1 ASN 8 N 0.0067 -0.0010 -0.0055 2 ASN 8 CA 0.0074 0.0034 -0.0089 3 ASN 8 C 0.0085 0.0033 -0.0130 4 ASN 8 O 0.0089 0.0072 -0.0151 5 ASN 8 CB 0.0080 0.0036 -0.0112 6 SER 9 N 0.0089 -0.0014 -0.0141 7 SER 9 CA 0.0099 -0.0021 -0.0177 8 SER 9 C 0.0092 -0.0030 -0.0150 9 SER 9 O 0.0083 -0.0056 -0.0112 10 SER 9 CB 0.0109 -0.0066 -0.0212 11 SER 9 OG 0.0121 -0.0063 -0.0256 12 PHE 10 N 0.0097 -0.0008 -0.0170 13 PHE 10 CA 0.0091 -0.0013 -0.0148 14 PHE 10 C 0.0102 -0.0023 -0.0191 15 PHE 10 O 0.0109 0.0010 -0.0222 16 PHE 10 CB 0.0082 0.0035 -0.0119 17 PHE 10 CG 0.0070 0.0045 -0.0075 18 PHE 10 CD1 0.0061 0.0012 -0.0034 19 PHE 10 CD2 0.0068 0.0088 -0.0074 20 PHE 10 CE1 0.0050 0.0021 0.0006 21 PHE 10 CE2 0.0058 0.0098 -0.0034 22 PHE 10 CZ 0.0049 0.0064 0.0007 23 HIS 11 N 0.0081 -0.0030 -0.0164 24 HIS 11 CA 0.0090 -0.0045 -0.0193 25 HIS 11 C 0.0088 -0.0047 -0.0187 26 HIS 11 O 0.0094 -0.0065 -0.0207 27 HIS 11 CB 0.0091 -0.0082 -0.0201 28 HIS 11 CG 0.0092 -0.0084 -0.0204 29 HIS 11 CD2 0.0085 -0.0071 -0.0184 30 HIS 11 ND1 0.0101 -0.0101 -0.0230 31 HIS 11 CE1 0.0099 -0.0098 -0.0226 32 HIS 11 NE2 0.0090 -0.0080 -0.0198 33 PHE 12 N 0.0080 -0.0030 -0.0160 34 PHE 12 CA 0.0076 -0.0033 -0.0150 35 PHE 12 C 0.0076 0.0004 -0.0144 36 PHE 12 O 0.0072 0.0006 -0.0133 37 PHE 12 CB 0.0063 -0.0054 -0.0118 38 PHE 12 CG 0.0062 -0.0093 -0.0123 39 PHE 12 CD1 0.0066 -0.0114 -0.0139 40 PHE 12 CD2 0.0057 -0.0110 -0.0111 41 PHE 12 CE1 0.0066 -0.0150 -0.0143 42 PHE 12 CE2 0.0056 -0.0146 -0.0115 43 PHE 12 CZ 0.0060 -0.0166 -0.0131 44 LYS 13 N 0.0080 0.0032 -0.0151 45 LYS 13 CA 0.0080 0.0068 -0.0146 46 LYS 13 C 0.0087 0.0074 -0.0163 47 LYS 13 O 0.0083 0.0091 -0.0148 48 LYS 13 CB 0.0087 0.0095 -0.0158 49 LYS 13 CG 0.0088 0.0134 -0.0156 50 LYS 13 CD 0.0091 0.0158 -0.0159 51 LYS 13 CE 0.0099 0.0193 -0.0173 52 LYS 13 NZ 0.0111 0.0190 -0.0209 53 GLU 14 N 0.0085 0.0064 -0.0196 54 GLU 14 CA 0.0088 0.0065 -0.0202 55 GLU 14 C 0.0081 0.0038 -0.0170 56 GLU 14 O 0.0074 0.0047 -0.0162 57 GLU 14 CB 0.0111 0.0055 -0.0243 58 GLU 14 CG 0.0113 0.0093 -0.0274 59 GLU 14 CD 0.0108 0.0113 -0.0276 60 GLU 14 OE1 0.0119 0.0094 -0.0287 61 GLU 14 OE2 0.0091 0.0148 -0.0264 62 ALA 15 N 0.0082 0.0005 -0.0152 63 ALA 15 CA 0.0074 -0.0018 -0.0118 64 ALA 15 C 0.0049 0.0008 -0.0085 65 ALA 15 O 0.0041 0.0009 -0.0068 66 ALA 15 CB 0.0080 -0.0058 -0.0105 67 TRP 16 N 0.0038 0.0029 -0.0076 68 TRP 16 CA 0.0015 0.0056 -0.0046 69 TRP 16 C 0.0009 0.0089 -0.0056 70 TRP 16 O -0.0005 0.0097 -0.0031 71 TRP 16 CB 0.0007 0.0077 -0.0043 72 TRP 16 CG 0.0008 0.0049 -0.0027 73 TRP 16 CD1 0.0024 0.0031 -0.0048 74 TRP 16 CD2 -0.0007 0.0036 0.0014 75 TRP 16 CE2 0.0000 0.0011 0.0015 76 TRP 16 CE3 -0.0027 0.0044 0.0049 77 TRP 16 NE1 0.0019 0.0008 -0.0023 78 TRP 16 CZ2 -0.0011 -0.0008 0.0050 79 TRP 16 CZ3 -0.0038 0.0026 0.0083 80 TRP 16 CH2 -0.0030 0.0000 0.0084 81 LYS 17 N 0.0011 0.0112 -0.0087 82 LYS 17 CA 0.0003 0.0137 -0.0095 83 LYS 17 C 0.0008 0.0121 -0.0089 84 LYS 17 O -0.0007 0.0135 -0.0078 85 LYS 17 CB 0.0014 0.0157 -0.0129 86 LYS 17 CG 0.0007 0.0176 -0.0134 87 LYS 17 CD 0.0021 0.0192 -0.0168 88 LYS 17 CE 0.0009 0.0229 -0.0179 89 LYS 17 NZ 0.0024 0.0235 -0.0207 90 HIS 18 N 0.0027 0.0092 -0.0096 91 HIS 18 CA 0.0032 0.0074 -0.0089 92 HIS 18 C 0.0014 0.0065 -0.0053 93 HIS 18 O 0.0006 0.0067 -0.0042 94 HIS 18 CB 0.0057 0.0042 -0.0102 95 HIS 18 CG 0.0067 0.0029 -0.0107 96 HIS 18 CD2 0.0072 0.0042 -0.0126 97 HIS 18 ND1 0.0073 -0.0003 -0.0091 98 HIS 18 CE1 0.0082 -0.0008 -0.0100 99 HIS 18 NE2 0.0082 0.0019 -0.0122 100 ALA 19 N 0.0007 0.0055 -0.0034 101 ALA 19 CA -0.0011 0.0048 0.0000 102 ALA 19 C -0.0034 0.0079 0.0011 103 ALA 19 O -0.0047 0.0078 0.0033 104 ALA 19 CB -0.0013 0.0032 0.0017 105 ILE 20 N -0.0061 0.0090 0.0014 106 ILE 20 CA -0.0080 0.0120 0.0022 107 ILE 20 C -0.0082 0.0130 0.0016 108 ILE 20 O -0.0098 0.0141 0.0035 109 ILE 20 CB -0.0082 0.0142 0.0005 110 ILE 20 CG1 -0.0083 0.0134 0.0015 111 ILE 20 CG2 -0.0101 0.0174 0.0009 112 ILE 20 CD1 -0.0077 0.0145 -0.0009 113 GLN 21 N -0.0067 0.0125 -0.0009 114 GLN 21 CA -0.0067 0.0135 -0.0016 115 GLN 21 C -0.0069 0.0115 0.0005 116 GLN 21 O -0.0079 0.0127 0.0014 117 GLN 21 CB -0.0050 0.0134 -0.0049 118 GLN 21 CG -0.0054 0.0157 -0.0063 119 GLN 21 CD -0.0071 0.0189 -0.0062 120 GLN 21 NE2 -0.0083 0.0207 -0.0056 121 GLN 21 OE1 -0.0073 0.0197 -0.0067 122 LYS 22 N -0.0058 0.0085 0.0013 123 LYS 22 CA -0.0059 0.0066 0.0034 124 LYS 22 C -0.0080 0.0076 0.0064 125 LYS 22 O -0.0087 0.0076 0.0078 126 LYS 22 CB -0.0045 0.0033 0.0039 127 LYS 22 CG -0.0024 0.0016 0.0016 128 LYS 22 CD -0.0021 -0.0005 0.0031 129 LYS 22 CE -0.0001 -0.0035 0.0020 130 ALA 23 N -0.0105 0.0083 0.0070 131 ALA 23 CA -0.0129 0.0085 0.0082 132 ALA 23 C -0.0150 0.0094 0.0082 133 ALA 23 O -0.0167 0.0089 0.0098 134 ALA 23 CB -0.0134 0.0093 0.0073 135 LYS 24 N -0.0150 0.0107 0.0063 136 LYS 24 CA -0.0170 0.0116 0.0063 137 LYS 24 C -0.0173 0.0104 0.0081 138 LYS 24 O -0.0194 0.0107 0.0089 139 LYS 24 CB -0.0166 0.0130 0.0041 140 LYS 24 CG -0.0182 0.0147 0.0026 141 LYS 24 CD -0.0174 0.0160 0.0004 142 LYS 24 CE -0.0158 0.0164 -0.0011 143 LYS 24 NZ -0.0146 0.0174 -0.0032 144 HIS 25 N -0.0153 0.0091 0.0087 145 HIS 25 CA -0.0155 0.0080 0.0104 146 HIS 25 C -0.0154 0.0063 0.0126 147 HIS 25 O -0.0149 0.0051 0.0140 148 HIS 25 CB -0.0134 0.0077 0.0096 149 HIS 25 CG -0.0134 0.0092 0.0074 150 HIS 25 CD2 -0.0115 0.0097 0.0057 151 HIS 25 ND1 -0.0155 0.0105 0.0068 152 HIS 25 CE1 -0.0149 0.0117 0.0048 153 HIS 25 NE2 -0.0125 0.0113 0.0041 154 MET 26 N -0.0196 -0.0062 0.0137 155 MET 26 CA -0.0166 -0.0023 0.0128 156 MET 26 C -0.0133 -0.0013 0.0119 157 MET 26 O -0.0113 -0.0046 0.0114 158 MET 26 CB -0.0140 -0.0035 0.0121 159 MET 26 CG -0.0128 0.0008 0.0117 160 MET 26 SD -0.0177 0.0028 0.0131 161 MET 26 CE -0.0152 0.0069 0.0123 162 PRO 27 N -0.0126 0.0032 0.0116 163 PRO 27 CA -0.0095 0.0044 0.0107 164 PRO 27 C -0.0045 0.0041 0.0093 165 PRO 27 O -0.0032 0.0049 0.0089 166 PRO 27 CB -0.0109 0.0095 0.0110 167 PRO 27 CG -0.0124 0.0115 0.0114 168 PRO 27 CD -0.0149 0.0074 0.0122 169 ASP 28 N -0.0017 0.0028 0.0085 170 ASP 28 CA 0.0033 0.0026 0.0071 171 ASP 28 C 0.0052 0.0076 0.0065 172 ASP 28 O 0.0048 0.0104 0.0066 173 ASP 28 CB 0.0056 -0.0001 0.0065 174 ASP 28 CG 0.0108 -0.0004 0.0051 175 ASP 28 OD1 0.0124 0.0004 0.0046 176 ASP 28 OD2 0.0132 -0.0015 0.0044 177 PRO 29 N 0.0090 0.0043 0.0044 178 PRO 29 CA 0.0086 0.0046 0.0032 179 PRO 29 C 0.0090 0.0039 0.0019 180 PRO 29 O 0.0089 0.0039 0.0010 181 PRO 29 CB 0.0076 0.0056 0.0030 182 PRO 29 CG 0.0077 0.0056 0.0037 183 PRO 29 CD 0.0084 0.0051 0.0049 184 TRP 30 N 0.0096 0.0033 0.0020 185 TRP 30 CA 0.0100 0.0027 0.0008 186 TRP 30 C 0.0110 0.0016 0.0010 187 TRP 30 O 0.0115 0.0009 0.0003 188 TRP 30 CB 0.0098 0.0028 0.0005 189 TRP 30 CG 0.0089 0.0038 -0.0001 190 TRP 30 CD1 0.0083 0.0045 -0.0004 191 TRP 30 CD2 0.0086 0.0041 -0.0005 192 TRP 30 CE2 0.0077 0.0050 -0.0010 193 TRP 30 CE3 0.0089 0.0037 -0.0005 194 TRP 30 NE1 0.0075 0.0052 -0.0009 195 TRP 30 CZ2 0.0072 0.0055 -0.0015 196 TRP 30 CZ3 0.0084 0.0043 -0.0009 197 TRP 30 CH2 0.0075 0.0051 -0.0015 198 ALA 31 N 0.0113 0.0014 0.0020 199 ALA 31 CA 0.0122 0.0004 0.0023 200 ALA 31 C 0.0127 -0.0003 0.0011 201 ALA 31 O 0.0134 -0.0011 0.0009 202 ALA 31 CB 0.0124 0.0004 0.0034 203 GLU 32 N 0.0124 -0.0017 0.0022 204 GLU 32 CA 0.0125 -0.0029 0.0013 205 GLU 32 C 0.0118 -0.0032 -0.0002 206 GLU 32 O 0.0118 -0.0042 -0.0010 207 GLU 32 CB 0.0124 -0.0027 0.0013 208 GLU 32 CG 0.0129 -0.0021 0.0027 209 GLU 32 CD 0.0139 -0.0032 0.0037 210 GLU 32 OE1 0.0143 -0.0044 0.0035 211 GLU 32 OE2 0.0143 -0.0028 0.0048 212 PHE 33 N 0.0113 -0.0024 -0.0005 213 PHE 33 CA 0.0106 -0.0026 -0.0019 214 PHE 33 C 0.0110 -0.0034 -0.0019 215 PHE 33 O 0.0105 -0.0039 -0.0030 216 PHE 33 CB 0.0098 -0.0012 -0.0023 217 PHE 33 CG 0.0094 -0.0003 -0.0024 218 PHE 33 CD1 0.0092 -0.0009 -0.0033 219 PHE 33 CD2 0.0092 0.0010 -0.0016 220 PHE 33 CE1 0.0088 -0.0001 -0.0033 221 PHE 33 CE2 0.0088 0.0018 -0.0017 222 PHE 33 CZ 0.0086 0.0012 -0.0025 223 HIS 34 N 0.0117 -0.0036 -0.0007 224 HIS 34 CA 0.0121 -0.0046 -0.0006 225 HIS 34 C 0.0116 -0.0043 -0.0015 226 HIS 34 O 0.0115 -0.0052 -0.0023 227 HIS 34 CB 0.0126 -0.0061 -0.0010 228 HIS 34 CG 0.0133 -0.0065 -0.0001 229 HIS 34 CD2 0.0132 -0.0068 -0.0004 230 HIS 34 ND1 0.0140 -0.0066 0.0013 231 HIS 34 CE1 0.0144 -0.0069 0.0018 232 HIS 34 NE2 0.0140 -0.0071 0.0008 233 LEU 35 N 0.0102 -0.0029 -0.0009 234 LEU 35 CA 0.0091 -0.0020 -0.0017 235 LEU 35 C 0.0093 -0.0018 -0.0015 236 LEU 35 O 0.0084 -0.0017 -0.0022 237 LEU 35 CB 0.0087 -0.0003 -0.0017 238 LEU 35 CG 0.0084 -0.0004 -0.0020 239 LEU 35 CD1 0.0085 0.0014 -0.0017 240 LEU 35 CD2 0.0071 -0.0010 -0.0032 241 GLU 36 N 0.0106 -0.0019 -0.0004 242 GLU 36 CA 0.0109 -0.0017 -0.0001 243 GLU 36 C 0.0106 -0.0032 -0.0006 244 GLU 36 O 0.0104 -0.0031 -0.0007 245 GLU 36 CB 0.0123 -0.0015 0.0011 246 GLU 36 CG 0.0127 0.0001 0.0017 247 GLU 36 CD 0.0133 -0.0004 0.0021 248 GLU 36 OE1 0.0128 -0.0014 0.0015 249 GLU 36 OE2 0.0143 0.0003 0.0030 250 ASP 37 N 0.0105 -0.0046 -0.0009 251 ASP 37 CA 0.0101 -0.0062 -0.0014 252 ASP 37 C 0.0087 -0.0062 -0.0026 253 ASP 37 O 0.0083 -0.0074 -0.0032 254 ASP 37 CB 0.0106 -0.0077 -0.0012 255 ASP 37 CG 0.0121 -0.0077 -0.0000 256 ASP 37 OD1 0.0128 -0.0069 0.0007 257 ASP 37 OD2 0.0125 -0.0085 0.0002 258 ILE 38 N 0.0052 -0.0042 -0.0017 259 ILE 38 CA 0.0036 -0.0041 -0.0027 260 ILE 38 C 0.0028 -0.0031 -0.0034 261 ILE 38 O 0.0035 -0.0018 -0.0033 262 ILE 38 CB 0.0034 -0.0032 -0.0029 263 ILE 38 CG1 0.0041 -0.0044 -0.0023 264 ILE 38 CG2 0.0018 -0.0029 -0.0040 265 ILE 38 CD1 0.0043 -0.0034 -0.0024 266 ALA 39 N 0.0013 -0.0038 -0.0040 267 ALA 39 CA 0.0005 -0.0029 -0.0047 268 ALA 39 C 0.0004 -0.0010 -0.0053 269 ALA 39 O -0.0001 -0.0006 -0.0056 270 ALA 39 CB -0.0012 -0.0039 -0.0054 271 THR 40 N 0.0008 0.0002 -0.0054 272 THR 40 CA 0.0008 0.0021 -0.0058 273 THR 40 C -0.0009 0.0025 -0.0069 274 THR 40 O -0.0020 0.0018 -0.0074 275 THR 40 CB 0.0015 0.0032 -0.0057 276 THR 40 CG2 0.0019 0.0051 -0.0060 277 THR 40 OG1 0.0030 0.0026 -0.0047 278 GLU 41 N -0.0036 0.0045 -0.0078 279 GLU 41 CA -0.0051 0.0050 -0.0079 280 GLU 41 C -0.0045 0.0067 -0.0091 281 GLU 41 O -0.0027 0.0071 -0.0097 282 GLU 41 CB -0.0053 0.0036 -0.0069 283 GLU 41 CG -0.0063 0.0020 -0.0056 284 GLU 41 CD -0.0067 0.0007 -0.0047 285 GLU 41 OE1 -0.0080 0.0013 -0.0049 286 GLU 41 OE2 -0.0058 -0.0008 -0.0038 287 ARG 42 N -0.0061 0.0076 -0.0095 288 ARG 42 CA -0.0059 0.0093 -0.0107 289 ARG 42 C -0.0060 0.0091 -0.0106 290 ARG 42 O -0.0072 0.0082 -0.0097 291 ARG 42 CB -0.0077 0.0107 -0.0114 292 ARG 42 CG -0.0081 0.0105 -0.0112 293 ARG 42 CD -0.0104 0.0112 -0.0113 294 ARG 42 NE -0.0108 0.0130 -0.0125 295 ARG 42 CZ -0.0105 0.0143 -0.0134 296 ARG 42 NH1 -0.0097 0.0140 -0.0133 297 ARG 42 NH2 -0.0109 0.0160 -0.0145 298 ALA 43 N -0.0047 0.0100 -0.0114 299 ALA 43 CA -0.0046 0.0099 -0.0113 300 ALA 43 C -0.0040 0.0116 -0.0126 301 ALA 43 O -0.0033 0.0127 -0.0135 302 ALA 43 CB -0.0029 0.0084 -0.0105 303 THR 44 N -0.0044 0.0100 -0.0103 304 THR 44 CA -0.0038 0.0105 -0.0112 305 THR 44 C -0.0026 0.0100 -0.0111 306 THR 44 O -0.0025 0.0095 -0.0104 307 THR 44 CB -0.0046 0.0109 -0.0114 308 THR 44 CG2 -0.0041 0.0114 -0.0124 309 THR 44 OG1 -0.0058 0.0113 -0.0115 310 ARG 45 N -0.0017 0.0102 -0.0118 311 ARG 45 CA -0.0005 0.0098 -0.0117 312 ARG 45 C -0.0001 0.0102 -0.0124 313 ARG 45 O -0.0002 0.0108 -0.0133 314 ARG 45 CB 0.0004 0.0098 -0.0120 315 ARG 45 CG 0.0017 0.0094 -0.0121 316 ARG 45 CD 0.0025 0.0094 -0.0124 317 ARG 45 NE 0.0024 0.0101 -0.0134 318 ARG 45 CZ 0.0029 0.0102 -0.0138 319 ARG 45 NH1 0.0037 0.0097 -0.0133 320 ARG 45 NH2 0.0028 0.0109 -0.0147 321 HIS 46 N 0.0002 0.0097 -0.0119 322 HIS 46 CA 0.0007 0.0099 -0.0124 323 HIS 46 C 0.0021 0.0095 -0.0125 324 HIS 46 O 0.0025 0.0089 -0.0117 325 HIS 46 CB 0.0002 0.0097 -0.0119 326 HIS 46 CG -0.0011 0.0099 -0.0116 327 HIS 46 CD2 -0.0020 0.0105 -0.0121 328 HIS 46 ND1 -0.0017 0.0094 -0.0107 329 HIS 46 CE1 -0.0028 0.0097 -0.0106 330 HIS 46 NE2 -0.0031 0.0104 -0.0115 331 ARG 47 N 0.0019 0.0041 -0.0108 332 ARG 47 CA 0.0012 0.0033 -0.0114 333 ARG 47 C 0.0017 0.0018 -0.0109 334 ARG 47 O 0.0023 0.0011 -0.0105 335 ARG 47 CB -0.0002 0.0032 -0.0123 336 ARG 47 CG -0.0009 0.0046 -0.0128 337 ARG 47 CD -0.0022 0.0044 -0.0137 338 ARG 47 NE -0.0022 0.0040 -0.0137 339 ARG 47 CZ -0.0032 0.0038 -0.0144 340 ARG 47 NH1 -0.0043 0.0040 -0.0152 341 ARG 47 NH2 -0.0031 0.0034 -0.0143 342 TYR 48 N 0.0015 0.0013 -0.0110 343 TYR 48 CA 0.0022 -0.0000 -0.0106 344 TYR 48 C 0.0013 -0.0013 -0.0111 345 TYR 48 O 0.0003 -0.0010 -0.0118 346 TYR 48 CB 0.0030 0.0004 -0.0100 347 TYR 48 CG 0.0037 -0.0008 -0.0095 348 TYR 48 CD1 0.0046 -0.0016 -0.0088 349 TYR 48 CD2 0.0034 -0.0012 -0.0097 350 TYR 48 CE1 0.0052 -0.0028 -0.0084 351 TYR 48 CE2 0.0040 -0.0024 -0.0092 352 TYR 48 CZ 0.0049 -0.0032 -0.0086 353 TYR 48 OH 0.0056 -0.0043 -0.0081 354 ASN 49 N 0.0017 -0.0027 -0.0108 355 ASN 49 CA 0.0010 -0.0040 -0.0113 356 ASN 49 C 0.0019 -0.0048 -0.0106 357 ASN 49 O 0.0029 -0.0053 -0.0099 358 ASN 49 CB 0.0007 -0.0051 -0.0115 359 ASN 49 CG -0.0002 -0.0064 -0.0120 360 ASN 49 ND2 -0.0011 -0.0068 -0.0126 361 ASN 49 OD1 0.0000 -0.0071 -0.0119 362 ALA 50 N -0.0001 -0.0060 -0.0112 363 ALA 50 CA 0.0029 -0.0074 -0.0099 364 ALA 50 C 0.0038 -0.0112 -0.0111 365 ALA 50 O 0.0065 -0.0127 -0.0099 366 ALA 50 CB 0.0028 -0.0059 -0.0092 367 VAL 51 N 0.0015 -0.0129 -0.0134 368 VAL 51 CA 0.0023 -0.0166 -0.0146 369 VAL 51 C 0.0038 -0.0179 -0.0142 370 VAL 51 O 0.0061 -0.0203 -0.0137 371 VAL 51 CB -0.0006 -0.0180 -0.0171 372 VAL 51 CG1 0.0003 -0.0219 -0.0184 373 VAL 51 CG2 -0.0021 -0.0166 -0.0175 374 THR 52 N 0.0024 -0.0164 -0.0144 375 THR 52 CA 0.0036 -0.0173 -0.0140 376 THR 52 C 0.0059 -0.0152 -0.0115 377 THR 52 O 0.0075 -0.0161 -0.0108 378 THR 52 CB 0.0009 -0.0167 -0.0155 379 THR 52 CG2 -0.0016 -0.0184 -0.0180 380 THR 52 OG1 -0.0004 -0.0131 -0.0147 381 GLY 53 N 0.0047 -0.0118 -0.0120 382 GLY 53 CA 0.0058 -0.0105 -0.0103 383 GLY 53 C 0.0057 -0.0088 -0.0100 384 GLY 53 O 0.0068 -0.0084 -0.0085 385 GLU 54 N 0.0045 -0.0079 -0.0114 386 GLU 54 CA 0.0043 -0.0065 -0.0113 387 GLU 54 C 0.0035 -0.0043 -0.0117 388 GLU 54 O 0.0026 -0.0040 -0.0129 389 GLU 54 CB 0.0036 -0.0075 -0.0124 390 GLU 54 CG 0.0045 -0.0093 -0.0117 391 GLU 54 CD 0.0037 -0.0106 -0.0130 392 GLU 54 OE1 0.0024 -0.0100 -0.0144 393 GLU 54 OE2 0.0043 -0.0124 -0.0126 394 TRP 55 N 0.0039 -0.0026 -0.0109 395 TRP 55 CA 0.0033 -0.0004 -0.0112 396 TRP 55 C 0.0024 0.0005 -0.0121 397 TRP 55 O 0.0028 0.0003 -0.0116 398 TRP 55 CB 0.0044 0.0010 -0.0095 399 TRP 55 CG 0.0050 0.0008 -0.0087 400 TRP 55 CD1 0.0062 -0.0007 -0.0076 401 TRP 55 CD2 0.0046 0.0020 -0.0090 402 TRP 55 CE2 0.0055 0.0012 -0.0080 403 TRP 55 CE3 0.0035 0.0037 -0.0100 404 TRP 55 NE1 0.0065 -0.0004 -0.0071 405 TRP 55 CZ2 0.0054 0.0020 -0.0079 406 TRP 55 CZ3 0.0034 0.0045 -0.0099 407 TRP 55 CH2 0.0044 0.0037 -0.0089 408 LEU 56 N 0.0005 0.0066 -0.0140 409 LEU 56 CA 0.0002 0.0080 -0.0149 410 LEU 56 C -0.0002 0.0086 -0.0144 411 LEU 56 O 0.0001 0.0078 -0.0142 412 LEU 56 CB 0.0008 0.0078 -0.0166 413 LEU 56 CG 0.0006 0.0092 -0.0175 414 LEU 56 CD1 0.0003 0.0104 -0.0180 415 LEU 56 CD2 0.0013 0.0087 -0.0189 416 ASP 57 N -0.0009 0.0100 -0.0141 417 ASP 57 CA -0.0013 0.0106 -0.0136 418 ASP 57 C -0.0015 0.0120 -0.0147 419 ASP 57 O -0.0016 0.0127 -0.0154 420 ASP 57 CB -0.0021 0.0111 -0.0120 421 ASP 57 CG -0.0026 0.0124 -0.0120 422 ASP 57 OD1 -0.0024 0.0121 -0.0122 423 ASP 57 OD2 -0.0031 0.0136 -0.0119 424 ASP 58 N -0.0016 0.0122 -0.0148 425 ASP 58 CA -0.0018 0.0135 -0.0157 426 ASP 58 C -0.0023 0.0140 -0.0150 427 ASP 58 O -0.0024 0.0133 -0.0139 428 ASP 58 CB -0.0011 0.0131 -0.0173 429 ASP 58 CG -0.0006 0.0119 -0.0174 430 ASP 58 OD1 -0.0006 0.0110 -0.0162 431 ASP 58 OD2 -0.0001 0.0118 -0.0186 432 GLU 59 N -0.0008 0.0157 -0.0152 433 GLU 59 CA -0.0017 0.0145 -0.0143 434 GLU 59 C -0.0001 0.0136 -0.0137 435 GLU 59 O 0.0010 0.0143 -0.0141 436 GLU 59 CB -0.0032 0.0150 -0.0148 437 GLU 59 CG -0.0046 0.0161 -0.0157 438 GLU 59 CD -0.0060 0.0154 -0.0152 439 GLU 59 OE1 -0.0075 0.0148 -0.0148 440 GLU 59 OE2 -0.0057 0.0154 -0.0152 441 VAL 60 N -0.0001 0.0121 -0.0125 442 VAL 60 CA 0.0013 0.0112 -0.0118 443 VAL 60 C 0.0004 0.0098 -0.0108 444 VAL 60 O -0.0013 0.0095 -0.0106 445 VAL 60 CB 0.0026 0.0105 -0.0113 446 VAL 60 CG1 0.0035 0.0118 -0.0122 447 VAL 60 CG2 0.0016 0.0094 -0.0105 448 LEU 61 N 0.0015 0.0091 -0.0103 449 LEU 61 CA 0.0009 0.0078 -0.0093 450 LEU 61 C 0.0021 0.0065 -0.0083 451 LEU 61 O 0.0039 0.0067 -0.0084 452 LEU 61 CB 0.0011 0.0082 -0.0096 453 LEU 61 CG -0.0002 0.0095 -0.0106 454 LEU 61 CD1 0.0003 0.0099 -0.0109 455 LEU 61 CD2 -0.0022 0.0090 -0.0103 456 ILE 62 N 0.0023 0.0069 -0.0062 457 ILE 62 CA 0.0029 0.0060 -0.0056 458 ILE 62 C 0.0028 0.0044 -0.0051 459 ILE 62 O 0.0018 0.0039 -0.0053 460 ILE 62 CB 0.0021 0.0061 -0.0059 461 ILE 62 CG1 0.0005 0.0053 -0.0062 462 ILE 62 CG2 0.0021 0.0077 -0.0065 463 ILE 62 CD1 -0.0000 0.0046 -0.0062 464 LYS 63 N 0.0038 0.0036 -0.0044 465 LYS 63 CA 0.0038 0.0020 -0.0039 466 LYS 63 C 0.0040 0.0013 -0.0036 467 LYS 63 O 0.0052 0.0015 -0.0032 468 LYS 63 CB 0.0050 0.0016 -0.0033 469 LYS 63 CG 0.0048 0.0020 -0.0035 470 LYS 63 CD 0.0060 0.0015 -0.0029 471 LYS 63 CE 0.0058 0.0018 -0.0030 472 LYS 63 NZ 0.0048 0.0007 -0.0030 473 MET 64 N 0.0028 0.0006 -0.0037 474 MET 64 CA 0.0028 0.0001 -0.0036 475 MET 64 C 0.0026 -0.0016 -0.0030 476 MET 64 O 0.0018 -0.0024 -0.0030 477 MET 64 CB 0.0015 0.0007 -0.0042 478 MET 64 CG 0.0014 0.0002 -0.0041 479 MET 64 SD -0.0002 0.0008 -0.0049 480 MET 64 CE 0.0002 0.0028 -0.0054 481 ALA 65 N 0.0024 -0.0009 -0.0024 482 ALA 65 CA 0.0022 -0.0018 -0.0012 483 ALA 65 C 0.0014 -0.0021 -0.0019 484 ALA 65 O 0.0015 -0.0014 -0.0031 485 ALA 65 CB 0.0035 -0.0012 -0.0000 486 SER 66 N 0.0006 -0.0032 -0.0011 487 SER 66 CA -0.0003 -0.0036 -0.0016 488 SER 66 C 0.0004 -0.0032 -0.0013 489 SER 66 O -0.0001 -0.0032 -0.0020 490 SER 66 CB -0.0015 -0.0050 -0.0010 491 SER 66 OG -0.0010 -0.0054 0.0007 492 GLN 67 N 0.0015 -0.0029 -0.0001 493 GLN 67 CA 0.0022 -0.0025 0.0004 494 GLN 67 C 0.0037 -0.0013 0.0005 495 GLN 67 O 0.0042 -0.0010 0.0008 496 GLN 67 CB 0.0022 -0.0033 0.0020 497 GLN 67 CG 0.0008 -0.0045 0.0020 498 GLN 67 CD 0.0002 -0.0044 0.0007 499 GLN 67 NE2 -0.0011 -0.0051 -0.0000 500 GLN 67 OE1 0.0009 -0.0036 0.0004 501 PRO 68 N 0.0032 0.0012 0.0008 502 PRO 68 CA 0.0039 0.0014 0.0006 503 PRO 68 C 0.0045 0.0013 0.0011 504 PRO 68 O 0.0044 0.0010 0.0017 505 PRO 68 CB 0.0041 0.0015 0.0006 506 PRO 68 CG 0.0034 0.0014 0.0005 507 PRO 68 CD 0.0029 0.0011 0.0009 508 PHE 69 N 0.0051 0.0015 0.0008 509 PHE 69 CA 0.0057 0.0014 0.0012 510 PHE 69 C 0.0063 0.0014 0.0014 511 PHE 69 O 0.0067 0.0012 0.0019 512 PHE 69 CB 0.0060 0.0016 0.0009 513 PHE 69 CG 0.0064 0.0020 0.0002 514 PHE 69 CD1 0.0060 0.0022 -0.0004 515 PHE 69 CD2 0.0071 0.0021 0.0002 516 PHE 69 CE1 0.0063 0.0025 -0.0010 517 PHE 69 CE2 0.0075 0.0024 -0.0004 518 PHE 69 CZ 0.0070 0.0026 -0.0010 519 GLY 70 N 0.0064 0.0016 0.0010 520 GLY 70 CA 0.0069 0.0016 0.0012 521 GLY 70 C 0.0066 0.0017 0.0008 522 GLY 70 O 0.0062 0.0019 0.0003 523 ARG 71 N 0.0090 0.0012 0.0033 524 ARG 71 CA 0.0090 0.0011 0.0037 525 ARG 71 C 0.0112 -0.0001 0.0041 526 ARG 71 O 0.0123 -0.0009 0.0050 527 ARG 71 CB 0.0076 0.0014 0.0058 528 ARG 71 CG 0.0085 0.0004 0.0081 529 ARG 71 CD 0.0079 0.0004 0.0098 530 ARG 71 NE 0.0092 -0.0002 0.0094 531 ARG 71 CZ 0.0091 -0.0005 0.0108 532 ARG 71 NH1 0.0079 -0.0002 0.0126 533 ARG 71 NH2 0.0103 -0.0010 0.0102 534 GLY 72 N 0.0119 -0.0003 0.0031 535 GLY 72 CA 0.0138 -0.0014 0.0035 536 GLY 72 C 0.0136 -0.0016 0.0053 537 GLY 72 O 0.0122 -0.0012 0.0067 538 ALA 73 N 0.0150 -0.0023 0.0051 539 ALA 73 CA 0.0149 -0.0026 0.0067 540 ALA 73 C 0.0134 -0.0017 0.0061 541 ALA 73 O 0.0124 -0.0015 0.0076 542 ALA 73 CB 0.0171 -0.0037 0.0067 543 MET 74 N 0.0094 0.0021 0.0016 544 MET 74 CA 0.0088 0.0023 0.0009 545 MET 74 C 0.0077 0.0025 0.0005 546 MET 74 O 0.0069 0.0026 0.0003 547 MET 74 CB 0.0095 0.0022 -0.0001 548 MET 74 CG 0.0106 0.0020 0.0003 549 MET 74 SD 0.0103 0.0020 0.0009 550 MET 74 CE 0.0097 0.0022 -0.0003 551 ARG 75 N 0.0076 0.0025 0.0003 552 ARG 75 CA 0.0066 0.0027 -0.0002 553 ARG 75 C 0.0062 0.0027 0.0004 554 ARG 75 O 0.0068 0.0026 0.0010 555 ARG 75 CB 0.0069 0.0028 -0.0014 556 ARG 75 CG 0.0071 0.0028 -0.0022 557 ARG 75 CD 0.0074 0.0029 -0.0034 558 ARG 75 NE 0.0083 0.0027 -0.0035 559 ARG 75 CZ 0.0086 0.0028 -0.0044 560 ARG 75 NH1 0.0081 0.0029 -0.0054 561 ARG 75 NH2 0.0095 0.0026 -0.0043 562 GLU 76 N 0.0051 0.0029 0.0003 563 GLU 76 CA 0.0046 0.0030 0.0007 564 GLU 76 C 0.0043 0.0031 -0.0003 565 GLU 76 O 0.0040 0.0032 -0.0013 566 GLU 76 CB 0.0036 0.0031 0.0014 567 GLU 76 CG 0.0028 0.0032 0.0009 568 GLU 76 CD 0.0018 0.0033 0.0017 569 GLU 76 OE1 0.0019 0.0032 0.0027 570 GLU 76 OE2 0.0011 0.0035 0.0013 571 CYS 77 N 0.0042 0.0021 -0.0016 572 CYS 77 CA 0.0047 0.0025 -0.0019 573 CYS 77 C 0.0044 0.0023 -0.0018 574 CYS 77 O 0.0044 0.0017 -0.0013 575 CYS 77 CB 0.0056 0.0025 -0.0019 576 CYS 77 SG 0.0059 0.0027 -0.0020 577 PHE 78 N 0.0043 0.0027 -0.0022 578 PHE 78 CA 0.0041 0.0026 -0.0021 579 PHE 78 C 0.0047 0.0030 -0.0023 580 PHE 78 O 0.0049 0.0036 -0.0028 581 PHE 78 CB 0.0032 0.0028 -0.0023 582 PHE 78 CG 0.0025 0.0025 -0.0021 583 PHE 78 CD1 0.0023 0.0027 -0.0023 584 PHE 78 CD2 0.0021 0.0019 -0.0017 585 PHE 78 CE1 0.0017 0.0024 -0.0022 586 PHE 78 CE2 0.0014 0.0016 -0.0016 587 PHE 78 CZ 0.0013 0.0018 -0.0018 588 ARG 79 N 0.0050 0.0027 -0.0021 589 ARG 79 CA 0.0055 0.0030 -0.0023 590 ARG 79 C 0.0050 0.0035 -0.0027 591 ARG 79 O 0.0043 0.0033 -0.0026 592 ARG 79 CB 0.0059 0.0026 -0.0019 593 ARG 79 CG 0.0065 0.0021 -0.0015 594 ARG 79 CD 0.0070 0.0018 -0.0011 595 ARG 79 NE 0.0076 0.0013 -0.0007 596 ARG 79 CZ 0.0074 0.0007 -0.0002 597 ARG 79 NH1 0.0067 0.0004 -0.0000 598 ARG 79 NH2 0.0079 0.0003 0.0001 599 THR 80 N 0.0060 0.0033 -0.0022 600 THR 80 CA 0.0056 0.0036 -0.0026 601 THR 80 C 0.0065 0.0041 -0.0021 602 THR 80 O 0.0073 0.0047 -0.0017 603 THR 80 CB 0.0048 0.0045 -0.0035 604 THR 80 CG2 0.0042 0.0046 -0.0039 605 THR 80 OG1 0.0040 0.0040 -0.0039 606 LYS 81 N 0.0064 0.0039 -0.0021 607 LYS 81 CA 0.0071 0.0046 -0.0018 608 LYS 81 C 0.0064 0.0053 -0.0026 609 LYS 81 O 0.0054 0.0048 -0.0031 610 LYS 81 CB 0.0076 0.0037 -0.0011 611 LYS 81 CG 0.0086 0.0033 -0.0003 612 LYS 81 CD 0.0092 0.0027 0.0004 613 LYS 81 CE 0.0101 0.0022 0.0013 614 LYS 81 NZ 0.0110 0.0033 0.0015 615 LYS 82 N 0.0069 0.0064 -0.0026 616 LYS 82 CA 0.0063 0.0072 -0.0033 617 LYS 82 C 0.0070 0.0079 -0.0030 618 LYS 82 O 0.0080 0.0083 -0.0025 619 LYS 82 CB 0.0059 0.0082 -0.0040 620 LYS 82 CG 0.0051 0.0088 -0.0048 621 LYS 82 CD 0.0048 0.0099 -0.0054 622 LYS 82 CE 0.0058 0.0108 -0.0050 623 LYS 82 NZ 0.0063 0.0115 -0.0048 624 LEU 83 N 0.0083 0.0110 -0.0028 625 LEU 83 CA 0.0078 0.0101 -0.0019 626 LEU 83 C 0.0081 0.0108 -0.0024 627 LEU 83 O 0.0088 0.0111 -0.0040 628 LEU 83 CB 0.0076 0.0080 -0.0022 629 LEU 83 CG 0.0071 0.0071 -0.0013 630 LEU 83 CD1 0.0070 0.0050 -0.0018 631 LEU 83 CD2 0.0064 0.0074 0.0007 632 SER 84 N 0.0077 0.0111 -0.0012 633 SER 84 CA 0.0080 0.0118 -0.0015 634 SER 84 C 0.0080 0.0103 -0.0022 635 SER 84 O 0.0075 0.0087 -0.0017 636 SER 84 CB 0.0075 0.0127 0.0001 637 SER 84 OG 0.0077 0.0132 -0.0002 638 ASN 85 N 0.0085 0.0107 -0.0035 639 ASN 85 CA 0.0086 0.0094 -0.0041 640 ASN 85 C 0.0083 0.0099 -0.0033 641 ASN 85 O 0.0083 0.0089 -0.0036 642 ASN 85 CB 0.0093 0.0095 -0.0061 643 ASN 85 CG 0.0096 0.0089 -0.0071 644 ASN 85 ND2 0.0103 0.0094 -0.0087 645 ASN 85 OD1 0.0092 0.0079 -0.0064 646 PHE 86 N 0.0136 0.0098 0.0013 647 PHE 86 CA 0.0105 0.0086 0.0039 648 PHE 86 C 0.0078 0.0066 0.0063 649 PHE 86 O 0.0065 0.0034 0.0082 650 PHE 86 CB 0.0085 0.0126 0.0041 651 PHE 86 CG 0.0053 0.0117 0.0066 652 PHE 86 CD1 0.0059 0.0088 0.0070 653 PHE 86 CD2 0.0017 0.0139 0.0085 654 PHE 86 CE1 0.0029 0.0080 0.0093 655 PHE 86 CE2 -0.0013 0.0131 0.0108 656 PHE 86 CZ -0.0007 0.0102 0.0112 657 LEU 87 N 0.0071 0.0084 0.0063 658 LEU 87 CA 0.0051 0.0064 0.0083 659 LEU 87 C 0.0076 0.0024 0.0077 660 LEU 87 O 0.0110 0.0020 0.0055 661 LEU 87 CB 0.0036 0.0097 0.0083 662 LEU 87 CG 0.0008 0.0137 0.0091 663 LEU 87 CD1 -0.0002 0.0168 0.0089 664 LEU 87 CD2 -0.0026 0.0124 0.0119 665 HIS 88 N 0.0058 -0.0006 0.0099 666 HIS 88 CA 0.0079 -0.0047 0.0097 667 HIS 88 C 0.0093 -0.0045 0.0086 668 HIS 88 O 0.0123 -0.0066 0.0071 669 HIS 88 CB 0.0055 -0.0084 0.0124 670 HIS 88 CG 0.0051 -0.0099 0.0131 671 HIS 88 CD2 0.0063 -0.0085 0.0119 672 HIS 88 ND1 0.0033 -0.0134 0.0154 673 HIS 88 CE1 0.0034 -0.0141 0.0155 674 HIS 88 NE2 0.0052 -0.0111 0.0134 675 ALA 89 N 0.0115 0.0085 0.0070 676 ALA 89 CA 0.0123 0.0075 0.0063 677 ALA 89 C 0.0120 0.0080 0.0059 678 ALA 89 O 0.0121 0.0076 0.0066 679 ALA 89 CB 0.0130 0.0062 0.0074 680 GLN 90 N 0.0114 0.0089 0.0047 681 GLN 90 CA 0.0111 0.0095 0.0042 682 GLN 90 C 0.0119 0.0086 0.0031 683 GLN 90 O 0.0124 0.0080 0.0022 684 GLN 90 CB 0.0103 0.0108 0.0034 685 GLN 90 CG 0.0097 0.0116 0.0031 686 GLN 90 CD 0.0090 0.0129 0.0022 687 GLN 90 NE2 0.0082 0.0139 0.0026 688 GLN 90 OE1 0.0091 0.0129 0.0010 689 GLN 91 N 0.0119 0.0085 0.0033 690 GLN 91 CA 0.0125 0.0078 0.0023 691 GLN 91 C 0.0120 0.0087 0.0011 692 GLN 91 O 0.0112 0.0099 0.0013 693 GLN 91 CB 0.0130 0.0070 0.0033 694 GLN 91 CG 0.0133 0.0063 0.0048 695 GLN 91 CD 0.0140 0.0053 0.0045 696 GLN 91 NE2 0.0139 0.0053 0.0054 697 GLN 91 OE1 0.0147 0.0046 0.0035 698 TRP 92 N 0.0126 0.0054 0.0020 699 TRP 92 CA 0.0118 0.0048 0.0010 700 TRP 92 C 0.0127 0.0044 0.0016 701 TRP 92 O 0.0120 0.0043 0.0010 702 TRP 92 CB 0.0113 0.0031 -0.0001 703 TRP 92 CG 0.0100 0.0036 -0.0010 704 TRP 92 CD1 0.0100 0.0032 -0.0011 705 TRP 92 CD2 0.0084 0.0045 -0.0019 706 TRP 92 CE2 0.0076 0.0046 -0.0025 707 TRP 92 CE3 0.0076 0.0051 -0.0022 708 TRP 92 NE1 0.0086 0.0039 -0.0020 709 TRP 92 CZ2 0.0060 0.0054 -0.0034 710 TRP 92 CZ3 0.0061 0.0059 -0.0031 711 TRP 92 CH2 0.0053 0.0060 -0.0037 712 LYS 93 N 0.0142 0.0041 0.0027 713 LYS 93 CA 0.0151 0.0037 0.0033 714 LYS 93 C 0.0148 0.0054 0.0037 715 LYS 93 O 0.0149 0.0052 0.0037 716 LYS 93 CB 0.0168 0.0032 0.0044 717 LYS 93 CG 0.0172 0.0037 0.0050 718 LYS 93 CD 0.0189 0.0030 0.0061 719 LYS 93 CE 0.0194 0.0035 0.0066 720 LYS 93 NZ 0.0187 0.0026 0.0057 721 GLY 94 N 0.0144 0.0070 0.0040 722 GLY 94 CA 0.0140 0.0087 0.0044 723 GLY 94 C 0.0123 0.0097 0.0035 724 GLY 94 O 0.0120 0.0112 0.0038 725 ALA 95 N 0.0116 0.0078 0.0018 726 ALA 95 CA 0.0105 0.0082 0.0016 727 ALA 95 C 0.0103 0.0078 0.0015 728 ALA 95 O 0.0107 0.0068 0.0014 729 ALA 95 CB 0.0096 0.0077 0.0013 730 SER 96 N 0.0096 0.0085 0.0014 731 SER 96 CA 0.0093 0.0082 0.0013 732 SER 96 C 0.0084 0.0072 0.0009 733 SER 96 O 0.0078 0.0069 0.0008 734 SER 96 CB 0.0088 0.0093 0.0014 735 SER 96 OG 0.0097 0.0101 0.0018 736 ASN 97 N 0.0083 0.0067 0.0008 737 ASN 97 CA 0.0075 0.0058 0.0005 738 ASN 97 C 0.0064 0.0063 0.0003 739 ASN 97 O 0.0064 0.0071 0.0005 740 ASN 97 CB 0.0081 0.0048 0.0004 741 ASN 97 CG 0.0092 0.0042 0.0005 742 ASN 97 ND2 0.0101 0.0040 0.0007 743 ASN 97 OD1 0.0092 0.0039 0.0005 744 TYR 98 N 0.0074 0.0048 -0.0009 745 TYR 98 CA 0.0067 0.0052 -0.0012 746 TYR 98 C 0.0062 0.0046 -0.0017 747 TYR 98 O 0.0063 0.0038 -0.0018 748 TYR 98 CB 0.0064 0.0056 -0.0013 749 TYR 98 CG 0.0068 0.0062 -0.0009 750 TYR 98 CD1 0.0074 0.0060 -0.0006 751 TYR 98 CD2 0.0066 0.0070 -0.0008 752 TYR 98 CE1 0.0078 0.0065 -0.0002 753 TYR 98 CE2 0.0070 0.0076 -0.0004 754 TYR 98 CZ 0.0076 0.0074 -0.0001 755 TYR 98 OH 0.0080 0.0079 0.0003 756 VAL 99 N 0.0056 0.0049 -0.0019 757 VAL 99 CA 0.0051 0.0044 -0.0023 758 VAL 99 C 0.0044 0.0047 -0.0026 759 VAL 99 O 0.0041 0.0055 -0.0026 760 VAL 99 CB 0.0049 0.0046 -0.0024 761 VAL 99 CG1 0.0043 0.0040 -0.0029 762 VAL 99 CG2 0.0056 0.0044 -0.0021 763 ALA 100 N 0.0041 0.0042 -0.0030 764 ALA 100 CA 0.0034 0.0043 -0.0033 765 ALA 100 C 0.0028 0.0039 -0.0037 766 ALA 100 O 0.0028 0.0032 -0.0039 767 ALA 100 CB 0.0035 0.0040 -0.0033 768 LYS 101 N 0.0027 0.0043 -0.0044 769 LYS 101 CA 0.0032 0.0042 -0.0035 770 LYS 101 C 0.0027 0.0043 -0.0036 771 LYS 101 O 0.0025 0.0043 -0.0046 772 LYS 101 CB 0.0045 0.0040 -0.0037 773 LYS 101 CG 0.0051 0.0040 -0.0035 774 LYS 101 CD 0.0061 0.0039 -0.0043 775 LYS 101 CE 0.0069 0.0038 -0.0039 776 LYS 101 NZ 0.0082 0.0036 -0.0043 777 ARG 102 N 0.0026 0.0042 -0.0026 778 ARG 102 CA 0.0021 0.0043 -0.0025 779 ARG 102 C 0.0028 0.0042 -0.0016 780 ARG 102 O 0.0031 0.0041 -0.0007 781 ARG 102 CB 0.0008 0.0044 -0.0021 782 ARG 102 CG 0.0003 0.0045 -0.0018 783 ARG 102 CD 0.0002 0.0046 -0.0029 784 ARG 102 NE -0.0007 0.0047 -0.0027 785 ARG 102 CZ -0.0009 0.0047 -0.0036 786 ARG 102 NH1 -0.0005 0.0047 -0.0047 787 ARG 102 NH2 -0.0017 0.0048 -0.0033 788 TYR 103 N 0.0031 0.0042 -0.0019 789 TYR 103 CA 0.0038 0.0040 -0.0011 790 TYR 103 C 0.0030 0.0041 -0.0000 791 TYR 103 O 0.0020 0.0042 -0.0001 792 TYR 103 CB 0.0042 0.0040 -0.0017 793 TYR 103 CG 0.0053 0.0039 -0.0024 794 TYR 103 CD1 0.0064 0.0037 -0.0018 795 TYR 103 CD2 0.0054 0.0039 -0.0036 796 TYR 103 CE1 0.0075 0.0036 -0.0024 797 TYR 103 CE2 0.0064 0.0038 -0.0042 798 TYR 103 CZ 0.0075 0.0037 -0.0036 799 TYR 103 OH 0.0085 0.0036 -0.0042 800 ILE 104 N 0.0042 0.0038 0.0009 801 ILE 104 CA 0.0030 0.0044 0.0034 802 ILE 104 C 0.0027 0.0045 0.0045 803 ILE 104 O 0.0008 0.0054 0.0053 804 ILE 104 CB 0.0042 0.0038 0.0052 805 ILE 104 CG1 0.0045 0.0037 0.0039 806 ILE 104 CG2 0.0030 0.0044 0.0077 807 ILE 104 CD1 0.0061 0.0030 0.0053 808 GLU 105 N 0.0046 0.0037 0.0046 809 GLU 105 CA 0.0043 0.0038 0.0054 810 GLU 105 C 0.0037 0.0041 0.0031 811 GLU 105 O 0.0047 0.0036 0.0010 812 GLU 105 CB 0.0066 0.0028 0.0066 813 GLU 105 CG 0.0073 0.0024 0.0089 814 GLU 105 CD 0.0056 0.0032 0.0110 815 GLU 105 OE1 0.0044 0.0038 0.0114 816 GLU 105 OE2 0.0053 0.0034 0.0123 817 PRO 106 N 0.0021 0.0048 0.0033 818 PRO 106 CA 0.0014 0.0051 0.0011 819 PRO 106 C 0.0034 0.0042 0.0002 820 PRO 106 O 0.0047 0.0036 0.0016 821 PRO 106 CB -0.0005 0.0060 0.0021 822 PRO 106 CG -0.0002 0.0059 0.0049 823 PRO 106 CD 0.0008 0.0054 0.0056 824 VAL 107 N 0.0041 0.0052 -0.0016 825 VAL 107 CA 0.0053 0.0049 -0.0025 826 VAL 107 C 0.0046 0.0049 -0.0039 827 VAL 107 O 0.0033 0.0051 -0.0042 828 VAL 107 CB 0.0064 0.0046 -0.0029 829 VAL 107 CG1 0.0070 0.0046 -0.0015 830 VAL 107 CG2 0.0056 0.0047 -0.0039 831 ASP 108 N 0.0056 0.0046 -0.0048 832 ASP 108 CA 0.0051 0.0046 -0.0062 833 ASP 108 C 0.0047 0.0046 -0.0073 834 ASP 108 O 0.0052 0.0045 -0.0073 835 ASP 108 CB 0.0064 0.0043 -0.0068 836 ASP 108 CG 0.0058 0.0043 -0.0079 837 ASP 108 OD1 0.0049 0.0044 -0.0090 838 ASP 108 OD2 0.0062 0.0043 -0.0078 839 ARG 109 N 0.0037 0.0047 -0.0084 840 ARG 109 CA 0.0032 0.0048 -0.0095 841 ARG 109 C 0.0044 0.0044 -0.0105 842 ARG 109 O 0.0043 0.0044 -0.0111 843 ARG 109 CB 0.0019 0.0049 -0.0104 844 ARG 109 CG 0.0004 0.0053 -0.0097 845 ARG 109 CD -0.0008 0.0055 -0.0107 846 ARG 109 NE -0.0014 0.0055 -0.0118 847 ARG 109 CZ -0.0010 0.0053 -0.0132 848 ARG 109 NH1 0.0000 0.0051 -0.0138 849 ARG 109 NH2 -0.0016 0.0054 -0.0140 850 ASP 110 N 0.0062 0.0034 -0.0094 851 ASP 110 CA 0.0068 0.0031 -0.0099 852 ASP 110 C 0.0072 0.0034 -0.0094 853 ASP 110 O 0.0075 0.0032 -0.0098 854 ASP 110 CB 0.0077 0.0029 -0.0103 855 ASP 110 CG 0.0082 0.0025 -0.0111 856 ASP 110 OD1 0.0077 0.0022 -0.0117 857 ASP 110 OD2 0.0090 0.0026 -0.0109 858 VAL 111 N 0.0072 0.0038 -0.0085 859 VAL 111 CA 0.0075 0.0041 -0.0080 860 VAL 111 C 0.0069 0.0040 -0.0082 861 VAL 111 O 0.0072 0.0040 -0.0082 862 VAL 111 CB 0.0075 0.0046 -0.0070 863 VAL 111 CG1 0.0079 0.0048 -0.0065 864 VAL 111 CG2 0.0081 0.0046 -0.0069 865 TYR 112 N 0.0059 0.0040 -0.0083 866 TYR 112 CA 0.0052 0.0039 -0.0085 867 TYR 112 C 0.0055 0.0035 -0.0094 868 TYR 112 O 0.0055 0.0034 -0.0094 869 TYR 112 CB 0.0042 0.0040 -0.0084 870 TYR 112 CG 0.0039 0.0044 -0.0075 871 TYR 112 CD1 0.0040 0.0046 -0.0072 872 TYR 112 CD2 0.0034 0.0047 -0.0070 873 TYR 112 CE1 0.0037 0.0050 -0.0064 874 TYR 112 CE2 0.0031 0.0051 -0.0062 875 TYR 112 CZ 0.0033 0.0053 -0.0058 876 TYR 112 OH 0.0030 0.0057 -0.0050 877 PHE 113 N 0.0051 0.0032 -0.0089 878 PHE 113 CA 0.0052 0.0029 -0.0094 879 PHE 113 C 0.0057 0.0023 -0.0094 880 PHE 113 O 0.0058 0.0020 -0.0099 881 PHE 113 CB 0.0051 0.0030 -0.0094 882 PHE 113 CG 0.0046 0.0036 -0.0095 883 PHE 113 CD1 0.0044 0.0040 -0.0089 884 PHE 113 CD2 0.0044 0.0037 -0.0101 885 PHE 113 CE1 0.0040 0.0045 -0.0090 886 PHE 113 CE2 0.0040 0.0042 -0.0102 887 PHE 113 CZ 0.0038 0.0046 -0.0097 888 GLU 114 N 0.0059 0.0021 -0.0088 889 GLU 114 CA 0.0063 0.0015 -0.0088 890 GLU 114 C 0.0064 0.0014 -0.0090 891 GLU 114 O 0.0067 0.0010 -0.0093 892 GLU 114 CB 0.0066 0.0014 -0.0081 893 GLU 114 CG 0.0071 0.0008 -0.0080 894 GLU 114 CD 0.0072 0.0005 -0.0084 895 GLU 114 OE1 0.0070 0.0008 -0.0084 896 GLU 114 OE2 0.0075 0.0001 -0.0087 897 ASP 115 N 0.0062 0.0018 -0.0089 898 ASP 115 CA 0.0062 0.0017 -0.0091 899 ASP 115 C 0.0060 0.0017 -0.0099 900 ASP 115 O 0.0062 0.0013 -0.0102 901 ASP 115 CB 0.0059 0.0021 -0.0088 902 ASP 115 CG 0.0061 0.0021 -0.0081 903 ASP 115 OD1 0.0064 0.0017 -0.0079 904 ASP 115 OD2 0.0058 0.0025 -0.0078 905 VAL 116 N 0.0047 0.0008 -0.0085 906 VAL 116 CA 0.0044 0.0006 -0.0086 907 VAL 116 C 0.0042 0.0000 -0.0084 908 VAL 116 O 0.0038 -0.0002 -0.0086 909 VAL 116 CB 0.0047 0.0008 -0.0084 910 VAL 116 CG1 0.0045 0.0005 -0.0085 911 VAL 116 CG2 0.0049 0.0013 -0.0087 912 ARG 117 N 0.0044 -0.0002 -0.0080 913 ARG 117 CA 0.0042 -0.0007 -0.0078 914 ARG 117 C 0.0039 -0.0009 -0.0081 915 ARG 117 O 0.0036 -0.0012 -0.0081 916 ARG 117 CB 0.0046 -0.0009 -0.0073 917 ARG 117 CG 0.0049 -0.0008 -0.0071 918 ARG 117 CD 0.0052 -0.0010 -0.0066 919 ARG 117 NE 0.0055 -0.0007 -0.0065 920 ARG 117 CZ 0.0059 -0.0004 -0.0063 921 ARG 117 NH1 0.0060 -0.0004 -0.0062 922 ARG 117 NH2 0.0062 -0.0002 -0.0062 923 LEU 118 N 0.0040 -0.0006 -0.0082 924 LEU 118 CA 0.0036 -0.0007 -0.0085 925 LEU 118 C 0.0032 -0.0007 -0.0089 926 LEU 118 O 0.0029 -0.0011 -0.0090 927 LEU 118 CB 0.0038 -0.0004 -0.0086 928 LEU 118 CG 0.0036 -0.0004 -0.0088 929 LEU 118 CD1 0.0039 -0.0001 -0.0087 930 LEU 118 CD2 0.0032 -0.0004 -0.0092 931 GLN 119 N 0.0027 -0.0004 -0.0051 932 GLN 119 CA 0.0022 -0.0003 -0.0051 933 GLN 119 C 0.0020 -0.0007 -0.0051 934 GLN 119 O 0.0017 -0.0007 -0.0051 935 GLN 119 CB 0.0020 -0.0001 -0.0050 936 GLN 119 CG 0.0015 -0.0000 -0.0049 937 GLN 119 CD 0.0014 0.0004 -0.0048 938 GLN 119 NE2 0.0009 0.0005 -0.0048 939 GLN 119 OE1 0.0017 0.0007 -0.0048 940 MET 120 N 0.0021 -0.0011 -0.0052 941 MET 120 CA 0.0019 -0.0015 -0.0053 942 MET 120 C 0.0021 -0.0016 -0.0054 943 MET 120 O 0.0018 -0.0018 -0.0054 944 MET 120 CB 0.0020 -0.0019 -0.0054 945 MET 120 CG 0.0018 -0.0018 -0.0054 946 MET 120 SD 0.0013 -0.0015 -0.0053 947 MET 120 CE 0.0009 -0.0020 -0.0053 948 GLU 121 N 0.0025 -0.0015 -0.0054 949 GLU 121 CA 0.0026 -0.0016 -0.0054 950 GLU 121 C 0.0024 -0.0013 -0.0053 951 GLU 121 O 0.0023 -0.0015 -0.0053 952 GLU 121 CB 0.0031 -0.0015 -0.0054 953 GLU 121 CG 0.0033 -0.0016 -0.0055 954 GLU 121 CD 0.0034 -0.0020 -0.0056 955 GLU 121 OE1 0.0034 -0.0023 -0.0056 956 GLU 121 OE2 0.0035 -0.0021 -0.0056 957 ALA 122 N 0.0016 -0.0003 -0.0032 958 ALA 122 CA 0.0009 0.0009 -0.0024 959 ALA 122 C -0.0003 0.0003 -0.0014 960 ALA 122 O -0.0009 0.0011 -0.0007 961 ALA 122 CB 0.0010 0.0018 -0.0024 962 LYS 123 N -0.0006 -0.0010 -0.0012 963 LYS 123 CA -0.0017 -0.0017 -0.0002 964 LYS 123 C -0.0018 -0.0021 -0.0002 965 LYS 123 O -0.0027 -0.0018 0.0006 966 LYS 123 CB -0.0020 -0.0031 -0.0001 967 LYS 123 CG -0.0031 -0.0039 0.0008 968 LYS 123 CD -0.0033 -0.0052 0.0008 969 LYS 123 CE -0.0044 -0.0059 0.0019 970 LYS 123 NZ -0.0052 -0.0049 0.0027 971 LEU 124 N -0.0010 -0.0027 -0.0010 972 LEU 124 CA -0.0010 -0.0030 -0.0011 973 LEU 124 C -0.0011 -0.0016 -0.0008 974 LEU 124 O -0.0016 -0.0016 -0.0003 975 LEU 124 CB 0.0001 -0.0038 -0.0021 976 LEU 124 CG 0.0002 -0.0054 -0.0024 977 LEU 124 CD1 0.0012 -0.0060 -0.0034 978 LEU 124 CD2 -0.0009 -0.0063 -0.0015 979 TRP 125 N -0.0023 -0.0040 -0.0014 980 TRP 125 CA -0.0026 -0.0025 -0.0013 981 TRP 125 C -0.0033 -0.0021 -0.0002 982 TRP 125 O -0.0039 -0.0013 0.0003 983 TRP 125 CB -0.0022 -0.0017 -0.0025 984 TRP 125 CG -0.0016 -0.0017 -0.0035 985 TRP 125 CD1 -0.0009 -0.0023 -0.0045 986 TRP 125 CD2 -0.0017 -0.0011 -0.0035 987 TRP 125 CE2 -0.0011 -0.0014 -0.0046 988 TRP 125 CE3 -0.0023 -0.0003 -0.0028 989 TRP 125 NE1 -0.0006 -0.0021 -0.0051 990 TRP 125 CZ2 -0.0010 -0.0009 -0.0049 991 TRP 125 CZ3 -0.0023 0.0001 -0.0031 992 TRP 125 CH2 -0.0016 -0.0002 -0.0042 993 GLY 126 N -0.0034 -0.0026 0.0001 994 GLY 126 CA -0.0041 -0.0024 0.0012 995 GLY 126 C -0.0046 -0.0028 0.0023 996 GLY 126 O -0.0052 -0.0021 0.0031 997 GLU 127 N -0.0043 -0.0040 0.0023 998 GLU 127 CA -0.0047 -0.0045 0.0032 999 GLU 127 C -0.0050 -0.0036 0.0032 1000 GLU 127 O -0.0056 -0.0033 0.0042 1001 GLU 127 CB -0.0043 -0.0059 0.0031 1002 GLU 127 CG -0.0041 -0.0069 0.0031 1003 GLU 127 CD -0.0037 -0.0082 0.0029 1004 GLU 127 OE1 -0.0036 -0.0085 0.0029 1005 GLU 127 OE2 -0.0034 -0.0091 0.0027 1006 GLU 128 N -0.0051 -0.0062 0.0012 1007 GLU 128 CA -0.0049 -0.0052 0.0010 1008 GLU 128 C -0.0049 -0.0043 0.0018 1009 GLU 128 O -0.0048 -0.0036 0.0022 1010 GLU 128 CB -0.0046 -0.0049 -0.0001 1011 GLU 128 CG -0.0044 -0.0039 -0.0004 1012 GLU 128 CD -0.0044 -0.0039 -0.0003 1013 GLU 128 OE1 -0.0045 -0.0048 -0.0004 1014 GLU 128 OE2 -0.0043 -0.0031 -0.0001 1015 TYR 129 N -0.0049 -0.0042 0.0019 1016 TYR 129 CA -0.0049 -0.0034 0.0026 1017 TYR 129 C -0.0051 -0.0036 0.0038 1018 TYR 129 O -0.0051 -0.0028 0.0043 1019 TYR 129 CB -0.0049 -0.0035 0.0026 1020 TYR 129 CG -0.0049 -0.0028 0.0034 1021 TYR 129 CD1 -0.0047 -0.0017 0.0033 1022 TYR 129 CD2 -0.0052 -0.0032 0.0044 1023 TYR 129 CE1 -0.0047 -0.0011 0.0040 1024 TYR 129 CE2 -0.0052 -0.0025 0.0051 1025 TYR 129 CZ -0.0050 -0.0015 0.0049 1026 TYR 129 OH -0.0050 -0.0008 0.0057 1027 ASN 130 N -0.0054 -0.0046 0.0041 1028 ASN 130 CA -0.0056 -0.0048 0.0052 1029 ASN 130 C -0.0056 -0.0044 0.0053 1030 ASN 130 O -0.0057 -0.0041 0.0062 1031 ASN 130 CB -0.0058 -0.0059 0.0054 1032 ASN 130 CG -0.0059 -0.0063 0.0054 1033 ASN 130 ND2 -0.0061 -0.0073 0.0053 1034 ASN 130 OD1 -0.0058 -0.0056 0.0056 1035 ARG 131 N -0.0059 -0.0045 0.0058 1036 ARG 131 CA -0.0059 -0.0041 0.0060 1037 ARG 131 C -0.0059 -0.0030 0.0063 1038 ARG 131 O -0.0059 -0.0027 0.0067 1039 ARG 131 CB -0.0058 -0.0043 0.0051 1040 ARG 131 CG -0.0059 -0.0054 0.0051 1041 ARG 131 CD -0.0058 -0.0055 0.0044 1042 ARG 131 NE -0.0057 -0.0056 0.0033 1043 ARG 131 CZ -0.0057 -0.0064 0.0029 1044 ARG 131 NH1 -0.0058 -0.0073 0.0034 1045 ARG 131 NH2 -0.0057 -0.0064 0.0020 1046 HIS 132 N -0.0058 -0.0024 0.0060 1047 HIS 132 CA -0.0058 -0.0014 0.0063 1048 HIS 132 C -0.0059 -0.0012 0.0073 1049 HIS 132 O -0.0059 -0.0004 0.0075 1050 HIS 132 CB -0.0057 -0.0008 0.0055 1051 HIS 132 CG -0.0056 -0.0007 0.0045 1052 HIS 132 CD2 -0.0056 0.0000 0.0040 1053 HIS 132 ND1 -0.0056 -0.0016 0.0039 1054 HIS 132 CE1 -0.0055 -0.0013 0.0031 1055 HIS 132 NE2 -0.0055 -0.0003 0.0031 1056 LYS 133 N -0.0060 -0.0020 0.0079 1057 LYS 133 CA -0.0061 -0.0019 0.0090 1058 LYS 133 C -0.0060 -0.0015 0.0090 1059 LYS 133 O -0.0061 -0.0006 0.0095 1060 LYS 133 CB -0.0061 -0.0014 0.0096 1061 LYS 133 CG -0.0061 -0.0017 0.0095 1062 LYS 133 CD -0.0062 -0.0014 0.0103 1063 LYS 133 CE -0.0061 -0.0015 0.0100 1064 LYS 133 NZ -0.0061 -0.0025 0.0097 1065 PRO 134 N -0.0054 -0.0034 0.0085 1066 PRO 134 CA -0.0054 -0.0033 0.0084 1067 PRO 134 C -0.0051 -0.0037 0.0096 1068 PRO 134 O -0.0049 -0.0043 0.0102 1069 PRO 134 CB -0.0056 -0.0041 0.0074 1070 PRO 134 CG -0.0056 -0.0050 0.0075 1071 PRO 134 CD -0.0055 -0.0044 0.0078 1072 PRO 135 N -0.0051 -0.0034 0.0098 1073 PRO 135 CA -0.0048 -0.0039 0.0108 1074 PRO 135 C -0.0047 -0.0052 0.0109 1075 PRO 135 O -0.0045 -0.0057 0.0118 1076 PRO 135 CB -0.0048 -0.0033 0.0108 1077 PRO 135 CG -0.0051 -0.0030 0.0096 1078 PRO 135 CD -0.0053 -0.0027 0.0091 1079 LYS 136 N -0.0050 -0.0058 0.0099 1080 LYS 136 CA -0.0049 -0.0071 0.0098 1081 LYS 136 C -0.0052 -0.0074 0.0088 1082 LYS 136 O -0.0054 -0.0071 0.0079 1083 LYS 136 CB -0.0050 -0.0076 0.0097 1084 LYS 136 CG -0.0047 -0.0075 0.0108 1085 LYS 136 CD -0.0047 -0.0080 0.0106 1086 LYS 136 CE -0.0044 -0.0079 0.0117 1087 LYS 136 NZ -0.0045 -0.0084 0.0115 1088 GLN 137 N -0.0087 -0.0046 0.0068 1089 GLN 137 CA -0.0080 -0.0049 0.0071 1090 GLN 137 C -0.0074 -0.0044 0.0069 1091 GLN 137 O -0.0075 -0.0039 0.0065 1092 GLN 137 CB -0.0081 -0.0054 0.0074 1093 GLN 137 CG -0.0085 -0.0060 0.0077 1094 GLN 137 CD -0.0085 -0.0066 0.0080 1095 GLN 137 NE2 -0.0091 -0.0069 0.0082 1096 GLN 137 OE1 -0.0079 -0.0067 0.0082 1097 VAL 138 N -0.0067 -0.0046 0.0070 1098 VAL 138 CA -0.0061 -0.0042 0.0069 1099 VAL 138 C -0.0055 -0.0046 0.0071 1100 VAL 138 O -0.0056 -0.0051 0.0075 1101 VAL 138 CB -0.0057 -0.0040 0.0068 1102 VAL 138 CG1 -0.0062 -0.0036 0.0065 1103 VAL 138 CG2 -0.0054 -0.0046 0.0071 1104 ASP 139 N -0.0050 -0.0042 0.0070 1105 ASP 139 CA -0.0044 -0.0045 0.0072 1106 ASP 139 C -0.0037 -0.0040 0.0070 1107 ASP 139 O -0.0038 -0.0034 0.0066 1108 ASP 139 CB -0.0046 -0.0046 0.0073 1109 ASP 139 CG -0.0041 -0.0051 0.0076 1110 ASP 139 OD1 -0.0036 -0.0053 0.0078 1111 ASP 139 OD2 -0.0043 -0.0053 0.0077 1112 ILE 140 N -0.0008 -0.0005 0.0003 1113 ILE 140 CA -0.0009 -0.0003 0.0007 1114 ILE 140 C -0.0010 0.0002 0.0006 1115 ILE 140 O -0.0011 0.0003 0.0005 1116 ILE 140 CB -0.0009 -0.0004 0.0011 1117 ILE 140 CG1 -0.0008 -0.0008 0.0012 1118 ILE 140 CG2 -0.0010 -0.0001 0.0014 1119 ILE 140 CD1 -0.0007 -0.0012 0.0010 1120 MET 141 N -0.0011 0.0004 0.0007 1121 MET 141 CA -0.0012 0.0008 0.0006 1122 MET 141 C -0.0013 0.0010 0.0009 1123 MET 141 O -0.0013 0.0009 0.0013 1124 MET 141 CB -0.0013 0.0011 0.0007 1125 MET 141 CG -0.0012 0.0009 0.0004 1126 MET 141 SD -0.0013 0.0011 -0.0001 1127 MET 141 CE -0.0014 0.0016 0.0000 1128 GLN 142 N -0.0014 0.0013 0.0008 1129 GLN 142 CA -0.0014 0.0015 0.0010 1130 GLN 142 C -0.0015 0.0018 0.0013 1131 GLN 142 O -0.0016 0.0019 0.0012 1132 GLN 142 CB -0.0015 0.0017 0.0008 1133 GLN 142 CG -0.0016 0.0021 0.0010 1134 GLN 142 CD -0.0016 0.0022 0.0008 1135 GLN 142 NE2 -0.0017 0.0025 0.0005 1136 GLN 142 OE1 -0.0016 0.0021 0.0009 1137 MET 143 N 0.0049 0.0037 -0.0087 1138 MET 143 CA 0.0044 0.0037 -0.0082 1139 MET 143 C 0.0040 0.0039 -0.0086 1140 MET 143 O 0.0042 0.0039 -0.0089 1141 MET 143 CB 0.0047 0.0036 -0.0077 1142 MET 143 CG 0.0042 0.0036 -0.0072 1143 MET 143 SD 0.0045 0.0034 -0.0066 1144 MET 143 CE 0.0048 0.0034 -0.0069 1145 CYS 144 N 0.0034 0.0040 -0.0085 1146 CYS 144 CA 0.0030 0.0042 -0.0088 1147 CYS 144 C 0.0025 0.0042 -0.0083 1148 CYS 144 O 0.0026 0.0041 -0.0077 1149 CYS 144 CB 0.0026 0.0043 -0.0093 1150 CYS 144 SG 0.0021 0.0044 -0.0089 1151 ILE 145 N 0.0020 0.0043 -0.0085 1152 ILE 145 CA 0.0016 0.0043 -0.0081 1153 ILE 145 C 0.0009 0.0045 -0.0082 1154 ILE 145 O 0.0008 0.0046 -0.0088 1155 ILE 145 CB 0.0016 0.0044 -0.0082 1156 ILE 145 CG1 0.0021 0.0042 -0.0079 1157 ILE 145 CG2 0.0010 0.0044 -0.0078 1158 ILE 145 CD1 0.0022 0.0042 -0.0081 1159 ILE 146 N 0.0009 0.0083 -0.0104 1160 ILE 146 CA -0.0006 0.0082 -0.0105 1161 ILE 146 C -0.0022 0.0077 -0.0101 1162 ILE 146 O -0.0021 0.0070 -0.0090 1163 ILE 146 CB -0.0003 0.0076 -0.0096 1164 ILE 146 CG1 0.0002 0.0065 -0.0081 1165 ILE 146 CG2 0.0011 0.0081 -0.0102 1166 ILE 146 CD1 -0.0000 0.0058 -0.0070 1167 GLU 147 N -0.0035 0.0082 -0.0110 1168 GLU 147 CA -0.0051 0.0078 -0.0108 1169 GLU 147 C -0.0064 0.0074 -0.0104 1170 GLU 147 O -0.0068 0.0080 -0.0113 1171 GLU 147 CB -0.0058 0.0087 -0.0121 1172 GLU 147 CG -0.0074 0.0084 -0.0119 1173 GLU 147 CD -0.0079 0.0092 -0.0132 1174 GLU 147 OE1 -0.0071 0.0100 -0.0143 1175 GLU 147 OE2 -0.0090 0.0090 -0.0131 1176 LEU 148 N -0.0071 0.0065 -0.0092 1177 LEU 148 CA -0.0083 0.0060 -0.0087 1178 LEU 148 C -0.0101 0.0061 -0.0091 1179 LEU 148 O -0.0109 0.0054 -0.0082 1180 LEU 148 CB -0.0080 0.0050 -0.0071 1181 LEU 148 CG -0.0065 0.0047 -0.0065 1182 LEU 148 CD1 -0.0066 0.0052 -0.0072 1183 LEU 148 CD2 -0.0048 0.0050 -0.0067 1184 LYS 149 N -0.0131 0.0078 -0.0116 1185 LYS 149 CA -0.0152 0.0084 -0.0118 1186 LYS 149 C -0.0172 0.0080 -0.0109 1187 LYS 149 O -0.0191 0.0083 -0.0108 1188 LYS 149 CB -0.0155 0.0100 -0.0138 1189 LYS 149 CG -0.0138 0.0105 -0.0148 1190 LYS 149 CD -0.0143 0.0121 -0.0166 1191 LYS 149 CE -0.0124 0.0126 -0.0176 1192 LYS 149 NZ -0.0127 0.0142 -0.0195 1193 ASP 150 N -0.0168 0.0074 -0.0103 1194 ASP 150 CA -0.0185 0.0069 -0.0093 1195 ASP 150 C -0.0187 0.0053 -0.0073 1196 ASP 150 O -0.0203 0.0049 -0.0064 1197 ASP 150 CB -0.0182 0.0073 -0.0098 1198 ASP 150 CG -0.0189 0.0089 -0.0116 1199 ASP 150 OD1 -0.0206 0.0095 -0.0121 1200 ASP 150 OD2 -0.0176 0.0095 -0.0127 1201 ARG 151 N -0.0170 0.0045 -0.0066 1202 ARG 151 CA -0.0171 0.0030 -0.0048 1203 ARG 151 C -0.0185 0.0029 -0.0044 1204 ARG 151 O -0.0186 0.0038 -0.0055 1205 ARG 151 CB -0.0148 0.0021 -0.0042 1206 ARG 151 CG -0.0135 0.0018 -0.0042 1207 ARG 151 CD -0.0115 0.0006 -0.0031 1208 ARG 151 NE -0.0098 0.0006 -0.0034 1209 ARG 151 CZ -0.0080 -0.0004 -0.0026 1210 ARG 151 NH1 -0.0076 -0.0015 -0.0014 1211 ARG 151 NH2 -0.0066 -0.0003 -0.0030 1212 PRO 152 N -0.0221 0.0002 -0.0011 1213 PRO 152 CA -0.0237 0.0001 -0.0011 1214 PRO 152 C -0.0214 0.0006 -0.0016 1215 PRO 152 O -0.0189 -0.0002 -0.0002 1216 PRO 152 CB -0.0249 -0.0020 0.0016 1217 PRO 152 CG -0.0254 -0.0026 0.0024 1218 PRO 152 CD -0.0227 -0.0015 0.0012 1219 GLY 153 N -0.0222 0.0020 -0.0036 1220 GLY 153 CA -0.0202 0.0026 -0.0043 1221 GLY 153 C -0.0179 0.0043 -0.0064 1222 GLY 153 O -0.0163 0.0050 -0.0073 1223 LYS 154 N -0.0176 0.0049 -0.0071 1224 LYS 154 CA -0.0153 0.0064 -0.0090 1225 LYS 154 C -0.0120 0.0060 -0.0081 1226 LYS 154 O -0.0106 0.0071 -0.0095 1227 LYS 154 CB -0.0162 0.0082 -0.0117 1228 LYS 154 CG -0.0196 0.0086 -0.0126 1229 LYS 154 CD -0.0203 0.0106 -0.0154 1230 LYS 154 CE -0.0230 0.0112 -0.0166 1231 LYS 154 NZ -0.0258 0.0097 -0.0149 1232 PRO 155 N -0.0080 0.0051 -0.0064 1233 PRO 155 CA -0.0064 0.0047 -0.0059 1234 PRO 155 C -0.0050 0.0051 -0.0070 1235 PRO 155 O -0.0053 0.0055 -0.0078 1236 PRO 155 CB -0.0064 0.0041 -0.0044 1237 PRO 155 CG -0.0076 0.0042 -0.0046 1238 PRO 155 CD -0.0089 0.0047 -0.0055 1239 LEU 156 N -0.0036 0.0050 -0.0069 1240 LEU 156 CA -0.0021 0.0053 -0.0078 1241 LEU 156 C -0.0010 0.0048 -0.0067 1242 LEU 156 O -0.0008 0.0042 -0.0054 1243 LEU 156 CB -0.0013 0.0055 -0.0085 1244 LEU 156 CG -0.0021 0.0062 -0.0098 1245 LEU 156 CD1 -0.0011 0.0063 -0.0103 1246 LEU 156 CD2 -0.0023 0.0067 -0.0111 1247 PHE 157 N -0.0002 0.0050 -0.0073 1248 PHE 157 CA 0.0011 0.0046 -0.0065 1249 PHE 157 C 0.0026 0.0049 -0.0075 1250 PHE 157 O 0.0024 0.0055 -0.0089 1251 PHE 157 CB 0.0005 0.0044 -0.0059 1252 PHE 157 CG -0.0007 0.0039 -0.0046 1253 PHE 157 CD1 -0.0024 0.0041 -0.0049 1254 PHE 157 CD2 -0.0002 0.0032 -0.0032 1255 PHE 157 CE1 -0.0035 0.0036 -0.0037 1256 PHE 157 CE2 -0.0014 0.0028 -0.0020 1257 PHE 157 CZ -0.0030 0.0030 -0.0023 1258 HIS 158 N 0.0035 0.0041 -0.0062 1259 HIS 158 CA 0.0038 0.0044 -0.0061 1260 HIS 158 C 0.0038 0.0043 -0.0056 1261 HIS 158 O 0.0037 0.0040 -0.0053 1262 HIS 158 CB 0.0040 0.0048 -0.0060 1263 HIS 158 CG 0.0041 0.0050 -0.0065 1264 HIS 158 CD2 0.0041 0.0052 -0.0068 1265 HIS 158 ND1 0.0041 0.0052 -0.0066 1266 HIS 158 CE1 0.0042 0.0054 -0.0070 1267 HIS 158 NE2 0.0041 0.0054 -0.0072 1268 LEU 159 N 0.0038 0.0044 -0.0056 1269 LEU 159 CA 0.0039 0.0042 -0.0052 1270 LEU 159 C 0.0041 0.0046 -0.0050 1271 LEU 159 O 0.0042 0.0049 -0.0052 1272 LEU 159 CB 0.0036 0.0039 -0.0053 1273 LEU 159 CG 0.0036 0.0037 -0.0048 1274 LEU 159 CD1 0.0035 0.0034 -0.0046 1275 LEU 159 CD2 0.0034 0.0035 -0.0050 1276 GLU 160 N 0.0042 0.0046 -0.0045 1277 GLU 160 CA 0.0045 0.0049 -0.0043 1278 GLU 160 C 0.0045 0.0047 -0.0038 1279 GLU 160 O 0.0043 0.0044 -0.0036 1280 GLU 160 CB 0.0047 0.0053 -0.0043 1281 GLU 160 CG 0.0047 0.0052 -0.0041 1282 GLU 160 CD 0.0049 0.0055 -0.0042 1283 GLU 160 OE1 0.0049 0.0057 -0.0046 1284 GLU 160 OE2 0.0051 0.0057 -0.0038 1285 HIS 161 N 0.0028 0.0044 0.0037 1286 HIS 161 CA 0.0033 0.0044 0.0031 1287 HIS 161 C 0.0032 0.0038 0.0026 1288 HIS 161 O 0.0027 0.0034 0.0026 1289 HIS 161 CB 0.0035 0.0045 0.0032 1290 HIS 161 CG 0.0039 0.0051 0.0035 1291 HIS 161 CD2 0.0037 0.0055 0.0041 1292 HIS 161 ND1 0.0045 0.0054 0.0032 1293 HIS 161 CE1 0.0047 0.0059 0.0036 1294 HIS 161 NE2 0.0043 0.0060 0.0041 1295 TYR 162 N 0.0037 0.0038 0.0021 1296 TYR 162 CA 0.0037 0.0033 0.0015 1297 TYR 162 C 0.0036 0.0030 0.0012 1298 TYR 162 O 0.0040 0.0033 0.0011 1299 TYR 162 CB 0.0042 0.0035 0.0011 1300 TYR 162 CG 0.0043 0.0030 0.0004 1301 TYR 162 CD1 0.0039 0.0025 0.0003 1302 TYR 162 CD2 0.0048 0.0031 -0.0000 1303 TYR 162 CE1 0.0040 0.0021 -0.0003 1304 TYR 162 CE2 0.0049 0.0026 -0.0006 1305 TYR 162 CZ 0.0045 0.0022 -0.0008 1306 TYR 162 OH 0.0046 0.0017 -0.0014 1307 ILE 163 N 0.0032 0.0025 0.0010 1308 ILE 163 CA 0.0031 0.0022 0.0007 1309 ILE 163 C 0.0033 0.0018 0.0000 1310 ILE 163 O 0.0031 0.0015 -0.0001 1311 ILE 163 CB 0.0024 0.0018 0.0010 1312 ILE 163 CG1 0.0021 0.0021 0.0017 1313 ILE 163 CG2 0.0023 0.0017 0.0010 1314 ILE 163 CD1 0.0014 0.0017 0.0019 1315 GLU 164 N 0.0022 0.0025 0.0035 1316 GLU 164 CA 0.0029 0.0015 0.0026 1317 GLU 164 C 0.0022 0.0009 0.0023 1318 GLU 164 O 0.0018 0.0015 0.0028 1319 GLU 164 CB 0.0044 0.0018 0.0025 1320 GLU 164 CG 0.0054 0.0020 0.0025 1321 GLU 164 CD 0.0069 0.0023 0.0025 1322 GLU 164 OE1 0.0075 0.0017 0.0019 1323 GLU 164 OE2 0.0075 0.0032 0.0030 1324 GLY 165 N 0.0020 -0.0002 0.0014 1325 GLY 165 CA 0.0015 -0.0009 0.0010 1326 GLY 165 C 0.0003 -0.0018 0.0005 1327 GLY 165 O -0.0000 -0.0020 0.0004 1328 LYS 166 N -0.0004 -0.0023 0.0002 1329 LYS 166 CA -0.0015 -0.0032 -0.0002 1330 LYS 166 C -0.0029 -0.0026 0.0004 1331 LYS 166 O -0.0034 -0.0021 0.0010 1332 LYS 166 CB -0.0017 -0.0039 -0.0007 1333 LYS 166 CG -0.0008 -0.0048 -0.0017 1334 LYS 166 CD -0.0008 -0.0054 -0.0021 1335 LYS 166 CE -0.0023 -0.0056 -0.0020 1336 LYS 166 NZ -0.0032 -0.0065 -0.0025 1337 TYR 167 N -0.0019 -0.0048 0.0006 1338 TYR 167 CA -0.0020 -0.0048 0.0004 1339 TYR 167 C -0.0022 -0.0045 0.0002 1340 TYR 167 O -0.0022 -0.0045 -0.0000 1341 TYR 167 CB -0.0018 -0.0050 0.0002 1342 TYR 167 CG -0.0018 -0.0049 0.0001 1343 TYR 167 CD1 -0.0019 -0.0048 -0.0001 1344 TYR 167 CD2 -0.0017 -0.0051 0.0003 1345 TYR 167 CE1 -0.0019 -0.0048 -0.0002 1346 TYR 167 CE2 -0.0017 -0.0051 0.0003 1347 TYR 167 CZ -0.0018 -0.0049 0.0000 1348 TYR 167 OH -0.0018 -0.0049 -0.0001 1349 ILE 168 N -0.0024 -0.0043 0.0003 1350 ILE 168 CA -0.0026 -0.0041 0.0002 1351 ILE 168 C -0.0027 -0.0040 0.0000 1352 ILE 168 O -0.0026 -0.0041 0.0002 1353 ILE 168 CB -0.0028 -0.0039 0.0004 1354 ILE 168 CG1 -0.0027 -0.0040 0.0006 1355 ILE 168 CG2 -0.0030 -0.0037 0.0002 1356 ILE 168 CD1 -0.0027 -0.0040 0.0003 1357 LYS 169 N -0.0027 -0.0039 -0.0003 1358 LYS 169 CA -0.0029 -0.0038 -0.0004 1359 LYS 169 C -0.0031 -0.0035 -0.0003 1360 LYS 169 O -0.0032 -0.0034 -0.0005 1361 LYS 169 CB -0.0028 -0.0039 -0.0008 1362 LYS 169 CG -0.0025 -0.0041 -0.0008 1363 LYS 169 CD -0.0025 -0.0042 -0.0012 1364 LYS 169 CE -0.0023 -0.0044 -0.0013 1365 LYS 169 NZ -0.0021 -0.0046 -0.0011 1366 TYR 170 N -0.0031 -0.0038 -0.0005 1367 TYR 170 CA -0.0030 -0.0026 -0.0003 1368 TYR 170 C -0.0027 -0.0019 -0.0013 1369 TYR 170 O -0.0026 -0.0010 -0.0012 1370 TYR 170 CB -0.0030 -0.0025 0.0001 1371 TYR 170 CG -0.0032 -0.0032 0.0010 1372 TYR 170 CD1 -0.0033 -0.0029 0.0021 1373 TYR 170 CD2 -0.0034 -0.0042 0.0009 1374 TYR 170 CE1 -0.0035 -0.0035 0.0030 1375 TYR 170 CE2 -0.0036 -0.0048 0.0018 1376 TYR 170 CZ -0.0036 -0.0045 0.0028 1377 TYR 170 OH -0.0038 -0.0051 0.0037 1378 ASN 171 N -0.0027 -0.0023 -0.0023 1379 ASN 171 CA -0.0025 -0.0018 -0.0033 1380 ASN 171 C -0.0025 -0.0026 -0.0042 1381 ASN 171 O -0.0027 -0.0036 -0.0040 1382 ASN 171 CB -0.0023 -0.0009 -0.0036 1383 ASN 171 CG -0.0024 -0.0014 -0.0037 1384 ASN 171 ND2 -0.0023 -0.0009 -0.0033 1385 ASN 171 OD1 -0.0025 -0.0023 -0.0043 1386 SER 172 N -0.0024 -0.0023 -0.0051 1387 SER 172 CA -0.0024 -0.0030 -0.0060 1388 SER 172 C -0.0022 -0.0026 -0.0069 1389 SER 172 O -0.0021 -0.0019 -0.0068 1390 SER 172 CB -0.0024 -0.0029 -0.0063 1391 SER 172 OG -0.0021 -0.0020 -0.0069 1392 ASN 173 N -0.0017 -0.0019 -0.0083 1393 ASN 173 CA -0.0017 -0.0018 -0.0087 1394 ASN 173 C -0.0016 -0.0014 -0.0090 1395 ASN 173 O -0.0015 -0.0014 -0.0094 1396 ASN 173 CB -0.0016 -0.0023 -0.0089 1397 ASN 173 CG -0.0015 -0.0024 -0.0093 1398 ASN 173 ND2 -0.0014 -0.0026 -0.0097 1399 ASN 173 OD1 -0.0015 -0.0024 -0.0091 1400 SER 174 N -0.0017 -0.0011 -0.0089 1401 SER 174 CA -0.0016 -0.0008 -0.0092 1402 SER 174 C -0.0017 -0.0003 -0.0090 1403 SER 174 O -0.0017 -0.0001 -0.0091 1404 SER 174 CB -0.0015 -0.0010 -0.0095 1405 SER 174 OG -0.0014 -0.0013 -0.0098 1406 GLY 175 N -0.0018 -0.0002 -0.0086 1407 GLY 175 CA -0.0019 0.0003 -0.0083 1408 GLY 175 C -0.0020 0.0002 -0.0079 1409 GLY 175 O -0.0021 0.0006 -0.0077 1410 PHE 176 N -0.0030 -0.0015 -0.0074 1411 PHE 176 CA -0.0029 -0.0019 -0.0060 1412 PHE 176 C -0.0027 -0.0015 -0.0048 1413 PHE 176 O -0.0028 -0.0018 -0.0048 1414 PHE 176 CB -0.0030 -0.0035 -0.0060 1415 PHE 176 CG -0.0029 -0.0041 -0.0046 1416 PHE 176 CD1 -0.0028 -0.0039 -0.0038 1417 PHE 176 CD2 -0.0029 -0.0049 -0.0039 1418 PHE 176 CE1 -0.0028 -0.0044 -0.0025 1419 PHE 176 CE2 -0.0029 -0.0055 -0.0026 1420 PHE 176 CZ -0.0028 -0.0052 -0.0019 1421 VAL 177 N -0.0026 -0.0009 -0.0037 1422 VAL 177 CA -0.0024 -0.0005 -0.0024 1423 VAL 177 C -0.0023 -0.0010 -0.0011 1424 VAL 177 O -0.0023 -0.0007 -0.0011 1425 VAL 177 CB -0.0023 0.0011 -0.0023 1426 VAL 177 CG1 -0.0021 0.0014 -0.0009 1427 VAL 177 CG2 -0.0024 0.0015 -0.0035 1428 ARG 178 N -0.0023 -0.0018 -0.0001 1429 ARG 178 CA -0.0022 -0.0022 0.0012 1430 ARG 178 C -0.0020 -0.0010 0.0022 1431 ARG 178 O -0.0019 -0.0006 0.0029 1432 ARG 178 CB -0.0023 -0.0035 0.0018 1433 ARG 178 CG -0.0022 -0.0041 0.0032 1434 ARG 178 CD -0.0022 -0.0052 0.0039 1435 ARG 178 NE -0.0021 -0.0056 0.0053 1436 ARG 178 CZ -0.0022 -0.0067 0.0056 1437 ARG 178 NH1 -0.0023 -0.0076 0.0045 1438 ARG 178 NH2 -0.0020 -0.0069 0.0069 1439 ASP 179 N -0.0004 -0.0005 0.0045 1440 ASP 179 CA -0.0003 0.0010 0.0057 1441 ASP 179 C -0.0011 0.0007 0.0077 1442 ASP 179 O -0.0012 0.0016 0.0088 1443 ASP 179 CB 0.0005 0.0027 0.0054 1444 ASP 180 N -0.0017 -0.0004 0.0081 1445 ASP 180 CA -0.0026 -0.0007 0.0099 1446 ASP 180 C -0.0032 -0.0017 0.0106 1447 ASP 180 O -0.0036 -0.0032 0.0098 1448 ASP 180 CB -0.0031 -0.0019 0.0100 1449 ASP 180 CG -0.0025 -0.0009 0.0097 1450 ASP 180 OD1 -0.0017 0.0000 0.0084 1451 ASP 180 OD2 -0.0030 -0.0010 0.0107 1452 ASN 181 N -0.0034 -0.0008 0.0119 1453 ASN 181 CA -0.0039 -0.0015 0.0126 1454 ASN 181 C -0.0035 -0.0020 0.0110 1455 ASN 181 O -0.0039 -0.0035 0.0105 1456 ASN 181 CB -0.0049 -0.0032 0.0135 1457 ASN 181 CG -0.0053 -0.0030 0.0147 1458 ASN 181 ND2 -0.0058 -0.0027 0.0165 1459 ASN 181 OD1 -0.0051 -0.0031 0.0140 1460 ILE 182 N -0.0032 -0.0025 0.0097 1461 ILE 182 CA -0.0032 -0.0022 0.0087 1462 ILE 182 C -0.0032 -0.0021 0.0086 1463 ILE 182 O -0.0028 -0.0019 0.0092 1464 ILE 182 CB -0.0028 -0.0014 0.0084 1465 ILE 182 CG1 -0.0029 -0.0011 0.0073 1466 ILE 182 CG2 -0.0021 -0.0007 0.0088 1467 ILE 182 CD1 -0.0028 -0.0008 0.0069 1468 ARG 183 N -0.0036 -0.0023 0.0078 1469 ARG 183 CA -0.0036 -0.0021 0.0075 1470 ARG 183 C -0.0034 -0.0015 0.0065 1471 ARG 183 O -0.0035 -0.0014 0.0060 1472 ARG 183 CB -0.0042 -0.0029 0.0073 1473 ARG 183 CG -0.0044 -0.0036 0.0082 1474 ARG 183 CD -0.0049 -0.0043 0.0080 1475 ARG 183 NE -0.0047 -0.0038 0.0076 1476 ARG 183 CZ -0.0051 -0.0041 0.0070 1477 ARG 183 NH1 -0.0057 -0.0048 0.0067 1478 ARG 183 NH2 -0.0049 -0.0037 0.0067 1479 LEU 184 N -0.0031 -0.0010 0.0064 1480 LEU 184 CA -0.0029 -0.0003 0.0056 1481 LEU 184 C -0.0033 -0.0006 0.0047 1482 LEU 184 O -0.0034 -0.0002 0.0039 1483 LEU 184 CB -0.0023 0.0004 0.0059 1484 LEU 184 CG -0.0018 0.0006 0.0069 1485 LEU 184 CD1 -0.0012 0.0014 0.0071 1486 LEU 184 CD2 -0.0018 0.0007 0.0068 1487 THR 185 N -0.0043 -0.0011 0.0043 1488 THR 185 CA -0.0042 -0.0020 0.0039 1489 THR 185 C -0.0040 -0.0024 0.0025 1490 THR 185 O -0.0039 -0.0024 0.0018 1491 THR 185 CB -0.0044 -0.0031 0.0048 1492 THR 185 CG2 -0.0043 -0.0040 0.0043 1493 THR 185 OG1 -0.0046 -0.0026 0.0060 1494 PRO 186 N -0.0040 -0.0029 0.0021 1495 PRO 186 CA -0.0037 -0.0033 0.0008 1496 PRO 186 C -0.0035 -0.0023 -0.0001 1497 PRO 186 O -0.0034 -0.0026 -0.0010 1498 PRO 186 CB -0.0037 -0.0038 0.0008 1499 PRO 186 CG -0.0040 -0.0041 0.0021 1500 PRO 186 CD -0.0041 -0.0031 0.0029 1501 GLN 187 N -0.0036 -0.0012 -0.0000 1502 GLN 187 CA -0.0034 -0.0002 -0.0009 1503 GLN 187 C -0.0034 0.0002 -0.0009 1504 GLN 187 O -0.0032 0.0005 -0.0020 1505 GLN 187 CB -0.0034 0.0009 -0.0007 1506 GLN 187 CG -0.0035 0.0005 -0.0002 1507 GLN 187 CD -0.0033 -0.0003 -0.0012 1508 GLN 187 NE2 -0.0034 -0.0011 -0.0007 1509 GLN 187 OE1 -0.0031 -0.0001 -0.0023 1510 ALA 188 N -0.0034 0.0010 -0.0006 1511 ALA 188 CA -0.0034 0.0012 -0.0004 1512 ALA 188 C -0.0033 0.0006 -0.0008 1513 ALA 188 O -0.0033 0.0008 -0.0011 1514 ALA 188 CB -0.0035 0.0014 0.0004 1515 PHE 189 N -0.0032 -0.0001 -0.0007 1516 PHE 189 CA -0.0031 -0.0008 -0.0010 1517 PHE 189 C -0.0030 -0.0007 -0.0019 1518 PHE 189 O -0.0030 -0.0008 -0.0022 1519 PHE 189 CB -0.0031 -0.0016 -0.0007 1520 PHE 189 CG -0.0030 -0.0023 -0.0011 1521 PHE 189 CD1 -0.0030 -0.0024 -0.0011 1522 PHE 189 CD2 -0.0029 -0.0028 -0.0016 1523 PHE 189 CE1 -0.0029 -0.0030 -0.0015 1524 PHE 189 CE2 -0.0028 -0.0034 -0.0020 1525 PHE 189 CZ -0.0028 -0.0035 -0.0019 1526 SER 190 N -0.0030 -0.0006 -0.0023 1527 SER 190 CA -0.0029 -0.0005 -0.0031 1528 SER 190 C -0.0029 0.0002 -0.0034 1529 SER 190 O -0.0028 0.0001 -0.0039 1530 SER 190 CB -0.0028 -0.0004 -0.0034 1531 SER 190 OG -0.0028 -0.0011 -0.0032 1532 HIS 191 N -0.0020 0.0008 -0.0043 1533 HIS 191 CA -0.0021 0.0015 -0.0045 1534 HIS 191 C -0.0021 0.0013 -0.0043 1535 HIS 191 O -0.0021 0.0016 -0.0048 1536 HIS 191 CB -0.0023 0.0022 -0.0041 1537 HIS 191 CG -0.0023 0.0029 -0.0044 1538 HIS 191 CD2 -0.0022 0.0031 -0.0050 1539 HIS 191 ND1 -0.0024 0.0036 -0.0042 1540 HIS 191 CE1 -0.0024 0.0042 -0.0046 1541 HIS 191 NE2 -0.0023 0.0039 -0.0051 1542 PHE 192 N -0.0022 0.0009 -0.0037 1543 PHE 192 CA -0.0022 0.0008 -0.0035 1544 PHE 192 C -0.0020 0.0002 -0.0041 1545 PHE 192 O -0.0020 0.0003 -0.0043 1546 PHE 192 CB -0.0022 0.0003 -0.0027 1547 PHE 192 CG -0.0022 0.0000 -0.0024 1548 PHE 192 CD1 -0.0023 0.0005 -0.0021 1549 PHE 192 CD2 -0.0021 -0.0007 -0.0026 1550 PHE 192 CE1 -0.0023 0.0002 -0.0019 1551 PHE 192 CE2 -0.0021 -0.0010 -0.0024 1552 PHE 192 CZ -0.0022 -0.0006 -0.0020 1553 THR 193 N -0.0019 -0.0003 -0.0044 1554 THR 193 CA -0.0017 -0.0008 -0.0050 1555 THR 193 C -0.0017 -0.0004 -0.0057 1556 THR 193 O -0.0016 -0.0005 -0.0061 1557 THR 193 CB -0.0016 -0.0015 -0.0051 1558 THR 193 CG2 -0.0017 -0.0020 -0.0044 1559 THR 193 OG1 -0.0016 -0.0012 -0.0054 1560 PHE 194 N -0.0003 0.0001 -0.0070 1561 PHE 194 CA -0.0001 0.0005 -0.0076 1562 PHE 194 C -0.0001 0.0008 -0.0076 1563 PHE 194 O 0.0000 0.0008 -0.0081 1564 PHE 194 CB -0.0001 0.0011 -0.0077 1565 PHE 194 CG 0.0000 0.0016 -0.0083 1566 PHE 194 CD1 0.0002 0.0014 -0.0089 1567 PHE 194 CD2 0.0000 0.0022 -0.0082 1568 PHE 194 CE1 0.0004 0.0018 -0.0095 1569 PHE 194 CE2 0.0001 0.0027 -0.0087 1570 PHE 194 CZ 0.0003 0.0025 -0.0094 1571 GLU 195 N -0.0003 0.0011 -0.0070 1572 GLU 195 CA -0.0003 0.0015 -0.0070 1573 GLU 195 C -0.0003 0.0010 -0.0070 1574 GLU 195 O -0.0002 0.0011 -0.0073 1575 GLU 195 CB -0.0005 0.0020 -0.0064 1576 GLU 195 CG -0.0005 0.0027 -0.0065 1577 GLU 195 CD -0.0006 0.0033 -0.0062 1578 GLU 195 OE1 -0.0007 0.0032 -0.0059 1579 GLU 195 OE2 -0.0006 0.0039 -0.0063 1580 ARG 196 N -0.0004 0.0005 -0.0066 1581 ARG 196 CA -0.0004 0.0000 -0.0065 1582 ARG 196 C -0.0002 -0.0004 -0.0071 1583 ARG 196 O -0.0002 -0.0006 -0.0072 1584 ARG 196 CB -0.0006 -0.0005 -0.0059 1585 ARG 196 CG -0.0006 -0.0009 -0.0056 1586 ARG 196 CD -0.0007 -0.0005 -0.0053 1587 ARG 196 NE -0.0008 -0.0009 -0.0049 1588 ARG 196 CZ -0.0008 -0.0011 -0.0051 1589 ARG 196 NH1 -0.0006 -0.0010 -0.0057 1590 ARG 196 NH2 -0.0009 -0.0015 -0.0046 1591 SER 197 N 0.0002 -0.0002 -0.0080 1592 SER 197 CA 0.0001 -0.0004 -0.0084 1593 SER 197 C 0.0006 -0.0002 -0.0088 1594 SER 197 O 0.0006 -0.0003 -0.0091 1595 SER 197 CB -0.0001 -0.0004 -0.0082 1596 SER 197 OG 0.0001 -0.0001 -0.0079 1597 GLY 198 N 0.0010 0.0001 -0.0087 1598 GLY 198 CA 0.0014 0.0003 -0.0090 1599 GLY 198 C 0.0015 0.0005 -0.0088 1600 GLY 198 O 0.0017 0.0005 -0.0092 1601 HIS 199 N 0.0014 0.0006 -0.0083 1602 HIS 199 CA 0.0015 0.0007 -0.0081 1603 HIS 199 C 0.0012 0.0004 -0.0084 1604 HIS 199 O 0.0013 0.0005 -0.0083 1605 HIS 199 CB 0.0020 0.0010 -0.0082 1606 HIS 199 CG 0.0022 0.0013 -0.0080 1607 HIS 199 CD2 0.0027 0.0016 -0.0081 1608 HIS 199 ND1 0.0021 0.0013 -0.0077 1609 HIS 199 CE1 0.0024 0.0016 -0.0076 1610 HIS 199 NE2 0.0028 0.0018 -0.0078 1611 GLN 200 N -0.0003 0.0001 -0.0094 1612 GLN 200 CA -0.0003 -0.0003 -0.0097 1613 GLN 200 C -0.0003 -0.0005 -0.0096 1614 GLN 200 O -0.0003 -0.0008 -0.0098 1615 GLN 200 CB -0.0003 -0.0005 -0.0098 1616 GLN 200 CG -0.0002 -0.0004 -0.0100 1617 GLN 200 CD -0.0002 -0.0006 -0.0100 1618 GLN 200 NE2 -0.0002 -0.0005 -0.0102 1619 GLN 200 OE1 -0.0003 -0.0010 -0.0099 1620 LEU 201 N -0.0004 -0.0005 -0.0092 1621 LEU 201 CA -0.0005 -0.0007 -0.0090 1622 LEU 201 C -0.0006 -0.0005 -0.0086 1623 LEU 201 O -0.0006 -0.0002 -0.0084 1624 LEU 201 CB -0.0006 -0.0012 -0.0090 1625 LEU 201 CG -0.0007 -0.0013 -0.0086 1626 LEU 201 CD1 -0.0008 -0.0014 -0.0082 1627 LEU 201 CD2 -0.0007 -0.0017 -0.0087 1628 ILE 202 N -0.0006 -0.0006 -0.0085 1629 ILE 202 CA -0.0007 -0.0005 -0.0081 1630 ILE 202 C -0.0008 -0.0008 -0.0079 1631 ILE 202 O -0.0008 -0.0010 -0.0082 1632 ILE 202 CB -0.0007 -0.0001 -0.0081 1633 ILE 202 CG1 -0.0008 0.0001 -0.0077 1634 ILE 202 CG2 -0.0006 -0.0001 -0.0084 1635 ILE 202 CD1 -0.0007 0.0005 -0.0077 1636 VAL 203 N -0.0015 -0.0009 -0.0065 1637 VAL 203 CA -0.0015 -0.0015 -0.0062 1638 VAL 203 C -0.0016 -0.0012 -0.0060 1639 VAL 203 O -0.0016 -0.0008 -0.0055 1640 VAL 203 CB -0.0016 -0.0018 -0.0057 1641 VAL 203 CG1 -0.0016 -0.0024 -0.0054 1642 VAL 203 CG2 -0.0015 -0.0020 -0.0059 1643 VAL 204 N -0.0015 -0.0014 -0.0063 1644 VAL 204 CA -0.0015 -0.0012 -0.0061 1645 VAL 204 C -0.0015 -0.0019 -0.0060 1646 VAL 204 O -0.0015 -0.0024 -0.0060 1647 VAL 204 CB -0.0015 -0.0007 -0.0065 1648 VAL 204 CG1 -0.0014 -0.0010 -0.0072 1649 VAL 204 CG2 -0.0016 -0.0003 -0.0062 1650 ASP 205 N -0.0015 -0.0018 -0.0060 1651 ASP 205 CA -0.0015 -0.0023 -0.0059 1652 ASP 205 C -0.0016 -0.0026 -0.0052 1653 ASP 205 O -0.0016 -0.0032 -0.0051 1654 ASP 205 CB -0.0014 -0.0028 -0.0064 1655 ASP 205 CG -0.0014 -0.0030 -0.0067 1656 ASP 205 OD1 -0.0014 -0.0029 -0.0063 1657 ASP 205 OD2 -0.0013 -0.0032 -0.0073 1658 ILE 206 N -0.0024 -0.0019 -0.0027 1659 ILE 206 CA -0.0025 -0.0022 -0.0019 1660 ILE 206 C -0.0025 -0.0025 -0.0017 1661 ILE 206 O -0.0026 -0.0020 -0.0018 1662 ILE 206 CB -0.0029 -0.0016 -0.0014 1663 ILE 206 CG1 -0.0029 -0.0013 -0.0016 1664 ILE 206 CG2 -0.0030 -0.0019 -0.0005 1665 ILE 206 CD1 -0.0027 -0.0019 -0.0016 1666 GLN 207 N -0.0023 -0.0032 -0.0014 1667 GLN 207 CA -0.0023 -0.0035 -0.0013 1668 GLN 207 C -0.0022 -0.0042 -0.0007 1669 GLN 207 O -0.0020 -0.0045 -0.0007 1670 GLN 207 CB -0.0020 -0.0037 -0.0020 1671 GLN 207 CG -0.0017 -0.0041 -0.0025 1672 GLN 207 CD -0.0015 -0.0043 -0.0033 1673 GLN 207 NE2 -0.0013 -0.0042 -0.0039 1674 GLN 207 OE1 -0.0014 -0.0044 -0.0033 1675 GLY 208 N -0.0022 -0.0043 -0.0002 1676 GLY 208 CA -0.0022 -0.0049 0.0003 1677 GLY 208 C -0.0024 -0.0048 0.0010 1678 GLY 208 O -0.0025 -0.0043 0.0009 1679 VAL 209 N -0.0019 -0.0033 0.0033 1680 VAL 209 CA -0.0020 -0.0033 0.0028 1681 VAL 209 C -0.0025 -0.0035 0.0032 1682 VAL 209 O -0.0024 -0.0034 0.0039 1683 VAL 209 CB -0.0012 -0.0031 0.0028 1684 VAL 209 CG1 -0.0012 -0.0031 0.0023 1685 VAL 209 CG2 -0.0006 -0.0029 0.0025 1686 GLY 210 N -0.0031 -0.0036 0.0028 1687 GLY 210 CA -0.0037 -0.0038 0.0031 1688 GLY 210 C -0.0040 -0.0039 0.0038 1689 GLY 210 O -0.0044 -0.0040 0.0038 1690 ASP 211 N -0.0040 -0.0039 0.0045 1691 ASP 211 CA -0.0042 -0.0040 0.0052 1692 ASP 211 C -0.0036 -0.0038 0.0058 1693 ASP 211 O -0.0037 -0.0039 0.0065 1694 ASP 211 CB -0.0048 -0.0042 0.0056 1695 ASP 211 CG -0.0055 -0.0044 0.0052 1696 ASP 211 OD1 -0.0057 -0.0045 0.0049 1697 ASP 211 OD2 -0.0058 -0.0045 0.0052 1698 LEU 212 N -0.0030 -0.0028 0.0030 1699 LEU 212 CA -0.0023 -0.0033 0.0030 1700 LEU 212 C -0.0020 -0.0032 0.0022 1701 LEU 212 O -0.0018 -0.0031 0.0016 1702 LEU 212 CB -0.0018 -0.0037 0.0032 1703 LEU 212 CG -0.0017 -0.0041 0.0041 1704 LEU 212 CD1 -0.0024 -0.0038 0.0046 1705 LEU 212 CD2 -0.0011 -0.0045 0.0042 1706 TYR 213 N -0.0020 -0.0032 0.0021 1707 TYR 213 CA -0.0019 -0.0030 0.0014 1708 TYR 213 C -0.0011 -0.0034 0.0012 1709 TYR 213 O -0.0008 -0.0038 0.0017 1710 TYR 213 CB -0.0024 -0.0026 0.0014 1711 TYR 213 CG -0.0031 -0.0022 0.0016 1712 TYR 213 CD1 -0.0034 -0.0019 0.0013 1713 TYR 213 CD2 -0.0036 -0.0020 0.0020 1714 TYR 213 CE1 -0.0041 -0.0015 0.0015 1715 TYR 213 CE2 -0.0043 -0.0016 0.0022 1716 TYR 213 CZ -0.0046 -0.0013 0.0019 1717 TYR 213 OH -0.0053 -0.0009 0.0021 1718 THR 214 N -0.0008 -0.0033 0.0004 1719 THR 214 CA -0.0001 -0.0037 0.0002 1720 THR 214 C -0.0001 -0.0034 -0.0007 1721 THR 214 O -0.0006 -0.0030 -0.0011 1722 THR 214 CB 0.0005 -0.0041 0.0001 1723 THR 214 CG2 0.0005 -0.0039 -0.0006 1724 THR 214 OG1 0.0011 -0.0045 0.0000 1725 ASP 215 N 0.0002 -0.0047 -0.0045 1726 ASP 215 CA 0.0002 -0.0045 -0.0053 1727 ASP 215 C 0.0000 -0.0036 -0.0054 1728 ASP 215 O -0.0000 -0.0032 -0.0056 1729 ASP 215 CB 0.0002 -0.0047 -0.0054 1730 ASP 215 CG 0.0002 -0.0047 -0.0062 1731 ASP 215 OD1 0.0002 -0.0048 -0.0067 1732 ASP 215 OD2 0.0002 -0.0044 -0.0063 1733 PRO 216 N 0.0000 -0.0033 -0.0054 1734 PRO 216 CA -0.0001 -0.0025 -0.0056 1735 PRO 216 C -0.0001 -0.0024 -0.0064 1736 PRO 216 O -0.0000 -0.0030 -0.0068 1737 PRO 216 CB -0.0001 -0.0023 -0.0051 1738 PRO 216 CG -0.0000 -0.0030 -0.0051 1739 PRO 216 CD 0.0000 -0.0036 -0.0051 1740 GLN 217 N -0.0002 -0.0017 -0.0067 1741 GLN 217 CA -0.0002 -0.0015 -0.0075 1742 GLN 217 C -0.0003 -0.0009 -0.0075 1743 GLN 217 O -0.0004 -0.0004 -0.0070 1744 GLN 217 CB -0.0002 -0.0013 -0.0079 1745 GLN 217 CG -0.0003 -0.0011 -0.0088 1746 GLN 217 CD -0.0001 -0.0018 -0.0092 1747 GLN 217 NE2 -0.0001 -0.0025 -0.0091 1748 GLN 217 OE1 -0.0002 -0.0017 -0.0096 1749 ILE 218 N -0.0002 -0.0021 -0.0092 1750 ILE 218 CA -0.0003 -0.0017 -0.0092 1751 ILE 218 C -0.0004 -0.0015 -0.0096 1752 ILE 218 O -0.0003 -0.0018 -0.0100 1753 ILE 218 CB -0.0002 -0.0019 -0.0090 1754 ILE 218 CG1 -0.0002 -0.0021 -0.0085 1755 ILE 218 CG2 -0.0004 -0.0016 -0.0090 1756 ILE 218 CD1 -0.0001 -0.0022 -0.0083 1757 HIS 219 N -0.0006 -0.0011 -0.0097 1758 HIS 219 CA -0.0007 -0.0009 -0.0101 1759 HIS 219 C -0.0008 -0.0007 -0.0100 1760 HIS 219 O -0.0009 -0.0005 -0.0097 1761 HIS 219 CB -0.0008 -0.0006 -0.0102 1762 HIS 219 CG -0.0008 -0.0007 -0.0102 1763 HIS 219 CD2 -0.0008 -0.0007 -0.0100 1764 HIS 219 ND1 -0.0006 -0.0010 -0.0106 1765 HIS 219 CE1 -0.0006 -0.0011 -0.0106 1766 HIS 219 NE2 -0.0007 -0.0009 -0.0102 1767 THR 220 N -0.0007 -0.0008 -0.0103 1768 THR 220 CA -0.0008 -0.0007 -0.0103 1769 THR 220 C -0.0009 -0.0003 -0.0106 1770 THR 220 O -0.0010 -0.0003 -0.0110 1771 THR 220 CB -0.0006 -0.0010 -0.0103 1772 THR 220 CG2 -0.0005 -0.0013 -0.0100 1773 THR 220 OG1 -0.0006 -0.0012 -0.0108 1774 GLU 221 N -0.0005 -0.0009 -0.0115 1775 GLU 221 CA -0.0002 -0.0008 -0.0116 1776 GLU 221 C -0.0000 -0.0008 -0.0118 1777 GLU 221 O 0.0002 -0.0006 -0.0119 1778 GLU 221 CB -0.0001 -0.0009 -0.0118 1779 GLU 221 CG 0.0001 -0.0008 -0.0120 1780 GLU 221 CD 0.0002 -0.0010 -0.0121 1781 GLU 221 OE1 0.0000 -0.0012 -0.0120 1782 GLU 221 OE2 0.0004 -0.0010 -0.0123 1783 THR 222 N -0.0000 -0.0011 -0.0119 1784 THR 222 CA 0.0001 -0.0011 -0.0121 1785 THR 222 C 0.0001 -0.0010 -0.0120 1786 THR 222 O 0.0003 -0.0010 -0.0121 1787 THR 222 CB 0.0001 -0.0015 -0.0123 1788 THR 222 CG2 0.0002 -0.0016 -0.0124 1789 THR 222 OG1 -0.0001 -0.0017 -0.0121 1790 GLY 223 N -0.0002 -0.0011 -0.0118 1791 GLY 223 CA -0.0002 -0.0010 -0.0117 1792 GLY 223 C -0.0002 -0.0012 -0.0119 1793 GLY 223 O -0.0002 -0.0011 -0.0118 1794 THR 224 N 0.0005 -0.0005 -0.0117 1795 THR 224 CA 0.0008 -0.0010 -0.0119 1796 THR 224 C 0.0011 -0.0014 -0.0116 1797 THR 224 O 0.0013 -0.0019 -0.0118 1798 THR 224 CB 0.0007 -0.0008 -0.0120 1799 THR 224 CG2 0.0003 -0.0004 -0.0124 1800 THR 224 OG1 0.0007 -0.0007 -0.0114 1801 ASP 225 N 0.0011 -0.0013 -0.0110 1802 ASP 225 CA 0.0014 -0.0017 -0.0106 1803 ASP 225 C 0.0015 -0.0018 -0.0105 1804 ASP 225 O 0.0014 -0.0016 -0.0106 1805 ASP 225 CB 0.0014 -0.0016 -0.0101 1806 ASP 225 CG 0.0012 -0.0010 -0.0099 1807 ASP 225 OD1 0.0009 -0.0007 -0.0102 1808 ASP 225 OD2 0.0012 -0.0009 -0.0093 1809 PHE 226 N 0.0018 -0.0022 -0.0101 1810 PHE 226 CA 0.0019 -0.0024 -0.0099 1811 PHE 226 C 0.0020 -0.0026 -0.0103 1812 PHE 226 O 0.0020 -0.0025 -0.0103 1813 PHE 226 CB 0.0018 -0.0019 -0.0095 1814 PHE 226 CG 0.0018 -0.0018 -0.0090 1815 PHE 226 CD1 0.0020 -0.0021 -0.0087 1816 PHE 226 CD2 0.0015 -0.0013 -0.0088 1817 PHE 226 CE1 0.0020 -0.0020 -0.0082 1818 PHE 226 CE2 0.0015 -0.0011 -0.0083 1819 PHE 226 CZ 0.0018 -0.0015 -0.0080 1820 GLY 227 N 0.0024 -0.0023 -0.0098 1821 GLY 227 CA 0.0028 -0.0012 -0.0100 1822 GLY 227 C 0.0028 -0.0012 -0.0100 1823 GLY 227 O 0.0028 -0.0020 -0.0096 1824 ASP 228 N 0.0029 -0.0001 -0.0104 1825 ASP 228 CA 0.0030 0.0001 -0.0104 1826 ASP 228 C 0.0021 -0.0001 -0.0111 1827 ASP 228 O 0.0021 -0.0001 -0.0111 1828 ASP 228 CB 0.0037 0.0013 -0.0104 1829 ASP 228 CG 0.0047 0.0015 -0.0095 1830 ASP 228 OD1 0.0050 0.0006 -0.0088 1831 ASP 228 OD2 0.0052 0.0025 -0.0095 1832 GLY 229 N 0.0013 -0.0002 -0.0118 1833 GLY 229 CA 0.0004 -0.0005 -0.0124 1834 GLY 229 C 0.0000 -0.0018 -0.0122 1835 GLY 229 O -0.0006 -0.0021 -0.0127 1836 ASN 230 N -0.0004 -0.0019 -0.0109 1837 ASN 230 CA -0.0005 -0.0016 -0.0109 1838 ASN 230 C -0.0006 -0.0014 -0.0112 1839 ASN 230 O -0.0007 -0.0015 -0.0114 1840 ASN 230 CB -0.0005 -0.0015 -0.0109 1841 ASN 230 CG -0.0006 -0.0012 -0.0108 1842 ASN 230 ND2 -0.0006 -0.0012 -0.0107 1843 ASN 230 OD1 -0.0007 -0.0010 -0.0108 1844 LEU 231 N -0.0007 -0.0013 -0.0111 1845 LEU 231 CA -0.0008 -0.0012 -0.0113 1846 LEU 231 C -0.0010 -0.0009 -0.0113 1847 LEU 231 O -0.0011 -0.0007 -0.0115 1848 LEU 231 CB -0.0008 -0.0012 -0.0113 1849 LEU 231 CG -0.0007 -0.0015 -0.0113 1850 LEU 231 CD1 -0.0007 -0.0014 -0.0113 1851 LEU 231 CD2 -0.0008 -0.0016 -0.0116 1852 GLY 232 N -0.0009 -0.0008 -0.0112 1853 GLY 232 CA -0.0010 -0.0005 -0.0111 1854 GLY 232 C -0.0011 -0.0003 -0.0110 1855 GLY 232 O -0.0010 -0.0003 -0.0109 1856 VAL 233 N -0.0015 -0.0001 -0.0113 1857 VAL 233 CA -0.0011 -0.0001 -0.0112 1858 VAL 233 C -0.0010 -0.0002 -0.0108 1859 VAL 233 O -0.0007 -0.0002 -0.0107 1860 VAL 233 CB -0.0010 0.0001 -0.0114 1861 VAL 233 CG1 -0.0010 0.0002 -0.0118 1862 VAL 233 CG2 -0.0012 -0.0000 -0.0113 1863 ARG 234 N -0.0013 -0.0004 -0.0106 1864 ARG 234 CA -0.0012 -0.0005 -0.0103 1865 ARG 234 C -0.0012 -0.0006 -0.0101 1866 ARG 234 O -0.0009 -0.0006 -0.0099 1867 ARG 234 CB -0.0015 -0.0007 -0.0102 1868 ARG 234 CG -0.0016 -0.0006 -0.0103 1869 ARG 234 CD -0.0019 -0.0008 -0.0101 1870 ARG 234 NE -0.0022 -0.0008 -0.0103 1871 ARG 234 CZ -0.0024 -0.0009 -0.0101 1872 ARG 234 NH1 -0.0024 -0.0010 -0.0098 1873 ARG 234 NH2 -0.0027 -0.0009 -0.0103 1874 GLY 235 N -0.0014 -0.0006 -0.0102 1875 GLY 235 CA -0.0014 -0.0006 -0.0101 1876 GLY 235 C -0.0010 -0.0005 -0.0102 1877 GLY 235 O -0.0008 -0.0006 -0.0100 1878 MET 236 N -0.0012 -0.0003 -0.0101 1879 MET 236 CA -0.0010 -0.0002 -0.0101 1880 MET 236 C -0.0008 -0.0002 -0.0099 1881 MET 236 O -0.0007 -0.0002 -0.0098 1882 MET 236 CB -0.0009 -0.0002 -0.0103 1883 MET 236 CG -0.0011 -0.0002 -0.0105 1884 MET 236 SD -0.0010 -0.0001 -0.0107 1885 MET 236 CE -0.0012 -0.0001 -0.0108 1886 ALA 237 N -0.0008 -0.0002 -0.0099 1887 ALA 237 CA -0.0007 -0.0002 -0.0098 1888 ALA 237 C -0.0007 -0.0003 -0.0096 1889 ALA 237 O -0.0005 -0.0003 -0.0095 1890 ALA 237 CB -0.0007 -0.0002 -0.0098 1891 LEU 238 N -0.0009 -0.0004 -0.0095 1892 LEU 238 CA -0.0009 -0.0004 -0.0093 1893 LEU 238 C -0.0008 -0.0004 -0.0093 1894 LEU 238 O -0.0008 -0.0004 -0.0091 1895 LEU 238 CB -0.0011 -0.0005 -0.0093 1896 LEU 238 CG -0.0012 -0.0005 -0.0093 1897 LEU 238 CD1 -0.0014 -0.0006 -0.0093 1898 LEU 238 CD2 -0.0011 -0.0006 -0.0091 1899 PHE 239 N -0.0027 -0.0009 -0.0080 1900 PHE 239 CA -0.0021 -0.0008 -0.0078 1901 PHE 239 C -0.0014 -0.0005 -0.0077 1902 PHE 239 O -0.0009 -0.0007 -0.0072 1903 PHE 239 CB -0.0022 -0.0004 -0.0083 1904 PHE 239 CG -0.0016 -0.0001 -0.0082 1905 PHE 239 CD1 -0.0015 -0.0005 -0.0078 1906 PHE 239 CD2 -0.0010 0.0004 -0.0084 1907 PHE 239 CE1 -0.0010 -0.0003 -0.0077 1908 PHE 239 CE2 -0.0005 0.0006 -0.0083 1909 PHE 239 CZ -0.0004 0.0002 -0.0079 1910 PHE 240 N -0.0013 -0.0001 -0.0081 1911 PHE 240 CA -0.0007 0.0003 -0.0080 1912 PHE 240 C -0.0004 -0.0001 -0.0076 1913 PHE 240 O 0.0002 0.0001 -0.0074 1914 PHE 240 CB -0.0007 0.0008 -0.0086 1915 PHE 240 CG -0.0006 0.0013 -0.0090 1916 PHE 240 CD1 -0.0000 0.0015 -0.0089 1917 PHE 240 CD2 -0.0012 0.0015 -0.0095 1918 PHE 240 CE1 0.0000 0.0019 -0.0092 1919 PHE 240 CE2 -0.0011 0.0019 -0.0099 1920 PHE 240 CZ -0.0005 0.0021 -0.0097 1921 TYR 241 N -0.0009 -0.0005 -0.0074 1922 TYR 241 CA -0.0007 -0.0009 -0.0069 1923 TYR 241 C -0.0003 -0.0012 -0.0064 1924 TYR 241 O 0.0002 -0.0014 -0.0060 1925 TYR 241 CB -0.0013 -0.0013 -0.0069 1926 TYR 241 CG -0.0012 -0.0018 -0.0064 1927 TYR 241 CD1 -0.0009 -0.0016 -0.0064 1928 TYR 241 CD2 -0.0013 -0.0023 -0.0059 1929 TYR 241 CE1 -0.0008 -0.0020 -0.0059 1930 TYR 241 CE2 -0.0011 -0.0027 -0.0054 1931 TYR 241 CZ -0.0009 -0.0025 -0.0054 1932 TYR 241 OH -0.0007 -0.0029 -0.0050 1933 SER 242 N -0.0026 0.0007 -0.0073 1934 SER 242 CA -0.0024 0.0005 -0.0067 1935 SER 242 C -0.0023 0.0007 -0.0060 1936 SER 242 O -0.0022 0.0007 -0.0055 1937 SER 242 CB -0.0023 -0.0003 -0.0067 1938 SER 242 OG -0.0024 -0.0005 -0.0074 1939 HIS 243 N -0.0023 0.0009 -0.0060 1940 HIS 243 CA -0.0022 0.0010 -0.0054 1941 HIS 243 C -0.0022 0.0017 -0.0050 1942 HIS 243 O -0.0024 0.0023 -0.0053 1943 HIS 243 CB -0.0022 0.0010 -0.0055 1944 HIS 243 CG -0.0021 0.0011 -0.0049 1945 HIS 243 CD2 -0.0022 0.0017 -0.0047 1946 HIS 243 ND1 -0.0020 0.0007 -0.0043 1947 HIS 243 CE1 -0.0019 0.0010 -0.0038 1948 HIS 243 NE2 -0.0020 0.0015 -0.0040 1949 ALA 244 N -0.0021 0.0017 -0.0044 1950 ALA 244 CA -0.0021 0.0023 -0.0040 1951 ALA 244 C -0.0020 0.0023 -0.0034 1952 ALA 244 O -0.0018 0.0019 -0.0030 1953 ALA 244 CB -0.0020 0.0023 -0.0036 1954 CYS 245 N -0.0025 0.0064 -0.0028 1955 CYS 245 CA -0.0024 0.0063 -0.0018 1956 CYS 245 C -0.0022 0.0066 0.0005 1957 CYS 245 O -0.0020 0.0079 0.0012 1958 CYS 245 CB -0.0024 0.0080 -0.0026 1959 CYS 245 SG -0.0027 0.0073 -0.0049 1960 ASN 246 N -0.0022 0.0053 0.0016 1961 ASN 246 CA -0.0019 0.0053 0.0038 1962 ASN 246 C -0.0017 0.0062 0.0046 1963 ASN 246 O -0.0018 0.0070 0.0035 1964 ASN 246 CB -0.0020 0.0032 0.0047 1965 ASN 246 CG -0.0023 0.0016 0.0038 1966 ASN 246 ND2 -0.0025 0.0002 0.0027 1967 ASN 246 OD1 -0.0022 0.0018 0.0042 1968 ARG 247 N -0.0015 0.0061 0.0066 1969 ARG 247 CA -0.0014 0.0070 0.0075 1970 ARG 247 C -0.0015 0.0059 0.0071 1971 ARG 247 O -0.0014 0.0068 0.0072 1972 ARG 247 CB -0.0011 0.0072 0.0098 1973 ARG 247 CG -0.0012 0.0053 0.0109 1974 ARG 247 CD -0.0009 0.0056 0.0131 1975 ARG 247 NE -0.0009 0.0040 0.0142 1976 ARG 247 CZ -0.0008 0.0041 0.0148 1977 ARG 247 NH1 -0.0007 0.0057 0.0146 1978 ARG 247 NH2 -0.0009 0.0024 0.0158 1979 ILE 248 N -0.0033 0.0044 0.0059 1980 ILE 248 CA -0.0033 0.0032 0.0054 1981 ILE 248 C -0.0030 0.0036 0.0038 1982 ILE 248 O -0.0030 0.0034 0.0035 1983 ILE 248 CB -0.0034 0.0015 0.0054 1984 ILE 248 CG1 -0.0037 0.0012 0.0069 1985 ILE 248 CG2 -0.0035 0.0003 0.0051 1986 ILE 248 CD1 -0.0039 -0.0004 0.0070 1987 CYS 249 N -0.0027 0.0042 0.0027 1988 CYS 249 CA -0.0024 0.0048 0.0012 1989 CYS 249 C -0.0024 0.0061 0.0015 1990 CYS 249 O -0.0023 0.0060 0.0007 1991 CYS 249 CB -0.0022 0.0054 0.0002 1992 CYS 249 SG -0.0023 0.0040 -0.0002 1993 GLU 250 N -0.0025 0.0072 0.0026 1994 GLU 250 CA -0.0024 0.0085 0.0028 1995 GLU 250 C -0.0026 0.0080 0.0037 1996 GLU 250 O -0.0025 0.0087 0.0034 1997 GLU 250 CB -0.0024 0.0098 0.0037 1998 GLU 250 CG -0.0022 0.0105 0.0028 1999 GLU 250 CD -0.0024 0.0112 0.0039 2000 GLU 250 OE1 -0.0026 0.0112 0.0054 2001 GLU 250 OE2 -0.0022 0.0118 0.0034 2002 SER 251 N -0.0025 0.0075 0.0062 2003 SER 251 CA -0.0028 0.0069 0.0067 2004 SER 251 C -0.0028 0.0060 0.0054 2005 SER 251 O -0.0029 0.0057 0.0056 2006 SER 251 CB -0.0035 0.0060 0.0080 2007 SER 251 OG -0.0038 0.0047 0.0075 2008 MET 252 N -0.0026 0.0056 0.0043 2009 MET 252 CA -0.0026 0.0048 0.0030 2010 MET 252 C -0.0019 0.0056 0.0017 2011 MET 252 O -0.0018 0.0050 0.0005 2012 MET 252 CB -0.0029 0.0034 0.0026 2013 MET 252 CG -0.0036 0.0024 0.0038 2014 MET 252 SD -0.0040 0.0007 0.0033 2015 MET 252 CE -0.0047 -0.0003 0.0048 2016 GLY 253 N -0.0015 0.0070 0.0019 2017 GLY 253 CA -0.0009 0.0079 0.0007 2018 GLY 253 C -0.0006 0.0079 -0.0005 2019 GLY 253 O -0.0001 0.0082 -0.0017 2020 LEU 254 N 0.0008 0.0042 -0.0049 2021 LEU 254 CA 0.0003 0.0038 -0.0053 2022 LEU 254 C 0.0005 0.0041 -0.0053 2023 LEU 254 O 0.0009 0.0040 -0.0046 2024 LEU 254 CB -0.0001 0.0028 -0.0050 2025 LEU 254 CG -0.0003 0.0024 -0.0049 2026 LEU 254 CD1 -0.0007 0.0014 -0.0046 2027 LEU 254 CD2 -0.0007 0.0027 -0.0057 2028 ALA 255 N 0.0002 0.0045 -0.0060 2029 ALA 255 CA 0.0004 0.0048 -0.0060 2030 ALA 255 C 0.0001 0.0040 -0.0058 2031 ALA 255 O -0.0005 0.0034 -0.0061 2032 ALA 255 CB 0.0002 0.0055 -0.0069 2033 PRO 256 N 0.0004 0.0041 -0.0053 2034 PRO 256 CA 0.0001 0.0033 -0.0051 2035 PRO 256 C -0.0004 0.0033 -0.0059 2036 PRO 256 O -0.0004 0.0040 -0.0065 2037 PRO 256 CB 0.0007 0.0036 -0.0045 2038 PRO 256 CG 0.0013 0.0042 -0.0042 2039 PRO 256 CD 0.0011 0.0047 -0.0049 2040 PHE 257 N 0.0023 0.0002 -0.0112 2041 PHE 257 CA 0.0019 0.0001 -0.0109 2042 PHE 257 C 0.0023 -0.0003 -0.0105 2043 PHE 257 O 0.0026 -0.0006 -0.0102 2044 PHE 257 CB 0.0013 0.0001 -0.0106 2045 PHE 257 CG 0.0009 0.0001 -0.0103 2046 PHE 257 CD1 0.0005 0.0005 -0.0106 2047 PHE 257 CD2 0.0008 -0.0003 -0.0097 2048 PHE 257 CE1 0.0000 0.0005 -0.0103 2049 PHE 257 CE2 0.0004 -0.0003 -0.0095 2050 PHE 257 CZ -0.0000 0.0001 -0.0098 2051 ASP 258 N 0.0023 -0.0004 -0.0104 2052 ASP 258 CA 0.0026 -0.0007 -0.0101 2053 ASP 258 C 0.0024 -0.0010 -0.0095 2054 ASP 258 O 0.0019 -0.0010 -0.0092 2055 ASP 258 CB 0.0027 -0.0007 -0.0102 2056 ASP 258 CG 0.0031 -0.0005 -0.0108 2057 ASP 258 OD1 0.0037 -0.0007 -0.0108 2058 ASP 258 OD2 0.0029 -0.0001 -0.0112 2059 LEU 259 N 0.0026 -0.0013 -0.0092 2060 LEU 259 CA 0.0024 -0.0017 -0.0086 2061 LEU 259 C 0.0029 -0.0021 -0.0083 2062 LEU 259 O 0.0034 -0.0021 -0.0085 2063 LEU 259 CB 0.0024 -0.0017 -0.0085 2064 LEU 259 CG 0.0019 -0.0014 -0.0086 2065 LEU 259 CD1 0.0019 -0.0015 -0.0085 2066 LEU 259 CD2 0.0012 -0.0013 -0.0084 2067 SER 260 N 0.0064 -0.0036 -0.0062 2068 SER 260 CA 0.0075 -0.0036 -0.0054 2069 SER 260 C 0.0084 -0.0039 -0.0042 2070 SER 260 O 0.0080 -0.0042 -0.0037 2071 SER 260 CB 0.0066 -0.0041 -0.0049 2072 SER 260 OG 0.0060 -0.0049 -0.0035 2073 PRO 261 N 0.0097 -0.0038 -0.0036 2074 PRO 261 CA 0.0107 -0.0041 -0.0023 2075 PRO 261 C 0.0098 -0.0049 -0.0011 2076 PRO 261 O 0.0100 -0.0051 -0.0005 2077 PRO 261 CB 0.0120 -0.0039 -0.0019 2078 PRO 261 CG 0.0121 -0.0032 -0.0033 2079 PRO 261 CD 0.0106 -0.0033 -0.0041 2080 ARG 262 N 0.0088 -0.0054 -0.0006 2081 ARG 262 CA 0.0079 -0.0062 0.0006 2082 ARG 262 C 0.0069 -0.0063 0.0002 2083 ARG 262 O 0.0069 -0.0067 0.0010 2084 ARG 262 CB 0.0069 -0.0066 0.0009 2085 ARG 262 CG 0.0079 -0.0066 0.0015 2086 ARG 262 CD 0.0079 -0.0073 0.0031 2087 ARG 262 NE 0.0064 -0.0080 0.0036 2088 ARG 262 CZ 0.0058 -0.0082 0.0037 2089 ARG 262 NH1 0.0066 -0.0078 0.0033 2090 ARG 262 NH2 0.0044 -0.0088 0.0042 2091 GLU 263 N 0.0052 -0.0027 -0.0023 2092 GLU 263 CA 0.0039 -0.0033 -0.0027 2093 GLU 263 C 0.0042 -0.0032 -0.0027 2094 GLU 263 O 0.0032 -0.0036 -0.0022 2095 GLU 263 CB 0.0034 -0.0036 -0.0043 2096 GLU 263 CG 0.0032 -0.0036 -0.0044 2097 GLU 263 CD 0.0033 -0.0036 -0.0061 2098 GLU 263 OE1 0.0038 -0.0034 -0.0072 2099 GLU 263 OE2 0.0028 -0.0039 -0.0064 2100 ARG 264 N 0.0054 -0.0026 -0.0033 2101 ARG 264 CA 0.0057 -0.0025 -0.0033 2102 ARG 264 C 0.0058 -0.0025 -0.0017 2103 ARG 264 O 0.0052 -0.0027 -0.0014 2104 ARG 264 CB 0.0071 -0.0019 -0.0042 2105 ARG 264 CG 0.0074 -0.0017 -0.0046 2106 ARG 264 CD 0.0063 -0.0023 -0.0057 2107 ARG 264 NE 0.0063 -0.0023 -0.0072 2108 ARG 264 CZ 0.0067 -0.0021 -0.0085 2109 ARG 264 NH1 0.0072 -0.0019 -0.0086 2110 ARG 264 NH2 0.0067 -0.0021 -0.0099 2111 ASP 265 N 0.0064 -0.0022 -0.0006 2112 ASP 265 CA 0.0064 -0.0021 0.0011 2113 ASP 265 C 0.0049 -0.0028 0.0018 2114 ASP 265 O 0.0045 -0.0030 0.0027 2115 ASP 265 CB 0.0075 -0.0016 0.0020 2116 ASP 265 CG 0.0090 -0.0009 0.0015 2117 ASP 265 OD1 0.0094 -0.0008 0.0010 2118 ASP 265 OD2 0.0099 -0.0006 0.0015 2119 ALA 266 N 0.0035 0.0005 0.0007 2120 ALA 266 CA 0.0018 -0.0006 0.0015 2121 ALA 266 C 0.0007 -0.0013 0.0011 2122 ALA 266 O -0.0003 -0.0021 0.0022 2123 ALA 266 CB 0.0011 -0.0011 0.0007 2124 VAL 267 N 0.0010 -0.0011 -0.0006 2125 VAL 267 CA 0.0000 -0.0018 -0.0011 2126 VAL 267 C 0.0008 -0.0012 -0.0003 2127 VAL 267 O -0.0000 -0.0018 -0.0001 2128 VAL 267 CB -0.0003 -0.0019 -0.0033 2129 VAL 267 CG1 -0.0012 -0.0025 -0.0041 2130 VAL 267 CG2 0.0013 -0.0008 -0.0044 2131 ASN 268 N 0.0024 -0.0002 0.0001 2132 ASN 268 CA 0.0033 0.0003 0.0010 2133 ASN 268 C 0.0030 0.0001 0.0032 2134 ASN 268 O 0.0033 0.0003 0.0041 2135 ASN 268 CB 0.0051 0.0016 0.0006 2136 ASN 268 CG 0.0055 0.0019 -0.0015 2137 ASN 268 ND2 0.0069 0.0028 -0.0022 2138 ASN 268 OD1 0.0045 0.0012 -0.0025 2139 GLN 269 N 0.0006 0.0017 0.0059 2140 GLN 269 CA 0.0007 0.0009 0.0078 2141 GLN 269 C 0.0005 -0.0002 0.0088 2142 GLN 269 O 0.0009 -0.0005 0.0105 2143 GLN 269 CB -0.0001 -0.0002 0.0076 2144 GLN 269 CG -0.0014 -0.0018 0.0071 2145 GLN 269 CD -0.0022 -0.0029 0.0068 2146 GLN 269 NE2 -0.0032 -0.0045 0.0069 2147 GLN 269 OE1 -0.0019 -0.0022 0.0066 2148 ASN 270 N -0.0003 -0.0007 0.0079 2149 ASN 270 CA -0.0005 -0.0016 0.0089 2150 ASN 270 C 0.0002 -0.0006 0.0089 2151 ASN 270 O -0.0002 -0.0013 0.0092 2152 ASN 270 CB -0.0019 -0.0031 0.0081 2153 ASN 270 CG -0.0024 -0.0027 0.0060 2154 ASN 270 ND2 -0.0029 -0.0028 0.0050 2155 ASN 270 OD1 -0.0024 -0.0022 0.0053 2156 THR 271 N 0.0012 0.0010 0.0088 2157 THR 271 CA 0.0020 0.0020 0.0088 2158 THR 271 C 0.0026 0.0018 0.0107 2159 THR 271 O 0.0028 0.0020 0.0109 2160 THR 271 CB 0.0029 0.0039 0.0081 2161 THR 271 CG2 0.0023 0.0043 0.0060 2162 THR 271 OG1 0.0034 0.0042 0.0088 2163 LYS 272 N 0.0024 0.0032 0.0126 2164 LYS 272 CA 0.0030 0.0029 0.0144 2165 LYS 272 C 0.0022 0.0014 0.0147 2166 LYS 272 O 0.0025 0.0014 0.0156 2167 LYS 272 CB 0.0035 0.0026 0.0158 2168 LEU 273 N 0.0010 0.0001 0.0141 2169 LEU 273 CA 0.0001 -0.0013 0.0142 2170 LEU 273 C -0.0001 -0.0008 0.0130 2171 LEU 273 O -0.0004 -0.0014 0.0135 2172 LEU 273 CB -0.0011 -0.0026 0.0137 2173 LEU 274 N -0.0001 0.0003 0.0115 2174 LEU 274 CA -0.0002 0.0009 0.0104 2175 LEU 274 C 0.0008 0.0017 0.0113 2176 LEU 274 O 0.0006 0.0016 0.0111 2177 LEU 274 CB -0.0002 0.0021 0.0086 2178 LEU 274 CG -0.0014 0.0015 0.0069 2179 LEU 274 CD1 -0.0024 -0.0000 0.0070 2180 LEU 274 CD2 -0.0012 0.0028 0.0053 2181 GLN 275 N 0.0010 0.0034 0.0157 2182 GLN 275 CA 0.0025 0.0042 0.0165 2183 GLN 275 C 0.0027 0.0031 0.0180 2184 GLN 275 O 0.0035 0.0036 0.0184 2185 GLN 275 CB 0.0039 0.0052 0.0172 2186 GLN 275 CG 0.0050 0.0071 0.0165 2187 GLN 275 CD 0.0056 0.0074 0.0170 2188 GLN 275 NE2 0.0054 0.0084 0.0158 2189 GLN 275 OE1 0.0062 0.0067 0.0185 2190 SER 276 N 0.0019 0.0015 0.0187 2191 SER 276 CA 0.0019 0.0002 0.0201 2192 SER 276 C 0.0007 -0.0006 0.0195 2193 SER 276 O 0.0004 -0.0019 0.0205 2194 SER 276 CB 0.0019 -0.0011 0.0214 2195 SER 276 OG 0.0023 -0.0021 0.0229 2196 ALA 277 N -0.0002 0.0000 0.0178 2197 ALA 277 CA -0.0014 -0.0007 0.0170 2198 ALA 277 C -0.0007 -0.0004 0.0175 2199 ALA 277 O 0.0006 0.0008 0.0179 2200 ALA 277 CB -0.0024 0.0000 0.0151 2201 LYS 278 N -0.0003 0.0003 0.0177 2202 LYS 278 CA -0.0015 -0.0012 0.0194 2203 LYS 278 C -0.0013 -0.0026 0.0190 2204 LYS 278 O -0.0022 -0.0033 0.0205 2205 LYS 278 CB -0.0019 -0.0030 0.0200 2206 LYS 278 CG -0.0019 -0.0019 0.0200 2207 ILE 280 N -0.0025 -0.0024 0.0188 2208 ILE 280 CA -0.0027 0.0005 0.0199 2209 ILE 280 C -0.0027 0.0006 0.0194 2210 ILE 280 O -0.0025 -0.0017 0.0197 2211 ILE 280 CB -0.0025 0.0011 0.0233 2212 ILE 280 CG1 -0.0023 -0.0004 0.0255 2213 ILE 280 CG2 -0.0024 0.0001 0.0239 2214 ILE 280 CD1 -0.0021 0.0002 0.0288 2215 LEU 281 N -0.0029 0.0033 0.0188 2216 LEU 281 CA -0.0030 0.0038 0.0183 2217 LEU 281 C -0.0028 0.0042 0.0213 2218 LEU 281 O -0.0028 0.0055 0.0234 2219 LEU 281 CB -0.0033 0.0065 0.0161 2220 LEU 281 CG -0.0035 0.0061 0.0129 2221 LEU 281 CD1 -0.0038 0.0090 0.0112 2222 LEU 281 CD2 -0.0034 0.0035 0.0112 2223 ARG 282 N -0.0028 0.0032 0.0214 2224 ARG 282 CA -0.0026 0.0036 0.0240 2225 ARG 282 C -0.0028 0.0063 0.0237 2226 ARG 282 O -0.0028 0.0079 0.0260 2227 ARG 282 CB -0.0024 0.0007 0.0245 2228 GLY 283 N -0.0039 0.0062 0.0190 2229 GLY 283 CA -0.0039 0.0081 0.0184 2230 GLY 283 C -0.0040 0.0071 0.0172 2231 GLY 283 O -0.0039 0.0085 0.0160 2232 THR 284 N -0.0041 0.0046 0.0174 2233 THR 284 CA -0.0042 0.0035 0.0161 2234 THR 284 C -0.0044 0.0029 0.0134 2235 THR 284 O -0.0045 0.0018 0.0122 2236 THR 284 CB -0.0043 0.0010 0.0175 2237 THR 284 CG2 -0.0042 0.0014 0.0203 2238 THR 284 OG1 -0.0045 -0.0008 0.0169 2239 GLU 285 N -0.0044 0.0037 0.0124 2240 GLU 285 CA -0.0045 0.0032 0.0098 2241 GLU 285 C -0.0045 0.0048 0.0082 2242 GLU 285 O -0.0044 0.0071 0.0084 2243 GLU 285 CB -0.0045 0.0038 0.0094 2244 GLU 285 CG -0.0046 0.0019 0.0105 2245 GLU 285 CD -0.0044 0.0023 0.0133 2246 GLU 285 OE1 -0.0043 0.0045 0.0141 2247 GLU 285 OE2 -0.0045 0.0005 0.0146 2248 GLU 286 N -0.0042 0.0026 0.0082 2249 GLU 286 CA -0.0038 0.0032 0.0070 2250 GLU 286 C -0.0033 0.0040 0.0055 2251 GLU 286 O -0.0032 0.0039 0.0054 2252 GLU 286 CB -0.0039 0.0017 0.0063 2253 GLU 286 CG -0.0044 0.0009 0.0077 2254 GLU 286 CD -0.0044 -0.0005 0.0070 2255 GLU 286 OE1 -0.0042 -0.0011 0.0055 2256 GLU 286 OE2 -0.0047 -0.0008 0.0078 2257 LYS 287 N -0.0028 0.0047 0.0044 2258 LYS 287 CA -0.0023 0.0055 0.0030 2259 LYS 287 C -0.0021 0.0043 0.0015 2260 LYS 287 O -0.0023 0.0031 0.0013 2261 LYS 287 CB -0.0019 0.0071 0.0025 2262 CYS 288 N -0.0018 0.0046 0.0005 2263 CYS 288 CA -0.0016 0.0035 -0.0010 2264 CYS 288 C -0.0013 0.0033 -0.0021 2265 CYS 288 O -0.0008 0.0041 -0.0034 2266 CYS 288 CB -0.0012 0.0042 -0.0020 2267 CYS 288 SG -0.0010 0.0027 -0.0036 2268 HIS 426 N -0.0008 -0.0017 -0.0118 2269 HIS 426 CA -0.0008 -0.0016 -0.0111 2270 HIS 426 C -0.0001 -0.0006 -0.0109 2271 HIS 426 O 0.0001 -0.0003 -0.0101 2272 HIS 426 CB -0.0010 -0.0020 -0.0116 2273 LEU 427 N 0.0004 0.0000 -0.0116 2274 LEU 427 CA 0.0011 0.0010 -0.0115 2275 LEU 427 C 0.0013 0.0014 -0.0107 2276 LEU 427 O 0.0013 0.0014 -0.0110 2277 LEU 427 CB 0.0014 0.0014 -0.0126 2278 LEU 427 CG 0.0021 0.0023 -0.0127 2279 LEU 427 CD1 0.0020 0.0023 -0.0124 2280 LEU 427 CD2 0.0024 0.0027 -0.0138 2281 PRO 428 N 0.0014 0.0017 -0.0097 2282 PRO 428 CA 0.0016 0.0020 -0.0089 2283 PRO 428 C 0.0023 0.0029 -0.0092 2284 PRO 428 O 0.0027 0.0035 -0.0098 2285 PRO 428 CB 0.0016 0.0022 -0.0078 2286 PRO 428 CG 0.0018 0.0024 -0.0082 2287 PRO 428 CD 0.0015 0.0018 -0.0093 2288 ARG 429 N 0.0028 0.0008 -0.0065 2289 ARG 429 CA 0.0025 0.0008 -0.0066 2290 ARG 429 C 0.0021 0.0011 -0.0072 2291 ARG 429 O 0.0023 0.0013 -0.0076 2292 ARG 429 CB 0.0029 0.0009 -0.0066 2293 ARG 429 CG 0.0032 0.0006 -0.0060 2294 ARG 429 CD 0.0037 0.0008 -0.0061 2295 ARG 429 NE 0.0041 0.0005 -0.0055 2296 ARG 429 CZ 0.0045 0.0006 -0.0055 2297 ARG 429 NH1 0.0046 0.0009 -0.0059 2298 ARG 429 NH2 0.0049 0.0004 -0.0049 2299 ALA 430 N 0.0015 0.0010 -0.0073 2300 ALA 430 CA 0.0011 0.0012 -0.0079 2301 ALA 430 C 0.0014 0.0015 -0.0083 2302 ALA 430 O 0.0017 0.0015 -0.0082 2303 ALA 430 CB 0.0004 0.0010 -0.0079 2304 SER 431 N 0.0012 0.0018 -0.0089 2305 SER 431 CA 0.0015 0.0022 -0.0094 2306 SER 431 C 0.0010 0.0022 -0.0096 2307 SER 431 O 0.0011 0.0025 -0.0100 2308 SER 431 CB 0.0016 0.0025 -0.0099 2309 SER 431 OG 0.0020 0.0025 -0.0097 2310 ALA 432 N 0.0020 -0.0004 -0.0114 2311 ALA 432 CA -0.0007 -0.0008 -0.0124 2312 ALA 432 C -0.0011 -0.0013 -0.0107 2313 ALA 432 O -0.0003 -0.0016 -0.0081 2314 ALA 432 CB -0.0033 -0.0015 -0.0122 2315 VAL 433 N -0.0025 -0.0013 -0.0122 2316 VAL 433 CA -0.0030 -0.0017 -0.0108 2317 VAL 433 C -0.0053 -0.0027 -0.0085 2318 VAL 433 O -0.0050 -0.0031 -0.0062 2319 VAL 433 CB -0.0039 -0.0014 -0.0131 2320 VAL 433 CG1 -0.0045 -0.0019 -0.0117 2321 VAL 433 CG2 -0.0015 -0.0004 -0.0153 2322 ALA 434 N -0.0074 -0.0031 -0.0089 2323 ALA 434 CA -0.0097 -0.0040 -0.0068 2324 ALA 434 C -0.0085 -0.0043 -0.0039 2325 ALA 434 O -0.0090 -0.0049 -0.0015 2326 ALA 434 CB -0.0122 -0.0044 -0.0081 2327 LEU 435 N -0.0085 -0.0037 -0.0079 2328 LEU 435 CA -0.0063 -0.0022 -0.0041 2329 LEU 435 C -0.0052 -0.0017 -0.0027 2330 LEU 435 O -0.0052 -0.0004 0.0010 2331 LEU 435 CB -0.0023 -0.0022 -0.0044 2332 LEU 435 CG -0.0032 -0.0028 -0.0060 2333 LEU 435 CD1 0.0010 -0.0027 -0.0065 2334 LEU 435 CD2 -0.0063 -0.0019 -0.0032 2335 GLU 436 N -0.0043 -0.0027 -0.0056 2336 GLU 436 CA -0.0032 -0.0022 -0.0044 2337 GLU 436 C -0.0071 -0.0018 -0.0028 2338 GLU 436 O -0.0068 -0.0008 0.0000 2339 GLU 436 CB -0.0011 -0.0034 -0.0080 2340 GLU 436 CG 0.0001 -0.0030 -0.0071 2341 GLU 436 CD 0.0040 -0.0019 -0.0044 2342 GLU 436 OE1 0.0056 -0.0012 -0.0028 2343 GLU 436 OE2 0.0055 -0.0016 -0.0039 2344 VAL 437 N -0.0109 -0.0026 -0.0046 2345 VAL 437 CA -0.0147 -0.0022 -0.0029 2346 VAL 437 C -0.0159 -0.0009 0.0011 2347 VAL 437 O -0.0175 0.0000 0.0039 2348 VAL 437 CB -0.0186 -0.0035 -0.0059 2349 VAL 437 CG1 -0.0174 -0.0048 -0.0099 2350 VAL 437 CG2 -0.0202 -0.0038 -0.0065 2351 GLN 438 N -0.0189 0.0032 0.0040 2352 GLN 438 CA -0.0202 0.0042 0.0097 2353 GLN 438 C -0.0161 0.0036 0.0134 2354 GLN 438 O -0.0176 0.0044 0.0171 2355 GLN 438 CB -0.0205 0.0045 0.0113 2356 GLN 438 CG -0.0255 0.0056 0.0091 2357 GLN 438 CD -0.0253 0.0056 0.0097 2358 GLN 438 NE2 -0.0255 0.0051 0.0050 2359 GLN 438 OE1 -0.0248 0.0060 0.0142 2360 ARG 439 N -0.0110 0.0020 0.0123 2361 ARG 439 CA -0.0069 0.0013 0.0155 2362 ARG 439 C -0.0073 0.0013 0.0147 2363 ARG 439 O -0.0070 0.0017 0.0186 2364 ARG 439 CB -0.0014 -0.0004 0.0139 2365 ARG 439 CG 0.0032 -0.0014 0.0160 2366 ARG 439 CD 0.0083 -0.0032 0.0132 2367 ARG 439 NE 0.0088 -0.0039 0.0080 2368 ARG 439 CZ 0.0105 -0.0045 0.0075 2369 ARG 439 NH1 0.0119 -0.0043 0.0119 2370 ARG 439 NH2 0.0109 -0.0051 0.0026 2371 LEU 440 N -0.0081 0.0009 0.0095 2372 LEU 440 CA -0.0085 0.0009 0.0084 2373 LEU 440 C -0.0132 0.0025 0.0111 2374 LEU 440 O -0.0129 0.0026 0.0130 2375 LEU 440 CB -0.0088 0.0002 0.0022 2376 LEU 440 CG -0.0038 -0.0015 -0.0010 2377 LEU 440 CD1 -0.0051 -0.0019 -0.0071 2378 LEU 440 CD2 0.0002 -0.0025 -0.0001 2379 ASN 441 N -0.0280 0.0065 0.0202 2380 ASN 441 CA -0.0386 0.0110 0.0271 2381 ASN 441 C -0.0361 0.0080 0.0434 2382 ASN 441 O -0.0381 0.0084 0.0490 2383 ASN 441 CB -0.0522 0.0180 0.0254 2384 ASN 441 CG -0.0563 0.0217 0.0093 2385 ASN 441 ND2 -0.0640 0.0259 0.0055 2386 ASN 441 OD1 -0.0524 0.0207 0.0004 2387 ALA 442 N -0.0316 0.0049 0.0512 2388 ALA 442 CA -0.0285 0.0017 0.0668 2389 ALA 442 C -0.0174 -0.0040 0.0688 2390 ALA 442 O -0.0163 -0.0059 0.0812 2391 ALA 442 CB -0.0244 -0.0010 0.0732 2392 LEU 443 N -0.0093 -0.0068 0.0571 2393 LEU 443 CA 0.0003 -0.0116 0.0580 2394 LEU 443 C -0.0071 -0.0083 0.0608 2395 LEU 443 O -0.0027 -0.0113 0.0695 2396 LEU 443 CB 0.0093 -0.0145 0.0438 2397 ASP 444 N -0.0362 0.0049 0.0661 2398 ASP 444 CA -0.0439 0.0131 0.0645 2399 ASP 444 C -0.0226 0.0071 0.0413 2400 ASP 444 O -0.0287 0.0198 0.0300 2401 LEU 445 N 0.0024 -0.0122 0.0339 2402 LEU 445 CA 0.0245 -0.0206 0.0132 2403 LEU 445 C 0.0273 -0.0026 -0.0206 2404 LEU 445 O 0.0450 -0.0086 -0.0384 2405 LEU 445 CB 0.0497 -0.0481 0.0188 2406 LEU 445 CG 0.0560 -0.0695 0.0440 2407 LEU 445 CD1 0.0767 -0.0802 0.0294 2408 LEU 445 CD2 0.0314 -0.0607 0.0680 2409 GLU 446 N 0.0091 0.0200 -0.0292 2410 GLU 446 CA 0.0090 0.0393 -0.0607 2411 GLU 446 C 0.0332 0.0307 -0.0842 2412 GLU 446 O 0.0494 0.0280 -0.1050 2413 GLU 446 CB -0.0162 0.0645 -0.0625 2414 LYS 448 N 0.0114 0.0018 -0.0200 2415 LYS 448 CA 0.0102 0.0010 -0.0213 2416 LYS 448 C 0.0096 -0.0005 -0.0199 2417 LYS 448 O 0.0103 -0.0005 -0.0179 2418 LYS 448 CB 0.0089 0.0000 -0.0229 2419 ILE 449 N 0.0084 -0.0016 -0.0209 2420 ILE 449 CA 0.0077 -0.0030 -0.0198 2421 ILE 449 C 0.0064 -0.0049 -0.0193 2422 ILE 449 O 0.0056 -0.0054 -0.0207 2423 ILE 449 CB 0.0073 -0.0030 -0.0211 2424 ILE 449 CG1 0.0061 -0.0034 -0.0233 2425 ILE 449 CG2 0.0086 -0.0011 -0.0213 2426 ILE 449 CD1 0.0052 -0.0041 -0.0244 2427 GLY 450 N 0.0063 -0.0059 -0.0174 2428 GLY 450 CA 0.0051 -0.0078 -0.0167 2429 GLY 450 C 0.0051 -0.0080 -0.0165 2430 GLY 450 O 0.0038 -0.0093 -0.0171 2431 LYS 451 N 0.0095 -0.0062 -0.0098 2432 LYS 451 CA 0.0082 -0.0076 -0.0098 2433 LYS 451 C 0.0063 -0.0068 -0.0099 2434 LYS 451 O 0.0050 -0.0079 -0.0099 2435 LYS 451 CB 0.0083 -0.0092 -0.0097 2436 LYS 451 CG 0.0102 -0.0097 -0.0096 2437 LYS 451 CD 0.0110 -0.0114 -0.0095 2438 LYS 451 CE 0.0120 -0.0109 -0.0095 2439 LYS 451 NZ 0.0129 -0.0126 -0.0093 2440 SER 452 N 0.0061 -0.0050 -0.0100 2441 SER 452 CA 0.0043 -0.0041 -0.0102 2442 SER 452 C 0.0044 -0.0025 -0.0103 2443 SER 452 O 0.0055 -0.0012 -0.0103 2444 SER 452 CB 0.0037 -0.0035 -0.0102 2445 SER 452 OG 0.0021 -0.0023 -0.0104 2446 ILE 453 N 0.0032 -0.0025 -0.0103 2447 ILE 453 CA 0.0031 -0.0010 -0.0104 2448 ILE 453 C 0.0022 0.0006 -0.0105 2449 ILE 453 O 0.0025 0.0022 -0.0106 2450 ILE 453 CB 0.0021 -0.0016 -0.0104 2451 ILE 453 CG1 0.0029 -0.0033 -0.0103 2452 ILE 453 CG2 0.0021 -0.0000 -0.0105 2453 ILE 453 CD1 0.0017 -0.0043 -0.0103 2454 LEU 454 N 0.0019 -0.0006 -0.0113 2455 LEU 454 CA 0.0019 -0.0004 -0.0111 2456 LEU 454 C 0.0021 -0.0003 -0.0111 2457 LEU 454 O 0.0021 -0.0001 -0.0110 2458 LEU 454 CB 0.0019 -0.0003 -0.0110 2459 LEU 454 CG 0.0019 -0.0002 -0.0108 2460 LEU 454 CD1 0.0017 -0.0003 -0.0106 2461 LEU 454 CD2 0.0020 -0.0001 -0.0108 2462 GLY 455 N 0.0023 -0.0002 -0.0113 2463 GLY 455 CA 0.0024 -0.0001 -0.0114 2464 GLY 455 C 0.0024 -0.0001 -0.0114 2465 GLY 455 O 0.0024 0.0000 -0.0113 2466 LYS 456 N 0.0023 -0.0004 -0.0115 2467 LYS 456 CA 0.0022 -0.0004 -0.0114 2468 LYS 456 C 0.0021 -0.0004 -0.0112 2469 LYS 456 O 0.0021 -0.0003 -0.0111 2470 LYS 456 CB 0.0021 -0.0007 -0.0116 2471 LYS 456 CG 0.0022 -0.0007 -0.0118 2472 LYS 456 CD 0.0021 -0.0010 -0.0120 2473 LYS 456 CE 0.0023 -0.0010 -0.0122 2474 LYS 456 NZ 0.0025 -0.0009 -0.0123 2475 VAL 457 N 0.0011 0.0002 -0.0107 2476 VAL 457 CA 0.0011 0.0002 -0.0107 2477 VAL 457 C 0.0014 -0.0002 -0.0103 2478 VAL 457 O 0.0013 -0.0001 -0.0099 2479 VAL 457 CB 0.0011 0.0003 -0.0113 2480 VAL 457 CG1 0.0011 0.0003 -0.0112 2481 VAL 457 CG2 0.0008 0.0007 -0.0116 2482 HIS 458 N 0.0018 -0.0005 -0.0103 2483 HIS 458 CA 0.0021 -0.0009 -0.0100 2484 HIS 458 C 0.0019 -0.0009 -0.0093 2485 HIS 458 O 0.0020 -0.0010 -0.0089 2486 HIS 458 CB 0.0025 -0.0013 -0.0102 2487 HIS 458 CG 0.0027 -0.0014 -0.0107 2488 HIS 458 CD2 0.0028 -0.0014 -0.0113 2489 HIS 458 ND1 0.0029 -0.0016 -0.0107 2490 HIS 458 CE1 0.0031 -0.0017 -0.0112 2491 HIS 458 NE2 0.0030 -0.0015 -0.0116 2492 LEU 459 N 0.0018 -0.0007 -0.0092 2493 LEU 459 CA 0.0016 -0.0007 -0.0086 2494 LEU 459 C 0.0012 -0.0004 -0.0084 2495 LEU 459 O 0.0012 -0.0004 -0.0079 2496 LEU 459 CB 0.0015 -0.0005 -0.0086 2497 LEU 459 CG 0.0014 -0.0006 -0.0081 2498 LEU 459 CD1 0.0018 -0.0011 -0.0078 2499 LEU 459 CD2 0.0013 -0.0005 -0.0081 2500 ALA 460 N 0.0003 -0.0015 -0.0083 2501 ALA 460 CA -0.0004 -0.0012 -0.0078 2502 ALA 460 C 0.0000 -0.0016 -0.0073 2503 ALA 460 O -0.0003 -0.0015 -0.0065 2504 ALA 460 CB -0.0010 -0.0006 -0.0086 2505 MET 461 N 0.0008 -0.0020 -0.0078 2506 MET 461 CA 0.0013 -0.0024 -0.0074 2507 MET 461 C 0.0016 -0.0028 -0.0063 2508 MET 461 O 0.0015 -0.0030 -0.0055 2509 MET 461 CB 0.0021 -0.0027 -0.0081 2510 MET 461 CG 0.0018 -0.0023 -0.0092 2511 MET 461 SD 0.0025 -0.0027 -0.0096 2512 MET 461 CE 0.0025 -0.0030 -0.0084 2513 VAL 462 N 0.0020 -0.0031 -0.0063 2514 VAL 462 CA 0.0023 -0.0035 -0.0053 2515 VAL 462 C 0.0015 -0.0032 -0.0044 2516 VAL 462 O 0.0016 -0.0035 -0.0035 2517 VAL 462 CB 0.0027 -0.0037 -0.0055 2518 VAL 462 CG1 0.0029 -0.0041 -0.0045 2519 VAL 462 CG2 0.0035 -0.0041 -0.0064 2520 ARG 463 N 0.0003 -0.0031 -0.0049 2521 ARG 463 CA -0.0005 -0.0030 -0.0041 2522 ARG 463 C -0.0007 -0.0030 -0.0038 2523 ARG 463 O -0.0011 -0.0033 -0.0030 2524 ARG 463 CB -0.0014 -0.0022 -0.0044 2525 ARG 463 CG -0.0014 -0.0021 -0.0045 2526 ARG 463 CD -0.0024 -0.0014 -0.0045 2527 ARG 463 NE -0.0023 -0.0012 -0.0048 2528 ARG 463 CZ -0.0022 -0.0007 -0.0057 2529 ARG 463 NH1 -0.0020 -0.0004 -0.0064 2530 ARG 463 NH2 -0.0021 -0.0006 -0.0059 2531 TYR 464 N -0.0003 -0.0028 -0.0045 2532 TYR 464 CA -0.0004 -0.0030 -0.0043 2533 TYR 464 C 0.0002 -0.0038 -0.0037 2534 TYR 464 O -0.0001 -0.0041 -0.0030 2535 TYR 464 CB -0.0000 -0.0026 -0.0053 2536 TYR 464 CG -0.0008 -0.0017 -0.0056 2537 TYR 464 CD1 -0.0018 -0.0015 -0.0050 2538 TYR 464 CD2 -0.0007 -0.0012 -0.0066 2539 TYR 464 CE1 -0.0025 -0.0007 -0.0053 2540 TYR 464 CE2 -0.0014 -0.0004 -0.0070 2541 TYR 464 CZ -0.0023 -0.0002 -0.0063 2542 TYR 464 OH -0.0031 0.0006 -0.0067 2543 HIS 465 N 0.0011 -0.0043 -0.0039 2544 HIS 465 CA 0.0017 -0.0051 -0.0033 2545 HIS 465 C 0.0012 -0.0055 -0.0022 2546 HIS 465 O 0.0012 -0.0059 -0.0015 2547 HIS 465 CB 0.0026 -0.0055 -0.0037 2548 HIS 465 CG 0.0034 -0.0056 -0.0044 2549 HIS 465 CD2 0.0039 -0.0054 -0.0054 2550 HIS 465 ND1 0.0037 -0.0061 -0.0041 2551 HIS 465 CE1 0.0044 -0.0061 -0.0049 2552 HIS 465 NE2 0.0045 -0.0057 -0.0056 2553 GLU 466 N 0.0007 -0.0067 -0.0008 2554 GLU 466 CA 0.0001 -0.0071 0.0012 2555 GLU 466 C -0.0009 -0.0060 0.0019 2556 GLU 466 O -0.0011 -0.0065 0.0033 2557 GLU 466 CB -0.0003 -0.0069 0.0018 2558 GLU 466 CG -0.0006 -0.0077 0.0037 2559 GLU 466 CD -0.0010 -0.0074 0.0044 2560 GLU 466 OE1 -0.0010 -0.0067 0.0033 2561 GLU 466 OE2 -0.0014 -0.0078 0.0060 2562 GLY 467 N -0.0014 -0.0045 0.0010 2563 GLY 467 CA -0.0024 -0.0033 0.0017 2564 GLY 467 C -0.0022 -0.0035 0.0014 2565 GLY 467 O -0.0029 -0.0026 0.0021 2566 GLY 468 N -0.0011 -0.0045 0.0004 2567 GLY 468 CA -0.0009 -0.0047 0.0001 2568 GLY 468 C -0.0010 -0.0035 -0.0015 2569 GLY 468 O -0.0012 -0.0031 -0.0015 2570 ARG 469 N -0.0011 -0.0030 -0.0033 2571 ARG 469 CA -0.0012 -0.0024 -0.0040 2572 ARG 469 C -0.0006 -0.0028 -0.0047 2573 ARG 469 O -0.0007 -0.0024 -0.0052 2574 ARG 469 CB -0.0014 -0.0019 -0.0045 2575 ARG 469 CG -0.0015 -0.0012 -0.0054 2576 ARG 469 CD -0.0021 -0.0006 -0.0051 2577 ARG 469 NE -0.0023 0.0001 -0.0058 2578 ARG 469 CZ -0.0020 0.0002 -0.0065 2579 ARG 469 NH1 -0.0015 -0.0005 -0.0066 2580 ARG 469 NH2 -0.0022 0.0009 -0.0071 2581 PHE 470 N -0.0000 -0.0036 -0.0047 2582 PHE 470 CA 0.0006 -0.0040 -0.0053 2583 PHE 470 C 0.0009 -0.0047 -0.0049 2584 PHE 470 O 0.0014 -0.0051 -0.0053 2585 PHE 470 CB 0.0010 -0.0043 -0.0059 2586 PHE 470 CG 0.0008 -0.0037 -0.0064 2587 PHE 470 CD1 0.0004 -0.0029 -0.0068 2588 PHE 470 CD2 0.0010 -0.0038 -0.0064 2589 PHE 470 CE1 0.0002 -0.0023 -0.0073 2590 PHE 470 CE2 0.0007 -0.0032 -0.0069 2591 PHE 470 CZ 0.0004 -0.0025 -0.0074 2592 CYS 471 N 0.0005 -0.0048 -0.0040 2593 CYS 471 CA 0.0007 -0.0054 -0.0035 2594 CYS 471 C 0.0003 -0.0050 -0.0031 2595 CYS 471 O -0.0003 -0.0043 -0.0030 2596 CYS 471 CB 0.0009 -0.0060 -0.0028 2597 CYS 471 SG 0.0002 -0.0056 -0.0018 2598 GLU 472 N -0.0042 -0.0003 -0.0090 2599 GLU 472 CA -0.0049 0.0096 -0.0095 2600 GLU 472 C -0.0013 0.0120 -0.0024 2601 GLU 472 O 0.0017 0.0062 0.0030 2602 GLU 472 CB -0.0095 0.0116 -0.0183 2603 LYS 473 N -0.0018 0.0208 -0.0026 2604 LYS 473 CA 0.0014 0.0242 0.0038 2605 LYS 473 C 0.0010 0.0191 0.0027 2606 LYS 473 O -0.0025 0.0166 -0.0043 2607 LYS 473 CB 0.0007 0.0350 0.0032 2608 GLU 475 N 0.0019 -0.0128 0.0066 2609 GLU 475 CA 0.0039 -0.0141 0.0047 2610 GLU 475 C 0.0035 -0.0140 0.0054 2611 GLU 475 O 0.0018 -0.0119 0.0055 2612 GLU 475 CB 0.0046 -0.0128 0.0012 2613 GLU 475 CG 0.0066 -0.0140 -0.0010 2614 GLU 475 CD 0.0087 -0.0170 -0.0005 2615 GLU 475 OE1 0.0094 -0.0178 -0.0004 2616 GLU 475 OE2 0.0098 -0.0186 -0.0001 2617 GLU 476 N 0.0052 -0.0164 0.0057 2618 GLU 476 CA 0.0051 -0.0165 0.0062 2619 GLU 476 C 0.0055 -0.0151 0.0031 2620 GLU 476 O 0.0071 -0.0156 0.0006 2621 GLU 476 CB 0.0068 -0.0195 0.0074 2622 GLU 476 CG 0.0069 -0.0213 0.0099 2623 TRP 477 N 0.0041 -0.0134 0.0032 2624 TRP 477 CA 0.0043 -0.0119 0.0004 2625 TRP 477 C 0.0065 -0.0138 -0.0010 2626 TRP 477 O 0.0073 -0.0159 0.0007 2627 TRP 477 CB 0.0022 -0.0095 0.0010 2628 TRP 477 CG 0.0017 -0.0104 0.0034 2629 TRP 477 CD1 0.0006 -0.0110 0.0066 2630 TRP 477 CD2 0.0022 -0.0108 0.0029 2631 TRP 477 CE2 0.0013 -0.0116 0.0059 2632 TRP 477 CE3 0.0032 -0.0104 0.0003 2633 TRP 477 NE1 0.0004 -0.0118 0.0081 2634 TRP 477 CZ2 0.0016 -0.0121 0.0063 2635 TRP 477 CZ3 0.0035 -0.0110 0.0007 2636 TRP 477 CH2 0.0026 -0.0118 0.0036 2637 ASP 478 N 0.0050 -0.0108 0.0013 2638 ASP 478 CA 0.0062 -0.0110 0.0006 2639 ASP 478 C 0.0059 -0.0106 0.0004 2640 ASP 478 O 0.0054 -0.0096 -0.0003 2641 ASP 478 CB 0.0070 -0.0105 -0.0005 2642 ASP 478 CG 0.0083 -0.0109 -0.0010 2643 ASP 478 OD1 0.0087 -0.0115 -0.0006 2644 ASP 478 OD2 0.0091 -0.0106 -0.0019 2645 GLN 479 N 0.0061 -0.0113 0.0011 2646 GLN 479 CA 0.0058 -0.0109 0.0009 2647 GLN 479 C 0.0069 -0.0107 -0.0001 2648 GLN 479 O 0.0066 -0.0100 -0.0007 2649 GLN 479 CB 0.0056 -0.0118 0.0020 2650 GLN 479 CG 0.0045 -0.0121 0.0031 2651 GLN 479 CD 0.0042 -0.0128 0.0041 2652 GLN 479 NE2 0.0031 -0.0128 0.0049 2653 GLN 479 OE1 0.0051 -0.0135 0.0042 2654 GLU 480 N 0.0081 -0.0113 -0.0003 2655 GLU 480 CA 0.0091 -0.0112 -0.0013 2656 GLU 480 C 0.0090 -0.0100 -0.0024 2657 GLU 480 O 0.0092 -0.0095 -0.0031 2658 GLU 480 CB 0.0104 -0.0120 -0.0013 2659 GLU 480 CG 0.0107 -0.0132 -0.0002 2660 GLU 480 CD 0.0102 -0.0137 0.0007 2661 GLU 480 OE1 0.0106 -0.0138 0.0006 2662 GLU 480 OE2 0.0093 -0.0140 0.0017 2663 SER 481 N 0.0077 -0.0079 -0.0028 2664 SER 481 CA 0.0074 -0.0070 -0.0040 2665 SER 481 C 0.0066 -0.0063 -0.0038 2666 SER 481 O 0.0066 -0.0060 -0.0047 2667 SER 481 CB 0.0069 -0.0064 -0.0044 2668 SER 481 OG 0.0076 -0.0071 -0.0046 2669 ALA 482 N 0.0061 -0.0062 -0.0025 2670 ALA 482 CA 0.0054 -0.0056 -0.0022 2671 ALA 482 C 0.0060 -0.0061 -0.0024 2672 ALA 482 O 0.0057 -0.0056 -0.0030 2673 ALA 482 CB 0.0048 -0.0054 -0.0007 2674 VAL 483 N 0.0068 -0.0072 -0.0020 2675 VAL 483 CA 0.0074 -0.0077 -0.0022 2676 VAL 483 C 0.0079 -0.0077 -0.0037 2677 VAL 483 O 0.0080 -0.0077 -0.0042 2678 VAL 483 CB 0.0082 -0.0089 -0.0013 2679 VAL 483 CG1 0.0089 -0.0095 -0.0016 2680 VAL 483 CG2 0.0077 -0.0088 0.0002 2681 PHE 484 N 0.0075 -0.0052 -0.0042 2682 PHE 484 CA 0.0077 -0.0052 -0.0056 2683 PHE 484 C 0.0069 -0.0046 -0.0065 2684 PHE 484 O 0.0072 -0.0047 -0.0074 2685 PHE 484 CB 0.0077 -0.0052 -0.0058 2686 PHE 484 CG 0.0078 -0.0051 -0.0072 2687 PHE 484 CD1 0.0089 -0.0057 -0.0078 2688 PHE 484 CD2 0.0069 -0.0045 -0.0078 2689 PHE 484 CE1 0.0090 -0.0056 -0.0091 2690 PHE 484 CE2 0.0070 -0.0044 -0.0091 2691 PHE 484 CZ 0.0081 -0.0050 -0.0098 2692 HIS 485 N 0.0058 -0.0040 -0.0061 2693 HIS 485 CA 0.0049 -0.0034 -0.0070 2694 HIS 485 C 0.0048 -0.0033 -0.0068 2695 HIS 485 O 0.0045 -0.0030 -0.0077 2696 HIS 485 CB 0.0038 -0.0027 -0.0066 2697 HIS 485 CG 0.0037 -0.0026 -0.0070 2698 HIS 485 CD2 0.0035 -0.0026 -0.0063 2699 HIS 485 ND1 0.0039 -0.0026 -0.0083 2700 HIS 485 CE1 0.0038 -0.0025 -0.0084 2701 HIS 485 NE2 0.0036 -0.0025 -0.0072 2702 LEU 486 N 0.0052 -0.0036 -0.0057 2703 LEU 486 CA 0.0052 -0.0037 -0.0055 2704 LEU 486 C 0.0062 -0.0042 -0.0064 2705 LEU 486 O 0.0060 -0.0040 -0.0070 2706 LEU 486 CB 0.0053 -0.0039 -0.0041 2707 LEU 486 CG 0.0051 -0.0038 -0.0037 2708 LEU 486 CD1 0.0039 -0.0030 -0.0040 2709 LEU 486 CD2 0.0053 -0.0041 -0.0023 2710 GLU 487 N 0.0060 -0.0021 -0.0042 2711 GLU 487 CA 0.0072 -0.0029 -0.0054 2712 GLU 487 C 0.0064 -0.0030 -0.0072 2713 GLU 487 O 0.0068 -0.0034 -0.0083 2714 GLU 487 CB 0.0083 -0.0034 -0.0051 2715 GLU 487 CG 0.0093 -0.0034 -0.0034 2716 GLU 487 CD 0.0109 -0.0042 -0.0035 2717 GLU 487 OE1 0.0117 -0.0049 -0.0046 2718 GLU 487 OE2 0.0114 -0.0042 -0.0024 2719 HIS 488 N 0.0052 -0.0025 -0.0075 2720 HIS 488 CA 0.0044 -0.0025 -0.0092 2721 HIS 488 C 0.0036 -0.0022 -0.0097 2722 HIS 488 O 0.0036 -0.0026 -0.0111 2723 HIS 488 CB 0.0032 -0.0020 -0.0093 2724 HIS 488 CG 0.0040 -0.0024 -0.0098 2725 HIS 488 CD2 0.0036 -0.0021 -0.0095 2726 HIS 488 ND1 0.0053 -0.0032 -0.0106 2727 HIS 488 CE1 0.0057 -0.0035 -0.0108 2728 HIS 488 NE2 0.0046 -0.0028 -0.0101 2729 ALA 489 N 0.0028 -0.0016 -0.0085 2730 ALA 489 CA 0.0020 -0.0013 -0.0089 2731 ALA 489 C 0.0032 -0.0019 -0.0093 2732 ALA 489 O 0.0029 -0.0020 -0.0104 2733 ALA 489 CB 0.0011 -0.0005 -0.0074 2734 ALA 490 N 0.0031 -0.0007 -0.0095 2735 ALA 490 CA 0.0038 -0.0009 -0.0098 2736 ALA 490 C 0.0041 -0.0012 -0.0106 2737 ALA 490 O 0.0042 -0.0014 -0.0111 2738 ALA 490 CB 0.0045 -0.0009 -0.0091 2739 ASN 491 N 0.0042 -0.0013 -0.0106 2740 ASN 491 CA 0.0044 -0.0015 -0.0114 2741 ASN 491 C 0.0038 -0.0016 -0.0121 2742 ASN 491 O 0.0040 -0.0018 -0.0128 2743 ASN 491 CB 0.0046 -0.0016 -0.0113 2744 ASN 491 CG 0.0053 -0.0015 -0.0106 2745 ASN 491 ND2 0.0053 -0.0014 -0.0103 2746 ASN 491 OD1 0.0058 -0.0016 -0.0104 2747 LEU 492 N 0.0031 -0.0014 -0.0119 2748 LEU 492 CA 0.0024 -0.0014 -0.0125 2749 LEU 492 C 0.0022 -0.0014 -0.0127 2750 LEU 492 O 0.0016 -0.0013 -0.0131 2751 LEU 492 CB 0.0017 -0.0011 -0.0123 2752 LEU 492 CG 0.0017 -0.0011 -0.0123 2753 LEU 492 CD1 0.0010 -0.0009 -0.0120 2754 LEU 492 CD2 0.0019 -0.0014 -0.0131 2755 GLY 493 N 0.0066 -0.0025 -0.0134 2756 GLY 493 CA 0.0061 -0.0022 -0.0134 2757 GLY 493 C 0.0052 -0.0019 -0.0126 2758 GLY 493 O 0.0046 -0.0015 -0.0128 2759 GLU 494 N 0.0051 -0.0021 -0.0118 2760 GLU 494 CA 0.0043 -0.0018 -0.0110 2761 GLU 494 C 0.0045 -0.0021 -0.0101 2762 GLU 494 O 0.0051 -0.0027 -0.0096 2763 GLU 494 CB 0.0041 -0.0018 -0.0105 2764 GLU 494 CG 0.0036 -0.0014 -0.0112 2765 GLU 494 CD 0.0028 -0.0007 -0.0116 2766 GLU 494 OE1 0.0021 -0.0005 -0.0109 2767 GLU 494 OE2 0.0028 -0.0005 -0.0125 2768 LEU 495 N 0.0040 -0.0018 -0.0101 2769 LEU 495 CA 0.0042 -0.0021 -0.0094 2770 LEU 495 C 0.0041 -0.0024 -0.0083 2771 LEU 495 O 0.0046 -0.0029 -0.0077 2772 LEU 495 CB 0.0035 -0.0017 -0.0096 2773 LEU 495 CG 0.0038 -0.0020 -0.0091 2774 LEU 495 CD1 0.0048 -0.0025 -0.0094 2775 LEU 495 CD2 0.0032 -0.0016 -0.0094 2776 GLU 496 N 0.0012 -0.0015 -0.0053 2777 GLU 496 CA 0.0010 -0.0021 -0.0036 2778 GLU 496 C 0.0025 -0.0030 -0.0032 2779 GLU 496 O 0.0029 -0.0038 -0.0020 2780 GLU 496 CB -0.0003 -0.0015 -0.0032 2781 GLU 496 CG -0.0004 -0.0021 -0.0016 2782 GLU 496 CD -0.0020 -0.0014 -0.0008 2783 GLU 496 OE1 -0.0030 -0.0005 -0.0017 2784 GLU 496 OE2 -0.0023 -0.0019 0.0006 2785 ALA 497 N 0.0033 -0.0030 -0.0043 2786 ALA 497 CA 0.0047 -0.0039 -0.0041 2787 ALA 497 C 0.0059 -0.0046 -0.0041 2788 ALA 497 O 0.0068 -0.0055 -0.0031 2789 ALA 497 CB 0.0052 -0.0037 -0.0054 2790 ILE 498 N 0.0059 -0.0042 -0.0051 2791 ILE 498 CA 0.0071 -0.0049 -0.0051 2792 ILE 498 C 0.0068 -0.0053 -0.0036 2793 ILE 498 O 0.0079 -0.0062 -0.0029 2794 ILE 498 CB 0.0071 -0.0043 -0.0066 2795 ILE 498 CG1 0.0075 -0.0039 -0.0082 2796 ILE 498 CG2 0.0082 -0.0049 -0.0066 2797 ILE 498 CD1 0.0072 -0.0031 -0.0096 2798 VAL 499 N 0.0052 -0.0075 0.0011 2799 VAL 499 CA 0.0047 -0.0079 0.0015 2800 VAL 499 C 0.0050 -0.0086 0.0027 2801 VAL 499 O 0.0053 -0.0088 0.0031 2802 VAL 499 CB 0.0033 -0.0080 0.0012 2803 VAL 499 CG1 0.0028 -0.0084 0.0017 2804 VAL 499 CG2 0.0030 -0.0073 0.0001 2805 GLY 500 N 0.0049 -0.0090 0.0033 2806 GLY 500 CA 0.0052 -0.0097 0.0044 2807 GLY 500 C 0.0065 -0.0096 0.0047 2808 GLY 500 O 0.0067 -0.0100 0.0054 2809 LEU 501 N 0.0073 -0.0091 0.0042 2810 LEU 501 CA 0.0086 -0.0090 0.0045 2811 LEU 501 C 0.0089 -0.0087 0.0041 2812 LEU 501 O 0.0097 -0.0089 0.0047 2813 LEU 501 CB 0.0094 -0.0085 0.0041 2814 LEU 501 CG 0.0095 -0.0089 0.0046 2815 LEU 501 CD1 0.0104 -0.0084 0.0042 2816 LEU 501 CD2 0.0099 -0.0096 0.0058 2817 GLY 502 N 0.0066 -0.0104 0.0053 2818 GLY 502 CA 0.0061 -0.0100 0.0049 2819 GLY 502 C 0.0057 -0.0105 0.0044 2820 GLY 502 O 0.0054 -0.0102 0.0042 2821 LEU 503 N 0.0058 -0.0111 0.0042 2822 LEU 503 CA 0.0055 -0.0116 0.0037 2823 LEU 503 C 0.0057 -0.0118 0.0038 2824 LEU 503 O 0.0054 -0.0119 0.0035 2825 LEU 503 CB 0.0056 -0.0122 0.0035 2826 LEU 503 CG 0.0054 -0.0120 0.0034 2827 LEU 503 CD1 0.0054 -0.0126 0.0032 2828 LEU 503 CD2 0.0048 -0.0116 0.0030 2829 MET 504 N 0.0062 -0.0119 0.0043 2830 MET 504 CA 0.0064 -0.0122 0.0044 2831 MET 504 C 0.0063 -0.0117 0.0044 2832 MET 504 O 0.0061 -0.0118 0.0042 2833 MET 504 CB 0.0071 -0.0125 0.0048 2834 MET 504 CG 0.0073 -0.0132 0.0047 2835 MET 504 SD 0.0079 -0.0134 0.0053 2836 MET 504 CE 0.0083 -0.0138 0.0054 2837 TYR 505 N 0.0057 -0.0098 0.0058 2838 TYR 505 CA 0.0042 -0.0078 0.0061 2839 TYR 505 C 0.0026 -0.0068 0.0043 2840 TYR 505 O 0.0012 -0.0054 0.0040 2841 TYR 505 CB 0.0043 -0.0065 0.0086 2842 TYR 505 CG 0.0056 -0.0070 0.0106 2843 TYR 505 CD1 0.0055 -0.0069 0.0106 2844 TYR 505 CD2 0.0069 -0.0076 0.0124 2845 TYR 505 CE1 0.0067 -0.0073 0.0124 2846 TYR 505 CE2 0.0081 -0.0080 0.0142 2847 TYR 505 CZ 0.0080 -0.0079 0.0142 2848 TYR 505 OH 0.0091 -0.0083 0.0159 2849 SER 506 N 0.0026 -0.0075 0.0031 2850 SER 506 CA 0.0011 -0.0068 0.0011 2851 SER 506 C 0.0009 -0.0079 -0.0012 2852 SER 506 O -0.0001 -0.0076 -0.0031 2853 SER 506 CB 0.0011 -0.0069 0.0009 2854 SER 506 OG 0.0012 -0.0058 0.0030 2855 GLN 507 N 0.0020 -0.0092 -0.0012 2856 GLN 507 CA 0.0020 -0.0103 -0.0033 2857 GLN 507 C 0.0023 -0.0116 -0.0050 2858 GLN 507 O 0.0016 -0.0119 -0.0072 2859 GLN 507 CB 0.0004 -0.0090 -0.0045 2860 GLN 507 CG -0.0002 -0.0073 -0.0029 2861 GLN 507 CD 0.0011 -0.0081 -0.0012 2862 GLN 507 NE2 0.0020 -0.0097 -0.0022 2863 GLN 507 OE1 0.0013 -0.0072 0.0009 2864 LEU 508 N 0.0054 -0.0101 0.0020 2865 LEU 508 CA 0.0048 -0.0107 0.0012 2866 LEU 508 C 0.0045 -0.0119 0.0016 2867 LEU 508 O 0.0049 -0.0122 0.0025 2868 LEU 508 CB 0.0046 -0.0103 0.0004 2869 LEU 508 CG 0.0047 -0.0092 -0.0003 2870 LEU 508 CD1 0.0045 -0.0089 -0.0009 2871 LEU 508 CD2 0.0043 -0.0093 -0.0011 2872 PRO 509 N 0.0040 -0.0127 0.0010 2873 PRO 509 CA 0.0037 -0.0138 0.0013 2874 PRO 509 C 0.0037 -0.0140 0.0014 2875 PRO 509 O 0.0036 -0.0135 0.0008 2876 PRO 509 CB 0.0031 -0.0144 0.0005 2877 PRO 509 CG 0.0030 -0.0136 -0.0005 2878 PRO 509 CD 0.0035 -0.0125 -0.0001 2879 HIS 510 N 0.0037 -0.0148 0.0022 2880 HIS 510 CA 0.0038 -0.0150 0.0024 2881 HIS 510 C 0.0035 -0.0162 0.0028 2882 HIS 510 O 0.0034 -0.0168 0.0031 2883 HIS 510 CB 0.0044 -0.0143 0.0033 2884 HIS 510 CG 0.0048 -0.0143 0.0042 2885 HIS 510 CD2 0.0051 -0.0149 0.0052 2886 HIS 510 ND1 0.0050 -0.0137 0.0041 2887 HIS 510 CE1 0.0054 -0.0139 0.0050 2888 HIS 510 NE2 0.0054 -0.0146 0.0057 2889 HIS 511 N 0.0002 -0.0095 0.0045 2890 HIS 511 CA -0.0009 -0.0089 0.0047 2891 HIS 511 C -0.0005 -0.0089 0.0041 2892 HIS 511 O -0.0006 -0.0092 0.0049 2893 HIS 511 CB -0.0019 -0.0079 0.0040 2894 HIS 511 CG -0.0031 -0.0072 0.0041 2895 HIS 511 CD2 -0.0036 -0.0063 0.0031 2896 HIS 511 ND1 -0.0038 -0.0074 0.0053 2897 HIS 511 CE1 -0.0048 -0.0066 0.0051 2898 HIS 511 NE2 -0.0047 -0.0060 0.0038 2899 ILE 512 N 0.0001 -0.0085 0.0028 2900 ILE 512 CA 0.0006 -0.0085 0.0021 2901 ILE 512 C 0.0017 -0.0095 0.0027 2902 ILE 512 O 0.0026 -0.0101 0.0027 2903 ILE 512 CB 0.0009 -0.0079 0.0006 2904 ILE 512 CG1 0.0014 -0.0080 -0.0001 2905 ILE 512 CG2 0.0018 -0.0083 0.0001 2906 ILE 512 CD1 0.0014 -0.0072 -0.0015 2907 LEU 513 N 0.0017 -0.0098 0.0031 2908 LEU 513 CA 0.0027 -0.0107 0.0037 2909 LEU 513 C 0.0028 -0.0114 0.0049 2910 LEU 513 O 0.0039 -0.0122 0.0051 2911 LEU 513 CB 0.0040 -0.0110 0.0026 2912 LEU 513 CG 0.0041 -0.0104 0.0014 2913 LEU 513 CD1 0.0055 -0.0109 0.0006 2914 LEU 513 CD2 0.0035 -0.0103 0.0019 2915 ALA 514 N 0.0013 -0.0129 0.0062 2916 ALA 514 CA 0.0015 -0.0134 0.0074 2917 ALA 514 C 0.0025 -0.0143 0.0087 2918 ALA 514 O 0.0036 -0.0149 0.0092 2919 ALA 514 CB -0.0001 -0.0129 0.0083 2920 ASP 515 N 0.0023 -0.0143 0.0092 2921 ASP 515 CA 0.0032 -0.0151 0.0105 2922 ASP 515 C 0.0049 -0.0157 0.0099 2923 ASP 515 O 0.0057 -0.0164 0.0109 2924 ASP 515 CB 0.0023 -0.0150 0.0114 2925 ASP 515 CG 0.0006 -0.0144 0.0122 2926 ASP 515 OD1 0.0004 -0.0146 0.0129 2927 ASP 515 OD2 -0.0005 -0.0139 0.0120 2928 VAL 516 N 0.0054 -0.0155 0.0083 2929 VAL 516 CA 0.0071 -0.0160 0.0076 2930 VAL 516 C 0.0081 -0.0165 0.0075 2931 VAL 516 O 0.0077 -0.0161 0.0068 2932 VAL 516 CB 0.0071 -0.0155 0.0058 2933 VAL 516 CG1 0.0088 -0.0161 0.0051 2934 VAL 516 CG2 0.0060 -0.0150 0.0058 2935 SER 517 N 0.0075 -0.0213 0.0063 2936 SER 517 CA 0.0062 -0.0197 0.0057 2937 SER 517 C 0.0072 -0.0182 0.0068 2938 SER 517 O 0.0082 -0.0190 0.0074 2939 SER 517 CB 0.0049 -0.0206 0.0044 2940 SER 517 OG 0.0037 -0.0217 0.0033 2941 LEU 518 N 0.0070 -0.0161 0.0072 2942 LEU 518 CA 0.0080 -0.0146 0.0083 2943 LEU 518 C 0.0071 -0.0138 0.0078 2944 LEU 518 O 0.0054 -0.0137 0.0065 2945 LEU 518 CB 0.0083 -0.0127 0.0090 2946 LEU 518 CG 0.0094 -0.0133 0.0097 2947 LEU 518 CD1 0.0096 -0.0113 0.0103 2948 LEU 518 CD2 0.0112 -0.0146 0.0108 2949 LYS 519 N 0.0081 -0.0132 0.0087 2950 LYS 519 CA 0.0073 -0.0123 0.0083 2951 LYS 519 C 0.0061 -0.0101 0.0079 2952 LYS 519 O 0.0064 -0.0089 0.0084 2953 LYS 519 CB 0.0088 -0.0119 0.0096 2954 LYS 519 CG 0.0102 -0.0139 0.0102 2955 LYS 519 CD 0.0098 -0.0150 0.0096 2956 LYS 519 CE 0.0109 -0.0173 0.0099 2957 LYS 519 NZ 0.0129 -0.0172 0.0115 2958 GLU 520 N -0.0046 0.0000 0.0049 2959 GLU 520 CA -0.0068 0.0041 0.0025 2960 GLU 520 C -0.0085 0.0105 0.0060 2961 GLU 520 O -0.0097 0.0135 0.0058 2962 GLU 520 CB -0.0086 0.0045 -0.0048 2963 GLU 520 CG -0.0110 0.0093 -0.0075 2964 GLU 520 CD -0.0130 0.0103 -0.0146 2965 GLU 520 OE1 -0.0121 0.0062 -0.0179 2966 GLU 520 OE2 -0.0154 0.0151 -0.0168 2967 THR 521 N -0.0087 0.0127 0.0093 2968 THR 521 CA -0.0105 0.0190 0.0124 2969 THR 521 C -0.0117 0.0215 0.0111 2970 THR 521 O -0.0109 0.0180 0.0088 2971 THR 521 CB -0.0089 0.0192 0.0198 2972 THR 521 CG2 -0.0078 0.0171 0.0211 2973 THR 521 OG1 -0.0067 0.0153 0.0228 2974 GLU 522 N -0.0138 0.0275 0.0126 2975 GLU 522 CA -0.0150 0.0303 0.0120 2976 GLU 522 C -0.0129 0.0279 0.0170 2977 GLU 522 O -0.0127 0.0265 0.0155 2978 GLU 522 CB -0.0176 0.0374 0.0128 2979 GLU 522 CG -0.0199 0.0402 0.0077 2980 GLU 522 CD -0.0205 0.0380 0.0008 2981 GLU 522 OE1 -0.0210 0.0385 -0.0007 2982 GLU 522 OE2 -0.0205 0.0359 -0.0031 2983 GLU 523 N -0.0128 0.0225 0.0211 2984 GLU 523 CA -0.0110 0.0193 0.0257 2985 GLU 523 C -0.0080 0.0140 0.0237 2986 GLU 523 O -0.0066 0.0116 0.0253 2987 GLU 523 CB -0.0112 0.0195 0.0307 2988 GLU 523 CG -0.0122 0.0212 0.0292 2989 GLU 523 CD -0.0154 0.0267 0.0289 2990 GLU 523 OE1 -0.0169 0.0292 0.0317 2991 GLU 523 OE2 -0.0163 0.0285 0.0259 2992 ASN 524 N -0.0069 0.0123 0.0202 2993 ASN 524 CA -0.0040 0.0073 0.0180 2994 ASN 524 C -0.0036 0.0068 0.0140 2995 ASN 524 O -0.0014 0.0029 0.0138 2996 ASN 524 CB -0.0030 0.0057 0.0151 2997 ASN 524 CG -0.0024 0.0045 0.0193 2998 ASN 524 ND2 -0.0023 0.0044 0.0173 2999 ASN 524 OD1 -0.0021 0.0037 0.0243 3000 LYS 525 N -0.0058 0.0107 0.0108 3001 LYS 525 CA -0.0056 0.0104 0.0070 3002 LYS 525 C -0.0055 0.0101 0.0104 3003 LYS 525 O -0.0037 0.0071 0.0092 3004 LYS 525 CB -0.0080 0.0148 0.0029 3005 LYS 525 CG -0.0073 0.0138 -0.0026 3006 LYS 525 CD -0.0045 0.0090 -0.0052 3007 LYS 525 CE -0.0041 0.0085 -0.0113 3008 LYS 525 NZ -0.0014 0.0039 -0.0138 3009 THR 526 N -0.0079 0.0095 0.0111 3010 THR 526 CA -0.0080 0.0081 0.0141 3011 THR 526 C -0.0062 0.0041 0.0162 3012 THR 526 O -0.0048 0.0017 0.0166 3013 THR 526 CB -0.0106 0.0107 0.0173 3014 THR 526 CG2 -0.0107 0.0091 0.0206 3015 THR 526 OG1 -0.0122 0.0143 0.0153 3016 LYS 527 N -0.0061 0.0033 0.0176 3017 LYS 527 CA -0.0045 -0.0005 0.0197 3018 LYS 527 C -0.0018 -0.0034 0.0168 3019 LYS 527 O -0.0002 -0.0065 0.0181 3020 LYS 527 CB -0.0051 -0.0004 0.0214 3021 LYS 527 CG -0.0048 -0.0031 0.0255 3022 LYS 527 CD -0.0055 -0.0027 0.0269 3023 LYS 527 CE -0.0081 0.0013 0.0271 3024 LYS 527 NZ -0.0087 0.0018 0.0281 3025 GLY 528 N -0.0011 -0.0023 0.0128 3026 GLY 528 CA 0.0015 -0.0049 0.0098 3027 GLY 528 C 0.0023 -0.0058 0.0090 3028 GLY 528 O 0.0043 -0.0091 0.0090 3029 PHE 529 N -0.0001 -0.0008 0.0082 3030 PHE 529 CA 0.0028 -0.0044 0.0088 3031 PHE 529 C 0.0015 -0.0093 0.0123 3032 PHE 529 O 0.0047 -0.0131 0.0129 3033 PHE 529 CB 0.0022 -0.0026 0.0081 3034 PHE 529 CG 0.0055 -0.0060 0.0084 3035 PHE 529 CD1 0.0104 -0.0056 0.0058 3036 PHE 529 CD2 0.0037 -0.0096 0.0113 3037 PHE 529 CE1 0.0135 -0.0087 0.0061 3038 PHE 529 CE2 0.0068 -0.0127 0.0116 3039 PHE 529 CZ 0.0117 -0.0122 0.0090 3040 ASP 734 N -0.0744 -0.0587 0.0409 3041 ASP 734 CA -0.0659 -0.0596 0.0356 3042 ASP 734 C -0.0539 -0.0554 0.0291 3043 ASP 734 O -0.0469 -0.0491 0.0259 3044 ASP 734 CB -0.0663 -0.0736 0.0337 3045 THR 735 N -0.0516 -0.0589 0.0272 3046 THR 735 CA -0.0405 -0.0550 0.0211 3047 THR 735 C -0.0395 -0.0405 0.0228 3048 THR 735 O -0.0312 -0.0332 0.0189 3049 THR 735 CB -0.0386 -0.0635 0.0187 3050 THR 735 CG2 -0.0390 -0.0779 0.0167 3051 THR 735 OG1 -0.0473 -0.0616 0.0242 3052 ASP 736 N -0.0480 -0.0361 0.0285 3053 ASP 736 CA -0.0477 -0.0223 0.0305 3054 ASP 736 C -0.0499 -0.0134 0.0331 3055 ASP 736 O -0.0463 -0.0017 0.0328 3056 ASP 736 CB -0.0564 -0.0204 0.0360 3057 ASP 736 CG -0.0534 -0.0269 0.0332 3058 ASP 736 OD1 -0.0432 -0.0289 0.0267 3059 ASP 736 OD2 -0.0612 -0.0300 0.0374 3060 SER 737 N -0.0448 -0.0160 0.0347 3061 SER 737 CA -0.0442 -0.0096 0.0361 3062 SER 737 C -0.0359 -0.0068 0.0304 3063 SER 737 O -0.0332 0.0015 0.0308 3064 SER 737 CB -0.0491 -0.0141 0.0387 3065 SER 737 OG -0.0567 -0.0124 0.0452 3066 GLU 738 N -0.0318 -0.0136 0.0251 3067 GLU 738 CA -0.0237 -0.0114 0.0193 3068 GLU 738 C -0.0194 -0.0049 0.0179 3069 GLU 738 O -0.0146 0.0020 0.0162 3070 GLU 738 CB -0.0204 -0.0204 0.0140 3071 GLU 738 CG -0.0193 -0.0237 0.0122 3072 GLU 738 CD -0.0133 -0.0171 0.0094 3073 GLU 738 OE1 -0.0150 -0.0098 0.0130 3074 GLU 738 OE2 -0.0068 -0.0191 0.0037 3075 GLU 739 N -0.0210 -0.0069 0.0185 3076 GLU 739 CA -0.0174 -0.0007 0.0176 3077 GLU 739 C -0.0197 0.0089 0.0223 3078 GLU 739 O -0.0150 0.0160 0.0207 3079 GLU 739 CB -0.0196 -0.0050 0.0180 3080 GLU 739 CG -0.0159 0.0009 0.0168 3081 GLU 739 CD -0.0080 -0.0011 0.0100 3082 GLU 739 OE1 -0.0042 -0.0042 0.0061 3083 GLU 739 OE2 -0.0055 0.0004 0.0085 3084 GLU 740 N -0.0244 0.0053 0.0235 3085 GLU 740 CA -0.0252 0.0108 0.0271 3086 GLU 740 C -0.0210 0.0134 0.0259 3087 GLU 740 O -0.0189 0.0187 0.0274 3088 GLU 740 CB -0.0311 0.0099 0.0303 3089 GLU 740 CG -0.0355 0.0098 0.0330 3090 GLU 740 CD -0.0411 0.0058 0.0343 3091 GLU 740 OE1 -0.0420 0.0044 0.0341 3092 GLU 740 OE2 -0.0446 0.0042 0.0356 3093 ILE 741 N -0.0197 0.0098 0.0231 3094 ILE 741 CA -0.0156 0.0120 0.0217 3095 ILE 741 C -0.0099 0.0144 0.0194 3096 ILE 741 O -0.0067 0.0189 0.0199 3097 ILE 741 CB -0.0157 0.0073 0.0191 3098 ILE 741 CG1 -0.0211 0.0058 0.0218 3099 ILE 741 CG2 -0.0108 0.0091 0.0171 3100 ILE 741 CD1 -0.0225 0.0109 0.0254 3101 ARG 742 N -0.0084 0.0115 0.0169 3102 ARG 742 CA -0.0031 0.0138 0.0148 3103 ARG 742 C -0.0030 0.0194 0.0179 3104 ARG 742 O 0.0013 0.0234 0.0174 3105 ARG 742 CB -0.0021 0.0093 0.0118 3106 ARG 742 CG -0.0007 0.0041 0.0081 3107 ARG 742 CD 0.0011 0.0003 0.0048 3108 ARG 742 NE -0.0033 -0.0025 0.0061 3109 ARG 742 CZ -0.0066 -0.0077 0.0052 3110 ARG 742 NH1 -0.0060 -0.0109 0.0031 3111 ARG 742 NH2 -0.0106 -0.0098 0.0066 3112 GLU 743 N -0.0097 0.0159 0.0148 3113 GLU 743 CA -0.0097 0.0168 0.0162 3114 GLU 743 C -0.0087 0.0163 0.0163 3115 GLU 743 O -0.0078 0.0166 0.0176 3116 GLU 743 CB -0.0114 0.0177 0.0162 3117 GLU 743 CG -0.0124 0.0184 0.0166 3118 GLU 743 CD -0.0141 0.0192 0.0164 3119 GLU 743 OE1 -0.0144 0.0197 0.0169 3120 GLU 743 OE2 -0.0152 0.0194 0.0157 3121 ALA 744 N -0.0088 0.0156 0.0151 3122 ALA 744 CA -0.0079 0.0151 0.0151 3123 ALA 744 C -0.0061 0.0143 0.0154 3124 ALA 744 O -0.0051 0.0143 0.0162 3125 ALA 744 CB -0.0084 0.0143 0.0135 3126 PHE 745 N -0.0056 0.0138 0.0149 3127 PHE 745 CA -0.0040 0.0131 0.0153 3128 PHE 745 C -0.0033 0.0139 0.0170 3129 PHE 745 O -0.0020 0.0136 0.0177 3130 PHE 745 CB -0.0037 0.0124 0.0144 3131 PHE 745 CG -0.0020 0.0116 0.0146 3132 PHE 745 CD1 -0.0011 0.0106 0.0139 3133 PHE 745 CD2 -0.0013 0.0118 0.0155 3134 PHE 745 CE1 0.0005 0.0099 0.0140 3135 PHE 745 CE2 0.0002 0.0111 0.0156 3136 PHE 745 CZ 0.0012 0.0101 0.0149 3137 ARG 746 N -0.0007 0.0098 0.0116 3138 ARG 746 CA -0.0002 0.0104 0.0116 3139 ARG 746 C -0.0008 0.0106 0.0104 3140 ARG 746 O -0.0007 0.0108 0.0104 3141 ARG 746 CB 0.0008 0.0116 0.0119 3142 ARG 746 CG 0.0016 0.0114 0.0131 3143 ARG 746 CD 0.0027 0.0126 0.0134 3144 ARG 746 NE 0.0031 0.0128 0.0138 3145 ARG 746 CZ 0.0034 0.0137 0.0132 3146 ARG 746 NH1 0.0033 0.0145 0.0121 3147 ARG 746 NH2 0.0038 0.0139 0.0136 3148 VAL 747 N -0.0015 0.0106 0.0094 3149 VAL 747 CA -0.0022 0.0107 0.0082 3150 VAL 747 C -0.0029 0.0097 0.0084 3151 VAL 747 O -0.0030 0.0098 0.0080 3152 VAL 747 CB -0.0028 0.0108 0.0072 3153 VAL 747 CG1 -0.0035 0.0108 0.0060 3154 VAL 747 CG2 -0.0020 0.0119 0.0069 3155 PHE 748 N -0.0033 0.0086 0.0091 3156 PHE 748 CA -0.0040 0.0076 0.0093 3157 PHE 748 C -0.0036 0.0072 0.0105 3158 PHE 748 O -0.0040 0.0067 0.0105 3159 PHE 748 CB -0.0049 0.0066 0.0092 3160 PHE 748 CG -0.0053 0.0070 0.0081 3161 PHE 748 CD1 -0.0060 0.0070 0.0069 3162 PHE 748 CD2 -0.0050 0.0073 0.0081 3163 PHE 748 CE1 -0.0064 0.0073 0.0058 3164 PHE 748 CE2 -0.0054 0.0076 0.0071 3165 PHE 748 CZ -0.0061 0.0076 0.0059 3166 ASP 749 N -0.0007 0.0036 0.0145 3167 ASP 749 CA -0.0009 0.0038 0.0138 3168 ASP 749 C -0.0005 0.0036 0.0123 3169 ASP 749 O 0.0005 0.0029 0.0119 3170 ASP 749 CB -0.0002 0.0033 0.0146 3171 ASP 749 CG -0.0004 0.0034 0.0140 3172 ASP 749 OD1 -0.0012 0.0040 0.0132 3173 ASP 749 OD2 0.0003 0.0030 0.0143 3174 LYS 750 N -0.0013 0.0041 0.0114 3175 LYS 750 CA -0.0010 0.0040 0.0100 3176 LYS 750 C -0.0006 0.0038 0.0091 3177 LYS 750 O 0.0003 0.0032 0.0083 3178 LYS 750 CB -0.0020 0.0047 0.0094 3179 LYS 750 CG -0.0016 0.0045 0.0083 3180 LYS 750 CD -0.0009 0.0040 0.0089 3181 LYS 750 CE 0.0004 0.0031 0.0084 3182 LYS 750 NZ 0.0012 0.0026 0.0093 3183 ASP 751 N -0.0011 0.0041 0.0093 3184 ASP 751 CA -0.0008 0.0040 0.0084 3185 ASP 751 C 0.0001 0.0033 0.0091 3186 ASP 751 O 0.0004 0.0031 0.0085 3187 ASP 751 CB -0.0019 0.0047 0.0081 3188 ASP 751 CG -0.0024 0.0050 0.0093 3189 ASP 751 OD1 -0.0022 0.0048 0.0105 3190 ASP 751 OD2 -0.0029 0.0053 0.0090 3191 GLY 752 N 0.0021 0.0042 0.0082 3192 GLY 752 CA 0.0035 0.0044 0.0097 3193 GLY 752 C 0.0029 0.0044 0.0113 3194 GLY 752 O 0.0041 0.0045 0.0122 3195 ASN 753 N 0.0010 0.0042 0.0118 3196 ASN 753 CA 0.0003 0.0042 0.0135 3197 ASN 753 C 0.0004 0.0043 0.0153 3198 ASN 753 O 0.0000 0.0043 0.0169 3199 ASN 753 CB -0.0017 0.0040 0.0131 3200 ASN 753 CG -0.0032 0.0038 0.0135 3201 ASN 753 ND2 -0.0048 0.0037 0.0144 3202 ASN 753 OD1 -0.0029 0.0038 0.0129 3203 GLY 754 N 0.0009 0.0043 0.0152 3204 GLY 754 CA 0.0011 0.0044 0.0169 3205 GLY 754 C -0.0006 0.0042 0.0172 3206 GLY 754 O -0.0006 0.0043 0.0187 3207 TYR 755 N -0.0023 0.0039 0.0202 3208 TYR 755 CA -0.0031 0.0025 0.0194 3209 TYR 755 C -0.0032 0.0017 0.0175 3210 TYR 755 O -0.0033 0.0013 0.0173 3211 TYR 755 CB -0.0043 0.0012 0.0209 3212 TYR 755 CG -0.0044 0.0019 0.0229 3213 TYR 755 CD1 -0.0045 0.0019 0.0232 3214 TYR 755 CD2 -0.0043 0.0026 0.0243 3215 TYR 755 CE1 -0.0046 0.0025 0.0250 3216 TYR 755 CE2 -0.0044 0.0032 0.0262 3217 TYR 755 CZ -0.0045 0.0032 0.0265 3218 TYR 755 OH -0.0045 0.0038 0.0283 3219 ILE 756 N -0.0030 0.0014 0.0161 3220 ILE 756 CA -0.0031 0.0005 0.0142 3221 ILE 756 C -0.0044 -0.0014 0.0142 3222 ILE 756 O -0.0048 -0.0019 0.0144 3223 ILE 756 CB -0.0023 0.0011 0.0126 3224 ILE 756 CG1 -0.0010 0.0030 0.0126 3225 ILE 756 CG2 -0.0024 0.0002 0.0106 3226 ILE 756 CD1 -0.0002 0.0037 0.0113 3227 SER 757 N -0.0050 -0.0023 0.0141 3228 SER 757 CA -0.0062 -0.0041 0.0141 3229 SER 757 C -0.0063 -0.0050 0.0120 3230 SER 757 O -0.0054 -0.0042 0.0106 3231 SER 757 CB -0.0069 -0.0047 0.0151 3232 SER 757 OG -0.0066 -0.0047 0.0140 3233 ALA 758 N -0.0053 -0.0073 0.0111 3234 ALA 758 CA -0.0056 -0.0079 0.0098 3235 ALA 758 C -0.0055 -0.0076 0.0093 3236 ALA 758 O -0.0054 -0.0074 0.0081 3237 ALA 758 CB -0.0063 -0.0093 0.0099 3238 ALA 759 N -0.0055 -0.0077 0.0103 3239 ALA 759 CA -0.0054 -0.0074 0.0099 3240 ALA 759 C -0.0048 -0.0061 0.0095 3241 ALA 759 O -0.0047 -0.0058 0.0084 3242 ALA 759 CB -0.0055 -0.0077 0.0112 3243 GLU 760 N -0.0044 -0.0052 0.0102 3244 GLU 760 CA -0.0038 -0.0039 0.0098 3245 GLU 760 C -0.0037 -0.0036 0.0083 3246 GLU 760 O -0.0034 -0.0029 0.0075 3247 GLU 760 CB -0.0034 -0.0030 0.0108 3248 GLU 760 CG -0.0033 -0.0030 0.0122 3249 GLU 760 CD -0.0029 -0.0022 0.0133 3250 GLU 760 OE1 -0.0030 -0.0023 0.0133 3251 GLU 760 OE2 -0.0026 -0.0015 0.0140 3252 LEU 761 N -0.0026 -0.0048 0.0101 3253 LEU 761 CA -0.0021 -0.0046 0.0087 3254 LEU 761 C -0.0019 -0.0056 0.0079 3255 LEU 761 O -0.0016 -0.0053 0.0070 3256 LEU 761 CB -0.0020 -0.0048 0.0083 3257 LEU 761 CG -0.0014 -0.0044 0.0069 3258 LEU 761 CD1 -0.0012 -0.0029 0.0067 3259 LEU 761 CD2 -0.0013 -0.0046 0.0065 3260 ARG 762 N -0.0022 -0.0069 0.0084 3261 ARG 762 CA -0.0021 -0.0079 0.0078 3262 ARG 762 C -0.0021 -0.0074 0.0078 3263 ARG 762 O -0.0018 -0.0075 0.0069 3264 ARG 762 CB -0.0025 -0.0093 0.0084 3265 ARG 762 CG -0.0025 -0.0104 0.0080 3266 ARG 762 CD -0.0021 -0.0111 0.0067 3267 ARG 762 NE -0.0017 -0.0103 0.0056 3268 ARG 762 CZ -0.0012 -0.0104 0.0044 3269 ARG 762 NH1 -0.0012 -0.0114 0.0040 3270 ARG 762 NH2 -0.0008 -0.0097 0.0035 3271 HIS 763 N -0.0025 -0.0069 0.0090 3272 HIS 763 CA -0.0025 -0.0064 0.0092 3273 HIS 763 C -0.0020 -0.0052 0.0083 3274 HIS 763 O -0.0018 -0.0052 0.0077 3275 HIS 763 CB -0.0030 -0.0060 0.0106 3276 HIS 763 CG -0.0030 -0.0053 0.0109 3277 HIS 763 CD2 -0.0028 -0.0039 0.0109 3278 HIS 763 ND1 -0.0031 -0.0059 0.0112 3279 HIS 763 CE1 -0.0031 -0.0050 0.0114 3280 HIS 763 NE2 -0.0029 -0.0038 0.0112 3281 VAL 764 N -0.0034 -0.0042 0.0100 3282 VAL 764 CA -0.0037 -0.0027 0.0090 3283 VAL 764 C -0.0028 -0.0032 0.0074 3284 VAL 764 O -0.0029 -0.0026 0.0070 3285 VAL 764 CB -0.0042 -0.0012 0.0084 3286 VAL 764 CG1 -0.0043 0.0003 0.0071 3287 VAL 764 CG2 -0.0052 -0.0004 0.0100 3288 MET 765 N -0.0019 -0.0042 0.0065 3289 MET 765 CA -0.0010 -0.0048 0.0050 3290 MET 765 C -0.0007 -0.0059 0.0056 3291 MET 765 O -0.0005 -0.0057 0.0047 3292 MET 765 CB -0.0001 -0.0059 0.0040 3293 MET 765 CG -0.0001 -0.0048 0.0029 3294 MET 765 SD -0.0005 -0.0027 0.0017 3295 MET 765 CE -0.0004 -0.0019 0.0005 3296 THR 766 N -0.0008 -0.0071 0.0070 3297 THR 766 CA -0.0006 -0.0082 0.0077 3298 THR 766 C -0.0014 -0.0070 0.0083 3299 THR 766 O -0.0011 -0.0073 0.0080 3300 THR 766 CB -0.0006 -0.0096 0.0092 3301 THR 766 CG2 -0.0004 -0.0107 0.0099 3302 THR 766 OG1 0.0003 -0.0108 0.0085 3303 ASN 767 N -0.0040 -0.0050 0.0105 3304 ASN 767 CA -0.0047 -0.0040 0.0111 3305 ASN 767 C -0.0044 -0.0028 0.0095 3306 ASN 767 O -0.0044 -0.0025 0.0095 3307 ASN 767 CB -0.0057 -0.0028 0.0125 3308 ASN 767 CG -0.0065 -0.0018 0.0133 3309 ASN 767 ND2 -0.0072 -0.0001 0.0136 3310 ASN 767 OD1 -0.0064 -0.0026 0.0136 3311 LEU 768 N -0.0040 -0.0021 0.0082 3312 LEU 768 CA -0.0037 -0.0009 0.0067 3313 LEU 768 C -0.0026 -0.0019 0.0053 3314 LEU 768 O -0.0023 -0.0010 0.0040 3315 LEU 768 CB -0.0037 0.0004 0.0058 3316 LEU 768 CG -0.0048 0.0018 0.0070 3317 LEU 768 CD1 -0.0047 0.0030 0.0061 3318 LEU 768 CD2 -0.0054 0.0031 0.0074 3319 GLY 769 N -0.0021 -0.0037 0.0056 3320 GLY 769 CA -0.0011 -0.0047 0.0043 3321 GLY 769 C -0.0003 -0.0048 0.0027 3322 GLY 769 O 0.0005 -0.0055 0.0015 3323 GLU 770 N 0.0012 -0.0067 -0.0005 3324 GLU 770 CA 0.0021 -0.0069 -0.0020 3325 GLU 770 C 0.0027 -0.0093 -0.0019 3326 GLU 770 O 0.0020 -0.0105 -0.0002 3327 GLU 770 CB 0.0016 -0.0054 -0.0017 3328 GLU 770 CG 0.0009 -0.0029 -0.0016 3329 GLU 770 CD 0.0018 -0.0017 -0.0037 3330 GLU 770 OE1 0.0021 -0.0008 -0.0046 3331 GLU 770 OE2 0.0022 -0.0015 -0.0044 3332 LYS 771 N 0.0038 -0.0100 -0.0036 3333 LYS 771 CA 0.0045 -0.0124 -0.0037 3334 LYS 771 C 0.0047 -0.0125 -0.0041 3335 LYS 771 O 0.0056 -0.0124 -0.0058 3336 LYS 771 CB 0.0056 -0.0133 -0.0053 3337 LYS 771 CG 0.0054 -0.0136 -0.0048 3338 LYS 771 CD 0.0050 -0.0156 -0.0033 3339 LYS 771 CE 0.0037 -0.0150 -0.0013 3340 LYS 771 NZ 0.0034 -0.0170 0.0003 3341 LEU 772 N 0.0038 -0.0127 -0.0025 3342 LEU 772 CA 0.0039 -0.0129 -0.0026 3343 LEU 772 C 0.0037 -0.0149 -0.0012 3344 LEU 772 O 0.0028 -0.0153 0.0005 3345 LEU 772 CB 0.0031 -0.0108 -0.0020 3346 LEU 772 CG 0.0031 -0.0086 -0.0030 3347 LEU 772 CD1 0.0021 -0.0066 -0.0021 3348 LEU 772 CD2 0.0043 -0.0082 -0.0053 3349 THR 773 N -0.0007 -0.0138 -0.0029 3350 THR 773 CA 0.0000 -0.0160 -0.0012 3351 THR 773 C 0.0003 -0.0162 0.0009 3352 THR 773 O 0.0000 -0.0151 0.0006 3353 THR 773 CB 0.0004 -0.0185 -0.0027 3354 THR 773 CG2 0.0004 -0.0193 -0.0041 3355 THR 773 OG1 0.0011 -0.0205 -0.0009 3356 ASP 774 N 0.0009 -0.0176 0.0030 3357 ASP 774 CA 0.0013 -0.0179 0.0050 3358 ASP 774 C 0.0014 -0.0192 0.0040 3359 ASP 774 O 0.0014 -0.0185 0.0048 3360 ASP 774 CB 0.0019 -0.0195 0.0073 3361 ASP 774 CG 0.0018 -0.0182 0.0087 3362 ASP 774 OD1 0.0013 -0.0164 0.0075 3363 ASP 774 OD2 0.0023 -0.0189 0.0109 3364 GLU 775 N 0.0016 -0.0210 0.0020 3365 GLU 775 CA 0.0017 -0.0222 0.0008 3366 GLU 775 C 0.0011 -0.0202 -0.0006 3367 GLU 775 O 0.0011 -0.0202 -0.0004 3368 GLU 775 CB 0.0020 -0.0244 -0.0011 3369 GLU 776 N 0.0012 -0.0177 -0.0016 3370 GLU 776 CA 0.0017 -0.0155 -0.0023 3371 GLU 776 C 0.0012 -0.0138 -0.0006 3372 GLU 776 O 0.0013 -0.0122 -0.0005 3373 GLU 776 CB 0.0025 -0.0151 -0.0041 3374 GLU 776 CG 0.0032 -0.0162 -0.0061 3375 GLU 776 CD 0.0039 -0.0159 -0.0078 3376 GLU 776 OE1 0.0045 -0.0142 -0.0088 3377 GLU 776 OE2 0.0039 -0.0173 -0.0080 3378 VAL 777 N 0.0006 -0.0140 0.0008 3379 VAL 777 CA 0.0000 -0.0125 0.0025 3380 VAL 777 C -0.0006 -0.0125 0.0039 3381 VAL 777 O -0.0007 -0.0108 0.0046 3382 VAL 777 CB -0.0005 -0.0129 0.0036 3383 VAL 777 CG1 -0.0012 -0.0116 0.0056 3384 VAL 777 CG2 0.0001 -0.0124 0.0022 3385 ASP 778 N -0.0010 -0.0145 0.0045 3386 ASP 778 CA -0.0015 -0.0147 0.0058 3387 ASP 778 C -0.0010 -0.0138 0.0048 3388 ASP 778 O -0.0014 -0.0127 0.0058 3389 ASP 778 CB -0.0020 -0.0171 0.0064 3390 ASP 778 CG -0.0026 -0.0179 0.0078 3391 ASP 778 OD1 -0.0025 -0.0171 0.0077 3392 ASP 778 OD2 -0.0033 -0.0193 0.0091 3393 GLU 779 N -0.0007 -0.0200 0.0012 3394 GLU 779 CA -0.0002 -0.0191 -0.0004 3395 GLU 779 C -0.0001 -0.0157 -0.0006 3396 GLU 779 O -0.0001 -0.0145 -0.0006 3397 GLU 779 CB 0.0006 -0.0205 -0.0035 3398 GLU 779 CG 0.0011 -0.0198 -0.0054 3399 GLU 779 CD 0.0006 -0.0202 -0.0038 3400 GLU 779 OE1 0.0003 -0.0227 -0.0027 3401 GLU 779 OE2 0.0007 -0.0180 -0.0037 3402 MET 780 N -0.0001 -0.0140 -0.0006 3403 MET 780 CA -0.0001 -0.0107 -0.0005 3404 MET 780 C -0.0008 -0.0097 0.0024 3405 MET 780 O -0.0008 -0.0079 0.0024 3406 MET 780 CB 0.0000 -0.0093 -0.0008 3407 MET 780 CG 0.0008 -0.0095 -0.0038 3408 MET 780 SD 0.0009 -0.0082 -0.0039 3409 MET 780 CE 0.0009 -0.0042 -0.0037 3410 ILE 781 N -0.0015 -0.0110 0.0048 3411 ILE 781 CA -0.0022 -0.0102 0.0076 3412 ILE 781 C -0.0022 -0.0109 0.0076 3413 ILE 781 O -0.0024 -0.0091 0.0085 3414 ILE 781 CB -0.0029 -0.0118 0.0102 3415 ILE 781 CG1 -0.0029 -0.0110 0.0103 3416 ILE 781 CG2 -0.0036 -0.0109 0.0131 3417 ILE 781 CD1 -0.0031 -0.0078 0.0115 3418 ARG 782 N -0.0020 -0.0160 0.0078 3419 ARG 782 CA -0.0022 -0.0169 0.0081 3420 ARG 782 C -0.0012 -0.0141 0.0062 3421 ARG 782 O -0.0015 -0.0128 0.0076 3422 ARG 782 CB -0.0022 -0.0208 0.0065 3423 ARG 782 CG -0.0028 -0.0224 0.0077 3424 ARG 782 CD -0.0022 -0.0252 0.0048 3425 ARG 782 NE -0.0008 -0.0232 0.0015 3426 ARG 782 CZ -0.0003 -0.0208 0.0009 3427 ARG 782 NH1 -0.0010 -0.0202 0.0033 3428 ARG 782 NH2 0.0010 -0.0190 -0.0022 3429 GLU 783 N 0.0000 -0.0131 0.0029 3430 GLU 783 CA 0.0011 -0.0105 0.0008 3431 GLU 783 C 0.0009 -0.0067 0.0028 3432 GLU 783 O 0.0011 -0.0050 0.0031 3433 GLU 783 CB 0.0024 -0.0101 -0.0029 3434 GLU 783 CG 0.0035 -0.0069 -0.0051 3435 GLU 783 CD 0.0048 -0.0069 -0.0089 3436 GLU 783 OE1 0.0052 -0.0094 -0.0111 3437 GLU 783 OE2 0.0054 -0.0046 -0.0096 3438 ALA 784 N 0.0006 -0.0052 0.0043 3439 ALA 784 CA 0.0005 -0.0015 0.0062 3440 ALA 784 C -0.0008 -0.0017 0.0100 3441 ALA 784 O -0.0010 0.0013 0.0118 3442 ALA 784 CB 0.0007 0.0005 0.0063 3443 ASP 785 N -0.0032 -0.0048 0.0089 3444 ASP 785 CA -0.0046 -0.0053 0.0131 3445 ASP 785 C -0.0050 -0.0056 0.0143 3446 ASP 785 O -0.0061 -0.0087 0.0140 3447 ASP 785 CB -0.0062 -0.0089 0.0142 3448 ASP 785 CG -0.0076 -0.0090 0.0186 3449 ASP 785 OD1 -0.0071 -0.0061 0.0209 3450 ASP 785 OD2 -0.0090 -0.0121 0.0199 3451 ILE 786 N -0.0042 -0.0022 0.0157 3452 ILE 786 CA -0.0044 -0.0019 0.0168 3453 ILE 786 C -0.0061 -0.0033 0.0209 3454 ILE 786 O -0.0071 -0.0053 0.0217 3455 ILE 786 CB -0.0028 0.0023 0.0167 3456 ILE 786 CG1 -0.0012 0.0033 0.0124 3457 ILE 786 CG2 -0.0031 0.0028 0.0184 3458 ILE 786 CD1 0.0005 0.0075 0.0119 3459 ASP 787 N -0.0065 -0.0023 0.0237 3460 ASP 787 CA -0.0080 -0.0033 0.0277 3461 ASP 787 C -0.0097 -0.0076 0.0281 3462 ASP 787 O -0.0111 -0.0093 0.0306 3463 ASP 787 CB -0.0079 -0.0008 0.0304 3464 ASP 787 CG -0.0083 -0.0023 0.0301 3465 ASP 787 OD1 -0.0099 -0.0050 0.0321 3466 ASP 787 OD2 -0.0071 -0.0007 0.0279 3467 GLY 788 N -0.0095 -0.0106 0.0254 3468 GLY 788 CA -0.0114 -0.0134 0.0250 3469 GLY 788 C -0.0121 -0.0140 0.0262 3470 GLY 788 O -0.0140 -0.0162 0.0272 3471 ASP 789 N -0.0108 -0.0121 0.0262 3472 ASP 789 CA -0.0113 -0.0125 0.0272 3473 ASP 789 C -0.0115 -0.0137 0.0245 3474 ASP 789 O -0.0119 -0.0141 0.0250 3475 ASP 789 CB -0.0098 -0.0099 0.0289 3476 ASP 789 CG -0.0077 -0.0078 0.0266 3477 ASP 789 OD1 -0.0072 -0.0080 0.0243 3478 ASP 789 OD2 -0.0066 -0.0061 0.0272 3479 GLY 790 N -0.0113 -0.0143 0.0216 3480 GLY 790 CA -0.0113 -0.0153 0.0188 3481 GLY 790 C -0.0094 -0.0131 0.0172 3482 GLY 790 O -0.0093 -0.0138 0.0149 3483 GLN 791 N -0.0081 -0.0058 0.0184 3484 GLN 791 CA -0.0070 -0.0043 0.0176 3485 GLN 791 C -0.0057 -0.0024 0.0173 3486 GLN 791 O -0.0058 -0.0021 0.0179 3487 GLN 791 CB -0.0073 -0.0036 0.0193 3488 GLN 791 CG -0.0081 -0.0052 0.0191 3489 GLN 791 CD -0.0085 -0.0046 0.0209 3490 GLN 791 NE2 -0.0089 -0.0056 0.0205 3491 GLN 791 OE1 -0.0084 -0.0033 0.0226 3492 VAL 792 N -0.0045 -0.0011 0.0162 3493 VAL 792 CA -0.0032 0.0008 0.0157 3494 VAL 792 C -0.0026 0.0027 0.0170 3495 VAL 792 O -0.0022 0.0030 0.0166 3496 VAL 792 CB -0.0021 0.0008 0.0131 3497 VAL 792 CG1 -0.0008 0.0028 0.0127 3498 VAL 792 CG2 -0.0027 -0.0011 0.0119 3499 ASN 793 N -0.0025 0.0040 0.0186 3500 ASN 793 CA -0.0019 0.0059 0.0198 3501 ASN 793 C -0.0003 0.0077 0.0185 3502 ASN 793 O 0.0003 0.0074 0.0166 3503 ASN 793 CB -0.0025 0.0065 0.0222 3504 ASN 793 CG -0.0025 0.0065 0.0222 3505 ASN 793 ND2 -0.0038 0.0050 0.0231 3506 ASN 793 OD1 -0.0014 0.0077 0.0213 3507 TYR 794 N -0.0046 0.0102 0.0162 3508 TYR 794 CA -0.0035 0.0111 0.0156 3509 TYR 794 C -0.0026 0.0125 0.0150 3510 TYR 794 O -0.0013 0.0128 0.0142 3511 TYR 794 CB -0.0043 0.0120 0.0162 3512 TYR 794 CG -0.0033 0.0132 0.0156 3513 TYR 794 CD1 -0.0023 0.0126 0.0148 3514 TYR 794 CD2 -0.0034 0.0150 0.0158 3515 TYR 794 CE1 -0.0014 0.0136 0.0143 3516 TYR 794 CE2 -0.0025 0.0161 0.0153 3517 TYR 794 CZ -0.0015 0.0154 0.0145 3518 TYR 794 OH -0.0006 0.0165 0.0140 3519 GLU 795 N -0.0032 0.0133 0.0156 3520 GLU 795 CA -0.0024 0.0146 0.0151 3521 GLU 795 C -0.0012 0.0137 0.0142 3522 GLU 795 O 0.0001 0.0144 0.0134 3523 GLU 795 CB -0.0034 0.0154 0.0159 3524 GLU 795 CG -0.0045 0.0166 0.0167 3525 GLU 795 CD -0.0057 0.0156 0.0175 3526 GLU 795 OE1 -0.0059 0.0140 0.0175 3527 GLU 795 OE2 -0.0065 0.0165 0.0181 3528 GLU 796 N -0.0015 0.0122 0.0143 3529 GLU 796 CA -0.0004 0.0113 0.0134 3530 GLU 796 C 0.0007 0.0106 0.0126 3531 GLU 796 O 0.0020 0.0106 0.0117 3532 GLU 796 CB -0.0011 0.0098 0.0138 3533 GLU 796 CG -0.0020 0.0105 0.0145 3534 GLU 796 CD -0.0031 0.0091 0.0151 3535 GLU 796 OE1 -0.0031 0.0076 0.0150 3536 GLU 796 OE2 -0.0039 0.0094 0.0157 3537 PHE 797 N -0.0020 0.0133 0.0132 3538 PHE 797 CA -0.0013 0.0131 0.0124 3539 PHE 797 C -0.0008 0.0154 0.0108 3540 PHE 797 O 0.0005 0.0151 0.0092 3541 PHE 797 CB -0.0026 0.0127 0.0142 3542 PHE 797 CG -0.0020 0.0122 0.0136 3543 PHE 797 CD1 -0.0009 0.0099 0.0133 3544 PHE 797 CD2 -0.0025 0.0140 0.0134 3545 PHE 797 CE1 -0.0003 0.0094 0.0127 3546 PHE 797 CE2 -0.0019 0.0135 0.0129 3547 PHE 797 CZ -0.0008 0.0112 0.0125 3548 VAL 798 N -0.0019 0.0175 0.0111 3549 VAL 798 CA -0.0014 0.0198 0.0096 3550 VAL 798 C 0.0001 0.0197 0.0077 3551 VAL 798 O 0.0013 0.0204 0.0060 3552 VAL 798 CB -0.0029 0.0221 0.0104 3553 VAL 798 CG1 -0.0024 0.0244 0.0087 3554 VAL 798 CG2 -0.0044 0.0223 0.0120 3555 GLN 799 N 0.0002 0.0190 0.0079 3556 GLN 799 CA 0.0017 0.0188 0.0062 3557 GLN 799 C 0.0033 0.0172 0.0049 3558 GLN 799 O 0.0046 0.0177 0.0031 3559 GLN 799 CB 0.0014 0.0178 0.0069 3560 GLN 799 CG -0.0002 0.0192 0.0083 3561 GLN 799 CD -0.0004 0.0219 0.0074 3562 GLN 799 NE2 0.0008 0.0225 0.0056 3563 GLN 799 OE1 -0.0017 0.0235 0.0083 3564 MET 800 N 0.0015 0.0167 0.0029 3565 MET 800 CA 0.0038 0.0140 0.0011 3566 MET 800 C 0.0047 0.0156 -0.0005 3567 MET 800 O 0.0071 0.0151 -0.0032 3568 MET 800 CB 0.0033 0.0101 0.0033 3569 MET 800 CG 0.0056 0.0071 0.0017 3570 MET 800 SD 0.0054 0.0069 0.0020 3571 MET 800 CE 0.0021 0.0063 0.0062 3572 MET 801 N 0.0028 0.0175 0.0011 3573 MET 801 CA 0.0035 0.0189 -0.0003 3574 MET 801 C 0.0045 0.0225 -0.0029 3575 MET 801 O 0.0064 0.0228 -0.0054 3576 MET 801 CB 0.0011 0.0198 0.0022 3577 MET 801 CG 0.0003 0.0162 0.0045 3578 MET 801 SD 0.0027 0.0131 0.0028 3579 MET 801 CE 0.0024 0.0160 0.0021 3580 THR 802 N 0.0031 0.0252 -0.0023 3581 THR 802 CA 0.0039 0.0287 -0.0046 3582 THR 802 C 0.0058 0.0279 -0.0065 3583 THR 802 O 0.0051 0.0292 -0.0062 3584 THR 802 CB 0.0014 0.0321 -0.0030 3585 THR 802 CG2 -0.0006 0.0324 -0.0007 3586 THR 802 OG1 0.0003 0.0315 -0.0014 3587 ALA 803 N 0.0094 0.0326 -0.0127 3588 ALA 803 CA 0.0152 0.0317 -0.0167 3589 ALA 803 C 0.0233 0.0346 -0.0236 3590 ALA 803 O 0.0252 0.0350 -0.0251 3591 ALA 803 CB 0.0169 0.0212 -0.0145 3592 LYS 804 N 0.0282 0.0364 -0.0278 3593 LYS 804 CA 0.0361 0.0396 -0.0347 3594 LYS 804 C 0.0422 0.0319 -0.0366 3595 LYS 804 O 0.0464 0.0343 -0.0405 3596 LYS 804 CB 0.0400 0.0417 -0.0382 3597 LYS 804 CG 0.0339 0.0473 -0.0355 3598 LYS 804 CD 0.0286 0.0564 -0.0346 3599 LYS 804 CE 0.0194 0.0565 -0.0279 3600 LYS 804 NZ 0.0146 0.0545 -0.0236 3601 LYS 804 OXT 0.0431 0.0231 -0.0344