0009 -0.0006 0.0024 1468 ILE 85 CG1 -0.0009 -0.0006 0.0029 1469 ILE 85 CG2 -0.0013 -0.0005 0.0020 1470 ILE 85 CD1 -0.0014 -0.0006 0.0033 1471 GLY 86 N -0.0004 -0.0020 0.0004 1472 GLY 86 CA -0.0010 -0.0010 0.0011 1473 GLY 86 C -0.0002 0.0004 0.0011 1474 GLY 86 O 0.0008 0.0005 0.0005 1475 ARG 87 N 0.0013 0.0025 0.0013 1476 ARG 87 CA 0.0021 0.0037 0.0018 1477 ARG 87 C 0.0032 0.0041 0.0017 1478 ARG 87 O 0.0044 0.0047 0.0017 1479 ARG 87 CB 0.0012 0.0048 0.0027 1480 ARG 87 CG 0.0003 0.0047 0.0028 1481 ARG 87 CD -0.0005 0.0058 0.0037 1482 ARG 87 NE -0.0015 0.0060 0.0041 1483 ARG 87 CZ -0.0013 0.0068 0.0045 1484 ARG 87 NH1 -0.0001 0.0076 0.0046 1485 ARG 87 NH2 -0.0023 0.0068 0.0048 1486 ASN 88 N 0.0005 0.0040 -0.0016 1487 ASN 88 CA 0.0024 0.0051 -0.0019 1488 ASN 88 C 0.0047 0.0047 -0.0037 1489 ASN 88 O 0.0066 0.0060 -0.0038 1490 ASN 88 CB 0.0018 0.0046 -0.0019 1491 ASN 88 CG 0.0018 0.0025 -0.0037 1492 ASN 88 OD1 0.0005 0.0009 -0.0043 1493 ASN 88 ND2 0.0032 0.0024 -0.0047 1494 LEU 89 N 0.0017 0.0079 -0.0031 1495 LEU 89 CA 0.0024 0.0076 -0.0030 1496 LEU 89 C 0.0022 0.0082 -0.0022 1497 LEU 89 O 0.0029 0.0081 -0.0017 1498 LEU 89 CB 0.0023 0.0070 -0.0040 1499 LEU 89 CG 0.0027 0.0063 -0.0049 1500 LEU 89 CD1 0.0025 0.0058 -0.0059 1501 LEU 89 CD2 0.0038 0.0060 -0.0045 1502 LEU 90 N 0.0015 0.0086 0.0010 1503 LEU 90 CA 0.0011 0.0079 0.0006 1504 LEU 90 C 0.0020 0.0092 0.0009 1505 LEU 90 O 0.0024 0.0091 -0.0002 1506 LEU 90 CB -0.0003 0.0066 0.0018 1507 LEU 90 CG -0.0012 0.0050 0.0013 1508 LEU 90 CD1 -0.0025 0.0040 0.0027 1509 LEU 90 CD2 -0.0011 0.0040 -0.0008 1510 THR 91 N 0.0048 0.0107 0.0013 1511 THR 91 CA 0.0057 0.0109 0.0028 1512 THR 91 C 0.0070 0.0116 0.0016 1513 THR 91 O 0.0071 0.0116 0.0021 1514 THR 91 CB 0.0070 0.0113 0.0046 1515 THR 91 OG1 0.0083 0.0119 0.0038 1516 THR 91 CG2 0.0057 0.0107 0.0061 1517 GLN 92 N 0.0063 0.0119 -0.0005 1518 GLN 92 CA 0.0060 0.0122 -0.0007 1519 GLN 92 C 0.0047 0.0125 -0.0009 1520 GLN 92 O 0.0043 0.0125 -0.0009 1521 GLN 92 CB 0.0068 0.0131 -0.0012 1522 GLN 92 CG 0.0081 0.0131 -0.0011 1523 GLN 92 CD 0.0087 0.0123 -0.0006 1524 GLN 92 OE1 0.0089 0.0114 -0.0001 1525 GLN 92 NE2 0.0092 0.0126 -0.0007 1526 ILE 93 N -0.0021 0.0144 0.0010 1527 ILE 93 CA -0.0030 0.0142 0.0001 1528 ILE 93 C -0.0033 0.0129 -0.0001 1529 ILE 93 O -0.0040 0.0125 -0.0008 1530 ILE 93 CB -0.0030 0.0145 0.0001 1531 ILE 93 CG1 -0.0025 0.0136 0.0007 1532 ILE 93 CG2 -0.0026 0.0159 0.0003 1533 ILE 93 CD1 -0.0025 0.0138 0.0007 1534 GLY 94 N -0.0003 0.0118 -0.0010 1535 GLY 94 CA -0.0014 0.0108 0.0003 1536 GLY 94 C -0.0034 0.0095 0.0004 1537 GLY 94 O -0.0047 0.0087 0.0006 1538 CYS 95 N -0.0026 0.0098 0.0004 1539 CYS 95 CA -0.0036 0.0081 0.0005 1540 CYS 95 C -0.0037 0.0066 0.0024 1541 CYS 95 O -0.0028 0.0071 0.0041 1542 CYS 95 CB -0.0033 0.0084 0.0007 1543 CYS 95 SG -0.0046 0.0063 0.0006 1544 THR 96 N -0.0058 0.0047 0.0021 1545 THR 96 CA -0.0062 0.0025 0.0043 1546 THR 96 C -0.0076 -0.0001 0.0044 1547 THR 96 O -0.0087 -0.0006 0.0023 1548 THR 96 CB -0.0068 0.0018 0.0038 1549 THR 96 OG1 -0.0085 0.0006 0.0013 1550 THR 96 CG2 -0.0055 0.0042 0.0035 1551 LEU 97 N -0.0063 -0.0034 0.0050 1552 LEU 97 CA -0.0075 -0.0037 0.0050 1553 LEU 97 C -0.0087 -0.0050 0.0061 1554 LEU 97 O -0.0080 -0.0059 0.0071 1555 LEU 97 CB -0.0064 -0.0038 0.0054 1556 LEU 97 CG -0.0056 -0.0027 0.0044 1557 LEU 97 CD1 -0.0043 -0.0032 0.0051 1558 LEU 97 CD2 -0.0070 -0.0020 0.0034 1559 ASN 98 N -0.0092 -0.0078 0.0056 1560 ASN 98 CA -0.0100 -0.0086 0.0060 1561 ASN 98 C -0.0110 -0.0094 0.0060 1562 ASN 98 O -0.0115 -0.0092 0.0053 1563 ASN 98 CB -0.0104 -0.0085 0.0053 1564 ASN 98 CG -0.0111 -0.0093 0.0059 1565 ASN 98 OD1 -0.0118 -0.0101 0.0063 1566 ASN 98 ND2 -0.0109 -0.0091 0.0058 1567 PHE 99 N -0.0056 -0.0013 0.0088 1568 PHE 99 CA -0.0071 -0.0001 0.0089 1569 PHE 99 C -0.0075 0.0000 0.0106 1570 PHE 99 O -0.0087 0.0010 0.0111 1571 PHE 99 CB -0.0075 0.0005 0.0072 1572 PHE 99 CG -0.0069 0.0000 0.0071 1573 PHE 99 CD1 -0.0056 -0.0010 0.0064 1574 PHE 99 CD2 -0.0077 0.0006 0.0076 1575 PHE 99 CE1 -0.0051 -0.0014 0.0062 1576 PHE 99 CE2 -0.0072 0.0002 0.0075 1577 PHE 99 CZ -0.0059 -0.0008 0.0068 1578 PHE 99 OXT -0.0066 -0.0008 0.0116