1 ASP 28 N 0.0028 -0.0027 -0.0003 2 ASP 28 CA 0.0023 -0.0021 0.0013 3 ASP 28 C 0.0022 -0.0034 0.0026 4 ASP 28 O 0.0023 -0.0042 0.0025 5 ASP 28 CB 0.0020 -0.0005 0.0016 6 ASP 28 CG 0.0015 0.0002 0.0032 7 ASP 28 OD1 0.0013 0.0008 0.0035 8 ASP 28 OD2 0.0012 0.0002 0.0042 9 ASP 28 H 0.0030 -0.0018 -0.0012 10 ASP 28 HA 0.0023 -0.0018 0.0014 11 ASP 28 HB2 0.0022 0.0004 0.0007 12 ASP 28 HB3 0.0021 -0.0008 0.0015 13 PRO 29 N 0.0019 -0.0039 0.0038 14 PRO 29 CA 0.0018 -0.0051 0.0051 15 PRO 29 C 0.0014 -0.0047 0.0061 16 PRO 29 O 0.0010 -0.0033 0.0066 17 PRO 29 CB 0.0015 -0.0052 0.0061 18 PRO 29 CG 0.0016 -0.0043 0.0051 19 PRO 29 CD 0.0018 -0.0031 0.0040 20 PRO 29 HA 0.0021 -0.0063 0.0046 21 PRO 29 HB2 0.0010 -0.0045 0.0072 22 PRO 29 HB3 0.0016 -0.0064 0.0064 23 PRO 29 HG2 0.0013 -0.0037 0.0059 24 PRO 29 HG3 0.0020 -0.0052 0.0044 25 PRO 29 HD2 0.0014 -0.0019 0.0045 26 PRO 29 HD3 0.0021 -0.0030 0.0028 27 ASN 30 N 0.0014 -0.0057 0.0063 28 ASN 30 CA 0.0012 -0.0056 0.0073 29 ASN 30 C 0.0011 -0.0042 0.0067 30 ASN 30 O 0.0008 -0.0029 0.0073 31 ASN 30 CB 0.0007 -0.0055 0.0090 32 ASN 30 CG 0.0004 -0.0053 0.0101 33 ASN 30 OD1 0.0004 -0.0065 0.0107 34 ASN 30 ND2 0.0001 -0.0039 0.0105 35 ASN 30 H 0.0017 -0.0068 0.0059 36 ASN 30 HA 0.0013 -0.0067 0.0071 37 ASN 30 HB2 0.0008 -0.0066 0.0093 38 ASN 30 HB3 0.0006 -0.0045 0.0090 39 ASN 30 HD21 0.0001 -0.0030 0.0100 40 ASN 30 HD22 -0.0001 -0.0038 0.0112 41 ALA 31 N 0.0015 -0.0044 0.0054 42 ALA 31 CA 0.0015 -0.0033 0.0048 43 ALA 31 C 0.0019 -0.0041 0.0036 44 ALA 31 O 0.0022 -0.0042 0.0023 45 ALA 31 CB 0.0015 -0.0018 0.0040 46 ALA 31 H 0.0017 -0.0054 0.0049 47 ALA 31 HA 0.0012 -0.0029 0.0058 48 ALA 31 HB1 0.0015 -0.0010 0.0036 49 ALA 31 HB2 0.0018 -0.0022 0.0031 50 ALA 31 HB3 0.0013 -0.0013 0.0049 51 GLU 32 N 0.0017 -0.0047 0.0043 52 GLU 32 CA 0.0020 -0.0053 0.0033 53 GLU 32 C 0.0020 -0.0040 0.0028 54 GLU 32 O 0.0022 -0.0042 0.0017 55 GLU 32 CB 0.0019 -0.0065 0.0042 56 GLU 32 CG 0.0016 -0.0060 0.0056 57 GLU 32 CD 0.0015 -0.0073 0.0064 58 GLU 32 OE1 0.0016 -0.0075 0.0060 59 GLU 32 OE2 0.0014 -0.0081 0.0074 60 GLU 32 H 0.0015 -0.0048 0.0054 61 GLU 32 HA 0.0022 -0.0058 0.0024 62 GLU 32 HB2 0.0021 -0.0070 0.0034 63 GLU 32 HB3 0.0019 -0.0074 0.0045 64 GLU 32 HG2 0.0013 -0.0056 0.0064 65 GLU 32 HG3 0.0015 -0.0051 0.0053 66 PHE 33 N 0.0017 -0.0028 0.0035 67 PHE 33 CA 0.0016 -0.0014 0.0032 68 PHE 33 C 0.0017 -0.0002 0.0025 69 PHE 33 O 0.0017 -0.0004 0.0024 70 PHE 33 CB 0.0012 -0.0008 0.0047 71 PHE 33 CG 0.0009 -0.0006 0.0059 72 PHE 33 CD1 0.0008 0.0007 0.0060 73 PHE 33 CD2 0.0008 -0.0018 0.0070 74 PHE 33 CE1 0.0005 0.0009 0.0071 75 PHE 33 CE2 0.0006 -0.0016 0.0081 76 PHE 33 CZ 0.0004 -0.0003 0.0081 77 PHE 33 H 0.0015 -0.0029 0.0043 78 PHE 33 HA 0.0018 -0.0017 0.0025 79 PHE 33 HB2 0.0012 0.0003 0.0045 80 PHE 33 HB3 0.0012 -0.0016 0.0052 81 PHE 33 HD1 0.0009 0.0016 0.0052 82 PHE 33 HD2 0.0009 -0.0029 0.0070 83 PHE 33 HE1 0.0004 0.0019 0.0071 84 PHE 33 HE2 0.0005 -0.0026 0.0089 85 PHE 33 HZ 0.0002 -0.0002 0.0090 86 ASP 34 N 0.0016 0.0010 0.0019 87 ASP 34 CA 0.0015 0.0023 0.0013 88 ASP 34 C 0.0013 0.0036 0.0024 89 ASP 34 O 0.0012 0.0038 0.0031 90 ASP 34 CB 0.0017 0.0028 -0.0001 91 ASP 34 CG 0.0017 0.0040 -0.0009 92 ASP 34 OD1 0.0015 0.0053 -0.0005 93 ASP 34 OD2 0.0018 0.0037 -0.0020 94 ASP 34 H 0.0016 0.0010 0.0020 95 ASP 34 HA 0.0016 0.0021 0.0011 96 ASP 34 HB2 0.0018 0.0018 -0.0008 97 ASP 34 HB3 0.0016 0.0031 0.0001 98 PRO 35 N 0.0012 0.0044 0.0027 99 PRO 35 CA 0.0010 0.0056 0.0038 100 PRO 35 C 0.0010 0.0071 0.0032 101 PRO 35 O 0.0008 0.0082 0.0040 102 PRO 35 CB 0.0010 0.0057 0.0041 103 PRO 35 CG 0.0012 0.0054 0.0027 104 PRO 35 CD 0.0013 0.0042 0.0019 105 PRO 35 HA 0.0009 0.0053 0.0048 106 PRO 35 HB2 0.0008 0.0069 0.0045 107 PRO 35 HB3 0.0009 0.0049 0.0050 108 PRO 35 HG2 0.0012 0.0064 0.0020 109 PRO 35 HG3 0.0012 0.0049 0.0029 110 PRO 35 HD2 0.0015 0.0044 0.0008 111 PRO 35 HD3 0.0014 0.0031 0.0021 112 ASP 36 N 0.0012 0.0072 0.0018 113 ASP 36 CA 0.0012 0.0085 0.0012 114 ASP 36 C 0.0012 0.0083 0.0012 115 ASP 36 O 0.0011 0.0093 0.0014 116 ASP 36 CB 0.0013 0.0088 -0.0003 117 ASP 36 CG 0.0012 0.0102 -0.0010 118 ASP 36 OD1 0.0011 0.0114 -0.0005 119 ASP 36 OD2 0.0013 0.0100 -0.0020 120 ASP 36 H 0.0013 0.0063 0.0011 121 ASP 36 HA 0.0011 0.0094 0.0019 122 ASP 36 HB2 0.0013 0.0090 -0.0002 123 ASP 36 HB3 0.0014 0.0079 -0.0010 124 LEU 37 N 0.0013 0.0069 0.0009 125 LEU 37 CA 0.0013 0.0066 0.0008 126 LEU 37 C 0.0012 0.0062 0.0022 127 LEU 37 O 0.0012 0.0054 0.0031 128 LEU 37 CB 0.0015 0.0054 -0.0003 129 LEU 37 CG 0.0016 0.0058 -0.0018 130 LEU 37 CD1 0.0016 0.0070 -0.0022 131 LEU 37 CD2 0.0016 0.0061 -0.0023 132 LEU 37 H 0.0014 0.0062 0.0009 133 LEU 37 HA 0.0013 0.0075 0.0004 134 LEU 37 HB2 0.0015 0.0046 -0.0000 135 LEU 37 HB3 0.0015 0.0050 -0.0001 136 LEU 37 HG 0.0017 0.0049 -0.0024 137 LEU 37 HD11 0.0017 0.0072 -0.0033 138 LEU 37 HD12 0.0015 0.0079 -0.0016 139 LEU 37 HD13 0.0016 0.0067 -0.0020 140 LEU 37 HD21 0.0017 0.0064 -0.0034 141 LEU 37 HD22 0.0016 0.0053 -0.0020 142 LEU 37 HD23 0.0015 0.0070 -0.0017 143 PRO 38 N 0.0013 0.0067 0.0025 144 PRO 38 CA 0.0012 0.0064 0.0037 145 PRO 38 C 0.0012 0.0049 0.0039 146 PRO 38 O 0.0013 0.0043 0.0029 147 PRO 38 CB 0.0012 0.0072 0.0037 148 PRO 38 CG 0.0012 0.0083 0.0027 149 PRO 38 CD 0.0013 0.0077 0.0017 150 PRO 38 HA 0.0011 0.0067 0.0046 151 PRO 38 HB2 0.0012 0.0066 0.0033 152 PRO 38 HB3 0.0011 0.0076 0.0046 153 PRO 38 HG2 0.0012 0.0086 0.0022 154 PRO 38 HG3 0.0011 0.0091 0.0031 155 PRO 38 HD2 0.0013 0.0072 0.0009 156 PRO 38 HD3 0.0013 0.0084 0.0013 157 GLY 39 N 0.0011 0.0043 0.0050 158 GLY 39 CA 0.0011 0.0029 0.0052 159 GLY 39 C 0.0012 0.0021 0.0045 160 GLY 39 O 0.0013 0.0009 0.0041 161 GLY 39 H 0.0010 0.0048 0.0057 162 GLY 39 HA2 0.0010 0.0027 0.0062 163 GLY 39 HA3 0.0011 0.0027 0.0048 164 GLY 40 N 0.0012 0.0027 0.0043 165 GLY 40 CA 0.0013 0.0020 0.0035 166 GLY 40 C 0.0015 0.0017 0.0021 167 GLY 40 O 0.0016 0.0010 0.0013 168 GLY 40 H 0.0011 0.0037 0.0045 169 GLY 40 HA2 0.0012 0.0026 0.0036 170 GLY 40 HA3 0.0013 0.0010 0.0041 171 GLY 41 N 0.0015 0.0023 0.0016 172 GLY 41 CA 0.0016 0.0020 0.0002 173 GLY 41 C 0.0017 0.0006 0.0001 174 GLY 41 O 0.0018 0.0002 -0.0010 175 GLY 41 H 0.0014 0.0029 0.0022 176 GLY 41 HA2 0.0016 0.0028 0.0000 177 GLY 41 HA3 0.0017 0.0021 -0.0005 178 LEU 42 N 0.0016 -0.0000 0.0014 179 LEU 42 CA 0.0017 -0.0014 0.0014 180 LEU 42 C 0.0017 -0.0015 0.0016 181 LEU 42 O 0.0018 -0.0025 0.0015 182 LEU 42 CB 0.0016 -0.0021 0.0027 183 LEU 42 CG 0.0017 -0.0022 0.0026 184 LEU 42 CD1 0.0015 -0.0029 0.0039 185 LEU 42 CD2 0.0019 -0.0029 0.0014 186 LEU 42 H 0.0015 0.0004 0.0022 187 LEU 42 HA 0.0019 -0.0019 0.0005 188 LEU 42 HB2 0.0015 -0.0016 0.0036 189 LEU 42 HB3 0.0017 -0.0032 0.0027 190 LEU 42 HG 0.0016 -0.0011 0.0026 191 LEU 42 HD11 0.0015 -0.0030 0.0039 192 LEU 42 HD12 0.0016 -0.0039 0.0040 193 LEU 42 HD13 0.0014 -0.0023 0.0048 194 LEU 42 HD21 0.0020 -0.0039 0.0013 195 LEU 42 HD22 0.0019 -0.0030 0.0014 196 LEU 42 HD23 0.0019 -0.0023 0.0004 197 HIS 43 N 0.0015 -0.0003 0.0020 198 HIS 43 CA 0.0014 -0.0004 0.0023 199 HIS 43 C 0.0015 0.0006 0.0014 200 HIS 43 O 0.0014 0.0018 0.0016 201 HIS 43 CB 0.0013 0.0000 0.0037 202 HIS 43 CG 0.0012 -0.0008 0.0047 203 HIS 43 ND1 0.0012 -0.0019 0.0051 204 HIS 43 CD2 0.0012 -0.0005 0.0053 205 HIS 43 CE1 0.0012 -0.0024 0.0060 206 HIS 43 NE2 0.0011 -0.0016 0.0061 207 HIS 43 H 0.0014 0.0005 0.0020 208 HIS 43 HA 0.0015 -0.0013 0.0021 209 HIS 43 HB2 0.0013 0.0010 0.0038 210 HIS 43 HB3 0.0013 -0.0001 0.0038 211 HIS 43 HD1 0.0013 -0.0024 0.0048 212 HIS 43 HD2 0.0012 0.0003 0.0052 213 HIS 43 HE1 0.0012 -0.0033 0.0065 214 HIS 43 HE2 0.0011 -0.0017 0.0066 215 ARG 44 N 0.0014 0.0000 0.0004 216 ARG 44 CA 0.0015 0.0009 -0.0006 217 ARG 44 C 0.0015 0.0004 -0.0008 218 ARG 44 O 0.0015 -0.0008 -0.0007 219 ARG 44 CB 0.0016 0.0007 -0.0019 220 ARG 44 CG 0.0016 0.0008 -0.0019 221 ARG 44 CD 0.0017 0.0005 -0.0033 222 ARG 44 NE 0.0017 0.0004 -0.0034 223 ARG 44 CZ 0.0018 0.0003 -0.0046 224 ARG 44 NH1 0.0019 0.0002 -0.0057 225 ARG 44 NH2 0.0018 0.0003 -0.0046 226 ARG 44 H 0.0014 -0.0010 0.0003 227 ARG 44 HA 0.0015 0.0019 -0.0003 228 ARG 44 HB2 0.0016 -0.0002 -0.0023 229 ARG 44 HB3 0.0017 0.0015 -0.0025 230 ARG 44 HG2 0.0016 0.0017 -0.0016 231 ARG 44 HG3 0.0016 0.0000 -0.0012 232 ARG 44 HD2 0.0017 -0.0005 -0.0036 233 ARG 44 HD3 0.0018 0.0012 -0.0040 234 ARG 44 HE 0.0017 0.0004 -0.0026 235 ARG 44 HH11 0.0019 0.0002 -0.0057 236 ARG 44 HH12 0.0020 0.0001 -0.0066 237 ARG 44 HH21 0.0018 0.0003 -0.0037 238 ARG 44 HH22 0.0019 0.0002 -0.0054 239 CYS 45 N 0.0015 0.0013 -0.0010 240 CYS 45 CA 0.0015 0.0010 -0.0015 241 CYS 45 C 0.0016 0.0012 -0.0029 242 CYS 45 O 0.0017 0.0023 -0.0033 243 CYS 45 CB 0.0016 0.0018 -0.0009 244 CYS 45 SG 0.0016 0.0016 -0.0017 245 CYS 45 H 0.0016 0.0022 -0.0009 246 CYS 45 HA 0.0014 0.0000 -0.0013 247 CYS 45 HB2 0.0015 0.0015 0.0001 248 CYS 45 HB3 0.0016 0.0028 -0.0009 249 LEU 46 N 0.0015 0.0002 -0.0036 250 LEU 46 CA 0.0017 0.0003 -0.0050 251 LEU 46 C 0.0018 0.0012 -0.0056 252 LEU 46 O 0.0019 0.0019 -0.0065 253 LEU 46 CB 0.0015 -0.0011 -0.0056 254 LEU 46 CG 0.0014 -0.0020 -0.0051 255 LEU 46 CD1 0.0013 -0.0033 -0.0057 256 LEU 46 CD2 0.0015 -0.0015 -0.0054 257 LEU 46 H 0.0014 -0.0006 -0.0032 258 LEU 46 HA 0.0017 0.0007 -0.0052 259 LEU 46 HB2 0.0015 -0.0015 -0.0054 260 LEU 46 HB3 0.0016 -0.0010 -0.0066 261 LEU 46 HG 0.0013 -0.0020 -0.0041 262 LEU 46 HD11 0.0012 -0.0037 -0.0053 263 LEU 46 HD12 0.0012 -0.0040 -0.0053 264 LEU 46 HD13 0.0014 -0.0033 -0.0067 265 LEU 46 HD21 0.0016 -0.0006 -0.0050 266 LEU 46 HD22 0.0016 -0.0014 -0.0065 267 LEU 46 HD23 0.0014 -0.0022 -0.0051 268 ALA 47 N 0.0017 0.0010 -0.0050 269 ALA 47 CA 0.0018 0.0018 -0.0054 270 ALA 47 C 0.0021 0.0032 -0.0051 271 ALA 47 O 0.0022 0.0040 -0.0056 272 ALA 47 CB 0.0017 0.0013 -0.0047 273 ALA 47 H 0.0016 0.0004 -0.0043 274 ALA 47 HA 0.0019 0.0016 -0.0064 275 ALA 47 HB1 0.0018 0.0018 -0.0050 276 ALA 47 HB2 0.0017 0.0015 -0.0036 277 ALA 47 HB3 0.0016 0.0003 -0.0049 278 CYS 48 N 0.0019 0.0036 -0.0044 279 CYS 48 CA 0.0020 0.0049 -0.0041 280 CYS 48 C 0.0021 0.0054 -0.0045 281 CYS 48 O 0.0021 0.0065 -0.0045 282 CYS 48 CB 0.0020 0.0052 -0.0027 283 CYS 48 SG 0.0019 0.0051 -0.0023 284 CYS 48 H 0.0018 0.0029 -0.0040 285 CYS 48 HA 0.0021 0.0055 -0.0047 286 CYS 48 HB2 0.0019 0.0047 -0.0019 287 CYS 48 HB3 0.0021 0.0063 -0.0025 288 ALA 49 N 0.0020 0.0045 -0.0049 289 ALA 49 CA 0.0020 0.0048 -0.0052 290 ALA 49 C 0.0020 0.0055 -0.0041 291 ALA 49 O 0.0020 0.0062 -0.0043 292 ALA 49 CB 0.0021 0.0055 -0.0065 293 ALA 49 H 0.0019 0.0036 -0.0049 294 ALA 49 HA 0.0019 0.0038 -0.0053 295 ALA 49 HB1 0.0022 0.0065 -0.0064 296 ALA 49 HB2 0.0021 0.0049 -0.0073 297 ALA 49 HB3 0.0021 0.0056 -0.0068 298 ARG 50 N 0.0018 0.0053 -0.0029 299 ARG 50 CA 0.0018 0.0060 -0.0018 300 ARG 50 C 0.0017 0.0051 -0.0010 301 ARG 50 O 0.0016 0.0040 -0.0009 302 ARG 50 CB 0.0018 0.0067 -0.0010 303 ARG 50 CG 0.0019 0.0077 -0.0018 304 ARG 50 CD 0.0019 0.0083 -0.0009 305 ARG 50 NE 0.0020 0.0093 -0.0016 306 ARG 50 CZ 0.0020 0.0099 -0.0011 307 ARG 50 NH1 0.0020 0.0097 0.0001 308 ARG 50 NH2 0.0021 0.0108 -0.0018 309 ARG 50 H 0.0018 0.0047 -0.0028 310 ARG 50 HA 0.0019 0.0067 -0.0022 311 ARG 50 HB2 0.0017 0.0059 -0.0007 312 ARG 50 HB3 0.0018 0.0071 -0.0002 313 ARG 50 HG2 0.0020 0.0085 -0.0020 314 ARG 50 HG3 0.0019 0.0073 -0.0026 315 ARG 50 HD2 0.0018 0.0076 -0.0006 316 ARG 50 HD3 0.0019 0.0088 -0.0001 317 ARG 50 HE 0.0021 0.0095 -0.0025 318 ARG 50 HH11 0.0019 0.0091 0.0007 319 ARG 50 HH12 0.0020 0.0101 0.0005 320 ARG 50 HH21 0.0022 0.0110 -0.0027 321 ARG 50 HH22 0.0022 0.0112 -0.0015 322 TYR 51 N 0.0016 0.0057 -0.0004 323 TYR 51 CA 0.0015 0.0049 0.0004 324 TYR 51 C 0.0014 0.0053 0.0018 325 TYR 51 O 0.0014 0.0065 0.0022 326 TYR 51 CB 0.0016 0.0053 0.0001 327 TYR 51 CG 0.0016 0.0051 -0.0014 328 TYR 51 CD1 0.0017 0.0061 -0.0023 329 TYR 51 CD2 0.0017 0.0039 -0.0018 330 TYR 51 CE1 0.0018 0.0059 -0.0036 331 TYR 51 CE2 0.0018 0.0037 -0.0031 332 TYR 51 CZ 0.0018 0.0047 -0.0040 333 TYR 51 OH 0.0019 0.0045 -0.0053 334 TYR 51 H 0.0016 0.0066 -0.0005 335 TYR 51 HA 0.0015 0.0039 0.0002 336 TYR 51 HB2 0.0015 0.0064 0.0003 337 TYR 51 HB3 0.0015 0.0047 0.0007 338 TYR 51 HD1 0.0017 0.0070 -0.0020 339 TYR 51 HD2 0.0016 0.0031 -0.0011 340 TYR 51 HE1 0.0018 0.0067 -0.0043 341 TYR 51 HE2 0.0018 0.0027 -0.0034 342 TYR 51 HH 0.0019 0.0053 -0.0056 343 PHE 52 N 0.0014 0.0042 0.0026 344 PHE 52 CA 0.0013 0.0044 0.0039 345 PHE 52 C 0.0013 0.0040 0.0047 346 PHE 52 O 0.0013 0.0030 0.0044 347 PHE 52 CB 0.0013 0.0037 0.0043 348 PHE 52 CG 0.0013 0.0042 0.0035 349 PHE 52 CD1 0.0014 0.0037 0.0023 350 PHE 52 CD2 0.0013 0.0050 0.0040 351 PHE 52 CE1 0.0015 0.0040 0.0016 352 PHE 52 CE2 0.0014 0.0054 0.0033 353 PHE 52 CZ 0.0015 0.0049 0.0021 354 PHE 52 H 0.0014 0.0034 0.0023 355 PHE 52 HA 0.0013 0.0055 0.0041 356 PHE 52 HB2 0.0013 0.0027 0.0041 357 PHE 52 HB3 0.0012 0.0039 0.0052 358 PHE 52 HD1 0.0014 0.0030 0.0019 359 PHE 52 HD2 0.0013 0.0054 0.0049 360 PHE 52 HE1 0.0015 0.0037 0.0007 361 PHE 52 HE2 0.0014 0.0061 0.0037 362 PHE 52 HZ 0.0015 0.0052 0.0015 363 ILE 53 N 0.0011 0.0047 0.0059 364 ILE 53 CA 0.0010 0.0044 0.0068 365 ILE 53 C 0.0010 0.0030 0.0074 366 ILE 53 O 0.0010 0.0024 0.0077 367 ILE 53 CB 0.0009 0.0054 0.0079 368 ILE 53 CG1 0.0009 0.0054 0.0086 369 ILE 53 CG2 0.0009 0.0067 0.0074 370 ILE 53 CD1 0.0008 0.0064 0.0097 371 ILE 53 H 0.0010 0.0054 0.0061 372 ILE 53 HA 0.0011 0.0044 0.0063 373 ILE 53 HB 0.0009 0.0051 0.0086 374 ILE 53 HG12 0.0009 0.0057 0.0079 375 ILE 53 HG13 0.0009 0.0045 0.0089 376 ILE 53 HG21 0.0010 0.0070 0.0066 377 ILE 53 HG22 0.0009 0.0066 0.0070 378 ILE 53 HG23 0.0008 0.0074 0.0081 379 ILE 53 HD11 0.0007 0.0061 0.0104 380 ILE 53 HD12 0.0008 0.0064 0.0101 381 ILE 53 HD13 0.0008 0.0073 0.0093 382 ASP 54 N 0.0010 0.0025 0.0074 383 ASP 54 CA 0.0010 0.0013 0.0080 384 ASP 54 C 0.0010 0.0007 0.0074 385 ASP 54 O 0.0010 0.0013 0.0069 386 ASP 54 CB 0.0008 0.0015 0.0094 387 ASP 54 CG 0.0008 0.0003 0.0101 388 ASP 54 OD1 0.0008 -0.0003 0.0105 389 ASP 54 OD2 0.0008 -0.0001 0.0104 390 ASP 54 H 0.0010 0.0030 0.0071 391 ASP 54 HA 0.0010 0.0007 0.0079 392 ASP 54 HB2 0.0008 0.0020 0.0098 393 ASP 54 HB3 0.0008 0.0021 0.0095 394 SER 55 N 0.0009 -0.0006 0.0074 395 SER 55 CA 0.0010 -0.0013 0.0070 396 SER 55 C 0.0009 -0.0009 0.0076 397 SER 55 O 0.0010 -0.0009 0.0070 398 SER 55 CB 0.0010 -0.0027 0.0071 399 SER 55 OG 0.0010 -0.0035 0.0067 400 SER 55 H 0.0009 -0.0010 0.0079 401 SER 55 HA 0.0010 -0.0011 0.0060 402 SER 55 HB2 0.0010 -0.0029 0.0066 403 SER 55 HB3 0.0009 -0.0029 0.0081 404 SER 55 HG 0.0009 -0.0036 0.0074 405 THR 56 N 0.0009 -0.0005 0.0087 406 THR 56 CA 0.0008 -0.0002 0.0093 407 THR 56 C 0.0009 0.0010 0.0088 408 THR 56 O 0.0009 0.0011 0.0087 409 THR 56 CB 0.0007 0.0000 0.0106 410 THR 56 OG1 0.0007 -0.0010 0.0111 411 THR 56 CG2 0.0007 0.0002 0.0114 412 THR 56 H 0.0008 -0.0005 0.0091 413 THR 56 HA 0.0008 -0.0009 0.0093 414 THR 56 HB 0.0007 0.0008 0.0107 415 THR 56 HG1 0.0007 -0.0009 0.0109 416 THR 56 HG21 0.0006 0.0004 0.0123 417 THR 56 HG22 0.0007 -0.0005 0.0114 418 THR 56 HG23 0.0007 0.0010 0.0111 419 ASN 57 N 0.0010 0.0018 0.0085 420 ASN 57 CA 0.0010 0.0029 0.0079 421 ASN 57 C 0.0011 0.0027 0.0066 422 ASN 57 O 0.0012 0.0032 0.0063 423 ASN 57 CB 0.0011 0.0039 0.0078 424 ASN 57 CG 0.0010 0.0046 0.0090 425 ASN 57 OD1 0.0010 0.0056 0.0092 426 ASN 57 ND2 0.0009 0.0041 0.0098 427 ASN 57 H 0.0010 0.0017 0.0086 428 ASN 57 HA 0.0010 0.0033 0.0085 429 ASN 57 HB2 0.0011 0.0033 0.0076 430 ASN 57 HB3 0.0011 0.0045 0.0070 431 ASN 57 HD21 0.0009 0.0034 0.0097 432 ASN 57 HD22 0.0009 0.0046 0.0106 433 LEU 58 N 0.0011 0.0018 0.0060 434 LEU 58 CA 0.0012 0.0014 0.0048 435 LEU 58 C 0.0012 0.0008 0.0049 436 LEU 58 O 0.0012 0.0011 0.0043 437 LEU 58 CB 0.0012 0.0006 0.0042 438 LEU 58 CG 0.0012 -0.0000 0.0029 439 LEU 58 CD1 0.0012 -0.0012 0.0032 440 LEU 58 CD2 0.0013 0.0008 0.0021 441 LEU 58 H 0.0011 0.0014 0.0063 442 LEU 58 HA 0.0013 0.0023 0.0043 443 LEU 58 HB2 0.0012 0.0012 0.0040 444 LEU 58 HB3 0.0011 -0.0001 0.0048 445 LEU 58 HG 0.0013 -0.0003 0.0025 446 LEU 58 HD11 0.0012 -0.0017 0.0023 447 LEU 58 HD12 0.0012 -0.0010 0.0037 448 LEU 58 HD13 0.0011 -0.0019 0.0037 449 LEU 58 HD21 0.0013 0.0011 0.0025 450 LEU 58 HD22 0.0013 0.0003 0.0012 451 LEU 58 HD23 0.0014 0.0016 0.0019 452 LYS 59 N 0.0010 -0.0001 0.0057 453 LYS 59 CA 0.0009 -0.0007 0.0059 454 LYS 59 C 0.0009 0.0001 0.0064 455 LYS 59 O 0.0010 -0.0001 0.0062 456 LYS 59 CB 0.0008 -0.0018 0.0066 457 LYS 59 CG 0.0007 -0.0016 0.0078 458 LYS 59 CD 0.0006 -0.0027 0.0084 459 LYS 59 CE 0.0005 -0.0034 0.0086 460 LYS 59 NZ 0.0005 -0.0028 0.0094 461 LYS 59 H 0.0009 -0.0004 0.0060 462 LYS 59 HA 0.0010 -0.0010 0.0051 463 LYS 59 HB2 0.0007 -0.0022 0.0067 464 LYS 59 HB3 0.0008 -0.0023 0.0062 465 LYS 59 HG2 0.0007 -0.0011 0.0077 466 LYS 59 HG3 0.0007 -0.0011 0.0083 467 LYS 59 HD2 0.0006 -0.0032 0.0079 468 LYS 59 HD3 0.0005 -0.0025 0.0092 469 LYS 59 HE2 0.0005 -0.0036 0.0078 470 LYS 59 HE3 0.0004 -0.0042 0.0090 471 LYS 59 HZ1 0.0004 -0.0027 0.0102 472 LYS 59 HZ2 0.0004 -0.0033 0.0095 473 LYS 59 HZ3 0.0005 -0.0020 0.0091 474 THR 60 N 0.0010 0.0009 0.0072 475 THR 60 CA 0.0011 0.0018 0.0077 476 THR 60 C 0.0012 0.0025 0.0067 477 THR 60 O 0.0013 0.0029 0.0069 478 THR 60 CB 0.0012 0.0026 0.0087 479 THR 60 OG1 0.0011 0.0019 0.0096 480 THR 60 CG2 0.0013 0.0035 0.0093 481 THR 60 H 0.0010 0.0010 0.0074 482 THR 60 HA 0.0010 0.0013 0.0082 483 THR 60 HB 0.0013 0.0031 0.0082 484 THR 60 HG1 0.0010 0.0014 0.0093 485 THR 60 HG21 0.0013 0.0041 0.0099 486 THR 60 HG22 0.0012 0.0030 0.0097 487 THR 60 HG23 0.0014 0.0041 0.0086 488 HIS 61 N 0.0013 0.0027 0.0058 489 HIS 61 CA 0.0014 0.0034 0.0048 490 HIS 61 C 0.0014 0.0027 0.0042 491 HIS 61 O 0.0015 0.0033 0.0036 492 HIS 61 CB 0.0015 0.0036 0.0039 493 HIS 61 CG 0.0016 0.0039 0.0026 494 HIS 61 ND1 0.0017 0.0049 0.0022 495 HIS 61 CD2 0.0016 0.0031 0.0016 496 HIS 61 CE1 0.0018 0.0048 0.0011 497 HIS 61 NE2 0.0017 0.0038 0.0007 498 HIS 61 H 0.0013 0.0024 0.0058 499 HIS 61 HA 0.0015 0.0042 0.0051 500 HIS 61 HB2 0.0016 0.0044 0.0042 501 HIS 61 HB3 0.0014 0.0028 0.0039 502 HIS 61 HD1 0.0018 0.0056 0.0028 503 HIS 61 HD2 0.0014 0.0022 0.0015 504 HIS 61 HE1 0.0019 0.0054 0.0005 505 PHE 62 N 0.0013 0.0014 0.0042 506 PHE 62 CA 0.0012 0.0008 0.0036 507 PHE 62 C 0.0012 0.0008 0.0044 508 PHE 62 O 0.0011 0.0003 0.0041 509 PHE 62 CB 0.0011 -0.0004 0.0032 510 PHE 62 CG 0.0011 -0.0006 0.0025 511 PHE 62 CD1 0.0012 0.0001 0.0015 512 PHE 62 CD2 0.0009 -0.0014 0.0029 513 PHE 62 CE1 0.0012 -0.0001 0.0009 514 PHE 62 CE2 0.0009 -0.0015 0.0023 515 PHE 62 CZ 0.0011 -0.0009 0.0013 516 PHE 62 H 0.0012 0.0010 0.0047 517 PHE 62 HA 0.0013 0.0013 0.0028 518 PHE 62 HB2 0.0009 -0.0010 0.0040 519 PHE 62 HB3 0.0010 -0.0007 0.0026 520 PHE 62 HD1 0.0013 0.0007 0.0012 521 PHE 62 HD2 0.0008 -0.0019 0.0037 522 PHE 62 HE1 0.0013 0.0004 0.0001 523 PHE 62 HE2 0.0008 -0.0021 0.0027 524 PHE 62 HZ 0.0011 -0.0010 0.0009 525 ARG 63 N 0.0013 0.0014 0.0055 526 ARG 63 CA 0.0013 0.0014 0.0063 527 ARG 63 C 0.0014 0.0022 0.0059 528 ARG 63 O 0.0015 0.0024 0.0066 529 ARG 63 CB 0.0013 0.0018 0.0076 530 ARG 63 CG 0.0011 0.0008 0.0082 531 ARG 63 CD 0.0012 0.0012 0.0095 532 ARG 63 NE 0.0012 0.0014 0.0103 533 ARG 63 CZ 0.0012 0.0016 0.0116 534 ARG 63 NH1 0.0012 0.0015 0.0121 535 ARG 63 NH2 0.0013 0.0018 0.0122 536 ARG 63 H 0.0014 0.0018 0.0056 537 ARG 63 HA 0.0011 0.0005 0.0064 538 ARG 63 HB2 0.0015 0.0026 0.0076 539 ARG 63 HB3 0.0013 0.0019 0.0082 540 ARG 63 HG2 0.0009 -0.0000 0.0083 541 ARG 63 HG3 0.0011 0.0007 0.0076 542 ARG 63 HD2 0.0010 0.0005 0.0098 543 ARG 63 HD3 0.0013 0.0020 0.0094 544 ARG 63 HE 0.0012 0.0015 0.0099 545 ARG 63 HH11 0.0012 0.0013 0.0116 546 ARG 63 HH12 0.0012 0.0016 0.0130 547 ARG 63 HH21 0.0013 0.0019 0.0118 548 ARG 63 HH22 0.0013 0.0020 0.0132 549 SER 64 N 0.0015 0.0027 0.0049 550 SER 64 CA 0.0016 0.0033 0.0043 551 SER 64 C 0.0015 0.0024 0.0036 552 SER 64 O 0.0014 0.0019 0.0027 553 SER 64 CB 0.0018 0.0041 0.0033 554 SER 64 OG 0.0019 0.0048 0.0039 555 SER 64 H 0.0015 0.0026 0.0045 556 SER 64 HA 0.0017 0.0038 0.0049 557 SER 64 HB2 0.0017 0.0036 0.0026 558 SER 64 HB3 0.0019 0.0047 0.0030 559 SER 64 HG 0.0020 0.0054 0.0044 560 LYS 65 N 0.0015 0.0022 0.0040 561 LYS 65 CA 0.0013 0.0013 0.0035 562 LYS 65 C 0.0014 0.0016 0.0023 563 LYS 65 O 0.0013 0.0008 0.0016 564 LYS 65 CB 0.0012 0.0011 0.0043 565 LYS 65 CG 0.0014 0.0021 0.0048 566 LYS 65 CD 0.0016 0.0028 0.0038 567 LYS 65 CE 0.0017 0.0038 0.0043 568 LYS 65 NZ 0.0019 0.0045 0.0034 569 LYS 65 H 0.0015 0.0026 0.0047 570 LYS 65 HA 0.0012 0.0006 0.0035 571 LYS 65 HB2 0.0012 0.0006 0.0039 572 LYS 65 HB3 0.0011 0.0006 0.0051 573 LYS 65 HG2 0.0013 0.0018 0.0054 574 LYS 65 HG3 0.0015 0.0027 0.0052 575 LYS 65 HD2 0.0017 0.0031 0.0032 576 LYS 65 HD3 0.0015 0.0022 0.0034 577 LYS 65 HE2 0.0016 0.0035 0.0049 578 LYS 65 HE3 0.0018 0.0043 0.0048 579 LYS 65 HZ1 0.0018 0.0040 0.0029 580 LYS 65 HZ2 0.0020 0.0048 0.0028 581 LYS 65 HZ3 0.0020 0.0052 0.0038 582 ASP 66 N 0.0016 0.0027 0.0021 583 ASP 66 CA 0.0018 0.0031 0.0010 584 ASP 66 C 0.0018 0.0027 0.0000 585 ASP 66 O 0.0018 0.0025 -0.0009 586 ASP 66 CB 0.0021 0.0043 0.0010 587 ASP 66 CG 0.0022 0.0047 -0.0001 588 ASP 66 OD1 0.0022 0.0047 -0.0001 589 ASP 66 OD2 0.0023 0.0050 -0.0009 590 ASP 66 H 0.0017 0.0033 0.0026 591 ASP 66 HA 0.0017 0.0026 0.0008 592 ASP 66 HB2 0.0020 0.0045 0.0017 593 ASP 66 HB3 0.0021 0.0047 0.0010 594 HIS 67 N 0.0017 0.0028 0.0004 595 HIS 67 CA 0.0017 0.0025 -0.0004 596 HIS 67 C 0.0014 0.0013 -0.0008 597 HIS 67 O 0.0014 0.0010 -0.0019 598 HIS 67 CB 0.0017 0.0027 0.0002 599 HIS 67 CG 0.0017 0.0025 -0.0005 600 HIS 67 ND1 0.0018 0.0028 -0.0017 601 HIS 67 CD2 0.0017 0.0025 -0.0001 602 HIS 67 CE1 0.0019 0.0030 -0.0019 603 HIS 67 NE2 0.0018 0.0028 -0.0010 604 HIS 67 H 0.0018 0.0030 0.0012 605 HIS 67 HA 0.0018 0.0030 -0.0012 606 HIS 67 HB2 0.0019 0.0036 0.0005 607 HIS 67 HB3 0.0016 0.0021 0.0010 608 HIS 67 HD1 0.0018 0.0029 -0.0022 609 HIS 67 HD2 0.0016 0.0021 0.0007 610 HIS 67 HE1 0.0019 0.0033 -0.0028 611 LYS 68 N 0.0013 0.0005 0.0000 612 LYS 68 CA 0.0010 -0.0008 -0.0002 613 LYS 68 C 0.0010 -0.0011 -0.0008 614 LYS 68 O 0.0008 -0.0019 -0.0016 615 LYS 68 CB 0.0009 -0.0014 0.0009 616 LYS 68 CG 0.0010 -0.0009 0.0016 617 LYS 68 CD 0.0008 -0.0016 0.0027 618 LYS 68 CE 0.0008 -0.0014 0.0035 619 LYS 68 NZ 0.0007 -0.0019 0.0047 620 LYS 68 H 0.0013 0.0007 0.0008 621 LYS 68 HA 0.0010 -0.0009 -0.0008 622 LYS 68 HB2 0.0009 -0.0013 0.0014 623 LYS 68 HB3 0.0007 -0.0023 0.0007 624 LYS 68 HG2 0.0010 -0.0009 0.0011 625 LYS 68 HG3 0.0012 -0.0000 0.0018 626 LYS 68 HD2 0.0006 -0.0025 0.0026 627 LYS 68 HD3 0.0009 -0.0013 0.0032 628 LYS 68 HE2 0.0010 -0.0004 0.0037 629 LYS 68 HE3 0.0008 -0.0017 0.0031 630 LYS 68 HZ1 0.0005 -0.0028 0.0046 631 LYS 68 HZ2 0.0007 -0.0017 0.0052 632 LYS 68 HZ3 0.0008 -0.0016 0.0051 633 LYS 69 N 0.0012 -0.0003 -0.0005 634 LYS 69 CA 0.0012 -0.0003 -0.0011 635 LYS 69 C 0.0014 -0.0000 -0.0023 636 LYS 69 O 0.0013 -0.0006 -0.0031 637 LYS 69 CB 0.0014 0.0006 -0.0006 638 LYS 69 CG 0.0015 0.0010 -0.0012 639 LYS 69 CD 0.0017 0.0020 -0.0005 640 LYS 69 CE 0.0019 0.0026 -0.0010 641 LYS 69 NZ 0.0021 0.0035 -0.0003 642 LYS 69 H 0.0012 0.0002 0.0001 643 LYS 69 HA 0.0010 -0.0010 -0.0010 644 LYS 69 HB2 0.0012 0.0004 0.0002 645 LYS 69 HB3 0.0015 0.0013 -0.0004 646 LYS 69 HG2 0.0017 0.0012 -0.0020 647 LYS 69 HG3 0.0014 0.0004 -0.0012 648 LYS 69 HD2 0.0016 0.0017 0.0003 649 LYS 69 HD3 0.0018 0.0026 -0.0004 650 LYS 69 HE2 0.0020 0.0028 -0.0019 651 LYS 69 HE3 0.0018 0.0020 -0.0011 652 LYS 69 HZ1 0.0022 0.0040 -0.0007 653 LYS 69 HZ2 0.0022 0.0040 -0.0003 654 LYS 69 HZ3 0.0019 0.0033 0.0005 655 ARG 70 N 0.0015 0.0008 -0.0026 656 ARG 70 CA 0.0017 0.0011 -0.0038 657 ARG 70 C 0.0015 0.0002 -0.0044 658 ARG 70 O 0.0016 -0.0001 -0.0054 659 ARG 70 CB 0.0020 0.0022 -0.0039 660 ARG 70 CG 0.0022 0.0026 -0.0051 661 ARG 70 CD 0.0023 0.0028 -0.0057 662 ARG 70 NE 0.0025 0.0031 -0.0069 663 ARG 70 CZ 0.0025 0.0029 -0.0077 664 ARG 70 NH1 0.0024 0.0023 -0.0075 665 ARG 70 NH2 0.0027 0.0032 -0.0088 666 ARG 70 H 0.0016 0.0013 -0.0020 667 ARG 70 HA 0.0018 0.0012 -0.0042 668 ARG 70 HB2 0.0021 0.0029 -0.0034 669 ARG 70 HB3 0.0019 0.0021 -0.0036 670 ARG 70 HG2 0.0024 0.0034 -0.0051 671 ARG 70 HG3 0.0021 0.0020 -0.0056 672 ARG 70 HD2 0.0021 0.0020 -0.0057 673 ARG 70 HD3 0.0024 0.0034 -0.0052 674 ARG 70 HE 0.0026 0.0036 -0.0071 675 ARG 70 HH11 0.0022 0.0020 -0.0067 676 ARG 70 HH12 0.0024 0.0021 -0.0081 677 ARG 70 HH21 0.0029 0.0037 -0.0090 678 ARG 70 HH22 0.0027 0.0031 -0.0094 679 LEU 71 N 0.0013 -0.0004 -0.0037 680 LEU 71 CA 0.0012 -0.0013 -0.0042 681 LEU 71 C 0.0009 -0.0023 -0.0045 682 LEU 71 O 0.0008 -0.0029 -0.0054 683 LEU 71 CB 0.0010 -0.0016 -0.0032 684 LEU 71 CG 0.0012 -0.0007 -0.0028 685 LEU 71 CD1 0.0010 -0.0012 -0.0019 686 LEU 71 CD2 0.0014 -0.0001 -0.0037 687 LEU 71 H 0.0013 -0.0002 -0.0029 688 LEU 71 HA 0.0013 -0.0010 -0.0049 689 LEU 71 HB2 0.0009 -0.0019 -0.0025 690 LEU 71 HB3 0.0009 -0.0023 -0.0036 691 LEU 71 HG 0.0013 -0.0001 -0.0023 692 LEU 71 HD11 0.0009 -0.0018 -0.0023 693 LEU 71 HD12 0.0009 -0.0015 -0.0012 694 LEU 71 HD13 0.0012 -0.0005 -0.0016 695 LEU 71 HD21 0.0015 0.0003 -0.0043 696 LEU 71 HD22 0.0013 -0.0008 -0.0042 697 LEU 71 HD23 0.0015 0.0005 -0.0034 698 LYS 72 N 0.0009 -0.0025 -0.0038 699 LYS 72 CA 0.0006 -0.0033 -0.0040 700 LYS 72 C 0.0009 -0.0031 -0.0050 701 LYS 72 O 0.0007 -0.0038 -0.0057 702 LYS 72 CB 0.0005 -0.0033 -0.0029 703 LYS 72 CG 0.0002 -0.0041 -0.0029 704 LYS 72 CD 0.0000 -0.0041 -0.0018 705 LYS 72 CE -0.0002 -0.0050 -0.0019 706 LYS 72 NZ -0.0004 -0.0050 -0.0008 707 LYS 72 H 0.0009 -0.0020 -0.0031 708 LYS 72 HA 0.0004 -0.0041 -0.0041 709 LYS 72 HB2 0.0003 -0.0034 -0.0021 710 LYS 72 HB3 0.0007 -0.0025 -0.0028 711 LYS 72 HG2 0.0004 -0.0039 -0.0036 712 LYS 72 HG3 -0.0000 -0.0050 -0.0031 713 LYS 72 HD2 -0.0001 -0.0043 -0.0011 714 LYS 72 HD3 0.0003 -0.0033 -0.0017 715 LYS 72 HE2 -0.0001 -0.0048 -0.0026 716 LYS 72 HE3 -0.0005 -0.0058 -0.0021 717 LYS 72 HZ1 -0.0002 -0.0042 -0.0006 718 LYS 72 HZ2 -0.0006 -0.0052 -0.0001 719 LYS 72 HZ3 -0.0006 -0.0056 -0.0008 720 GLN 73 N 0.0011 -0.0021 -0.0053 721 GLN 73 CA 0.0012 -0.0017 -0.0063 722 GLN 73 C 0.0013 -0.0018 -0.0074 723 GLN 73 O 0.0013 -0.0022 -0.0083 724 GLN 73 CB 0.0015 -0.0005 -0.0062 725 GLN 73 CG 0.0015 -0.0003 -0.0052 726 GLN 73 CD 0.0018 0.0009 -0.0050 727 GLN 73 OE1 0.0020 0.0017 -0.0053 728 GLN 73 NE2 0.0018 0.0011 -0.0046 729 GLN 73 H 0.0012 -0.0015 -0.0047 730 GLN 73 HA 0.0011 -0.0023 -0.0064 731 GLN 73 HB2 0.0017 0.0000 -0.0060 732 GLN 73 HB3 0.0017 -0.0003 -0.0069 733 GLN 73 HG2 0.0014 -0.0008 -0.0053 734 GLN 73 HG3 0.0014 -0.0006 -0.0044 735 GLN 73 HE21 0.0016 0.0004 -0.0044 736 GLN 73 HE22 0.0020 0.0018 -0.0045 737 LEU 74 N 0.0014 -0.0015 -0.0073 738 LEU 74 CA 0.0014 -0.0015 -0.0083 739 LEU 74 C 0.0011 -0.0027 -0.0085 740 LEU 74 O 0.0011 -0.0029 -0.0095 741 LEU 74 CB 0.0016 -0.0007 -0.0080 742 LEU 74 CG 0.0017 -0.0004 -0.0090 743 LEU 74 CD1 0.0019 -0.0000 -0.0101 744 LEU 74 CD2 0.0019 0.0004 -0.0086 745 LEU 74 H 0.0014 -0.0013 -0.0065 746 LEU 74 HA 0.0015 -0.0013 -0.0091 747 LEU 74 HB2 0.0018 0.0001 -0.0077 748 LEU 74 HB3 0.0015 -0.0010 -0.0073 749 LEU 74 HG 0.0016 -0.0012 -0.0092 750 LEU 74 HD11 0.0020 0.0001 -0.0107 751 LEU 74 HD12 0.0021 0.0008 -0.0099 752 LEU 74 HD13 0.0018 -0.0007 -0.0104 753 LEU 74 HD21 0.0021 0.0012 -0.0083 754 LEU 74 HD22 0.0020 0.0006 -0.0092 755 LEU 74 HD23 0.0018 0.0001 -0.0078 756 SER 75 N 0.0009 -0.0035 -0.0077 757 SER 75 CA 0.0006 -0.0047 -0.0078 758 SER 75 C 0.0006 -0.0048 -0.0075 759 SER 75 O 0.0004 -0.0056 -0.0079 760 SER 75 CB 0.0006 -0.0052 -0.0090 761 SER 75 OG 0.0003 -0.0064 -0.0090 762 SER 75 H 0.0009 -0.0032 -0.0070 763 SER 75 HA 0.0004 -0.0051 -0.0071 764 SER 75 HB2 0.0006 -0.0052 -0.0091 765 SER 75 HB3 0.0007 -0.0048 -0.0097 766 SER 75 HG 0.0002 -0.0068 -0.0093 767 VAL 76 N 0.0007 -0.0040 -0.0070 768 VAL 76 CA 0.0007 -0.0039 -0.0066 769 VAL 76 C 0.0004 -0.0049 -0.0058 770 VAL 76 O 0.0003 -0.0057 -0.0061 771 VAL 76 CB 0.0010 -0.0028 -0.0060 772 VAL 76 CG1 0.0009 -0.0028 -0.0056 773 VAL 76 CG2 0.0013 -0.0018 -0.0068 774 VAL 76 H 0.0009 -0.0033 -0.0067 775 VAL 76 HA 0.0008 -0.0040 -0.0074 776 VAL 76 HB 0.0009 -0.0027 -0.0052 777 VAL 76 HG11 0.0011 -0.0020 -0.0052 778 VAL 76 HG12 0.0010 -0.0029 -0.0064 779 VAL 76 HG13 0.0007 -0.0035 -0.0051 780 VAL 76 HG21 0.0014 -0.0010 -0.0063 781 VAL 76 HG22 0.0013 -0.0018 -0.0070 782 VAL 76 HG23 0.0013 -0.0019 -0.0076 783 GLU 77 N 0.0003 -0.0050 -0.0048 784 GLU 77 CA 0.0000 -0.0059 -0.0040 785 GLU 77 C -0.0001 -0.0062 -0.0034 786 GLU 77 O 0.0000 -0.0056 -0.0026 787 GLU 77 CB 0.0000 -0.0056 -0.0031 788 GLU 77 CG 0.0003 -0.0044 -0.0024 789 GLU 77 CD 0.0003 -0.0042 -0.0015 790 GLU 77 OE1 0.0004 -0.0040 -0.0018 791 GLU 77 OE2 0.0002 -0.0043 -0.0004 792 GLU 77 H 0.0005 -0.0044 -0.0046 793 GLU 77 HA -0.0001 -0.0066 -0.0045 794 GLU 77 HB2 -0.0002 -0.0062 -0.0024 795 GLU 77 HB3 0.0001 -0.0056 -0.0035 796 GLU 77 HG2 0.0005 -0.0038 -0.0031 797 GLU 77 HG3 0.0003 -0.0044 -0.0020 798 PRO 78 N -0.0004 -0.0070 -0.0039 799 PRO 78 CA -0.0005 -0.0074 -0.0033 800 PRO 78 C -0.0008 -0.0079 -0.0021 801 PRO 78 O -0.0010 -0.0087 -0.0021 802 PRO 78 CB -0.0007 -0.0083 -0.0042 803 PRO 78 CG -0.0005 -0.0081 -0.0053 804 PRO 78 CD -0.0004 -0.0076 -0.0050 805 PRO 78 HA -0.0004 -0.0067 -0.0031 806 PRO 78 HB2 -0.0010 -0.0092 -0.0038 807 PRO 78 HB3 -0.0007 -0.0083 -0.0043 808 PRO 78 HG2 -0.0007 -0.0089 -0.0058 809 PRO 78 HG3 -0.0003 -0.0075 -0.0058 810 PRO 78 HD2 -0.0006 -0.0083 -0.0049 811 PRO 78 HD3 -0.0002 -0.0070 -0.0057 812 TYR 79 N -0.0009 -0.0073 -0.0010 813 TYR 79 CA -0.0011 -0.0077 0.0002 814 TYR 79 C -0.0010 -0.0071 0.0006 815 TYR 79 O -0.0011 -0.0076 0.0003 816 TYR 79 CB -0.0016 -0.0090 0.0004 817 TYR 79 CG -0.0017 -0.0095 0.0002 818 TYR 79 CD1 -0.0018 -0.0099 -0.0009 819 TYR 79 CD2 -0.0018 -0.0096 0.0012 820 TYR 79 CE1 -0.0019 -0.0104 -0.0010 821 TYR 79 CE2 -0.0020 -0.0101 0.0011 822 TYR 79 CZ -0.0020 -0.0105 -0.0000 823 TYR 79 OH -0.0022 -0.0110 -0.0002 824 TYR 79 H -0.0007 -0.0068 -0.0011 825 TYR 79 HA -0.0010 -0.0072 0.0008 826 TYR 79 HB2 -0.0017 -0.0094 -0.0003 827 TYR 79 HB3 -0.0017 -0.0092 0.0013 828 TYR 79 HD1 -0.0017 -0.0099 -0.0017 829 TYR 79 HD2 -0.0018 -0.0093 0.0021 830 TYR 79 HE1 -0.0020 -0.0107 -0.0019 831 TYR 79 HE2 -0.0021 -0.0102 0.0019 832 TYR 79 HH -0.0020 -0.0104 0.0003 833 SER 80 N -0.0005 -0.0064 0.0011 834 SER 80 CA -0.0003 -0.0057 0.0014 835 SER 80 C -0.0004 -0.0058 0.0027 836 SER 80 O -0.0007 -0.0065 0.0033 837 SER 80 CB 0.0001 -0.0046 0.0010 838 SER 80 OG 0.0004 -0.0038 0.0012 839 SER 80 H -0.0004 -0.0061 0.0013 840 SER 80 HA -0.0003 -0.0060 0.0009 841 SER 80 HB2 0.0002 -0.0045 0.0001 842 SER 80 HB3 0.0002 -0.0043 0.0015 843 SER 80 HG 0.0004 -0.0040 0.0005 844 GLN 81 N -0.0001 -0.0053 0.0031 845 GLN 81 CA -0.0001 -0.0053 0.0042 846 GLN 81 C -0.0000 -0.0050 0.0049 847 GLN 81 O 0.0001 -0.0044 0.0045 848 GLN 81 CB 0.0001 -0.0045 0.0044 849 GLN 81 CG 0.0000 -0.0046 0.0056 850 GLN 81 CD 0.0003 -0.0037 0.0059 851 GLN 81 OE1 0.0006 -0.0028 0.0055 852 GLN 81 NE2 0.0002 -0.0040 0.0066 853 GLN 81 H 0.0001 -0.0048 0.0025 854 GLN 81 HA -0.0003 -0.0061 0.0045 855 GLN 81 HB2 0.0001 -0.0046 0.0039 856 GLN 81 HB3 0.0004 -0.0037 0.0043 857 GLN 81 HG2 0.0000 -0.0045 0.0062 858 GLN 81 HG3 -0.0002 -0.0053 0.0057 859 GLN 81 HE21 -0.0001 -0.0047 0.0069 860 GLN 81 HE22 0.0003 -0.0035 0.0068 861 GLU 82 N 0.0001 -0.0057 0.0057 862 GLU 82 CA 0.0002 -0.0058 0.0066 863 GLU 82 C -0.0002 -0.0065 0.0065 864 GLU 82 O -0.0002 -0.0067 0.0072 865 GLU 82 CB 0.0007 -0.0050 0.0067 866 GLU 82 CG 0.0009 -0.0050 0.0075 867 GLU 82 CD 0.0014 -0.0042 0.0076 868 GLU 82 OE1 0.0015 -0.0040 0.0071 869 GLU 82 OE2 0.0018 -0.0038 0.0082 870 GLU 82 H -0.0000 -0.0060 0.0058 871 GLU 82 HA 0.0002 -0.0060 0.0071 872 GLU 82 HB2 0.0010 -0.0046 0.0068 873 GLU 82 HB3 0.0007 -0.0049 0.0061 874 GLU 82 HG2 0.0006 -0.0054 0.0075 875 GLU 82 HG3 0.0009 -0.0052 0.0082 876 GLU 83 N -0.0008 -0.0059 0.0062 877 GLU 83 CA -0.0011 -0.0066 0.0059 878 GLU 83 C -0.0016 -0.0076 0.0057 879 GLU 83 O -0.0019 -0.0083 0.0063 880 GLU 83 CB -0.0010 -0.0063 0.0050 881 GLU 83 CG -0.0013 -0.0071 0.0047 882 GLU 83 CD -0.0011 -0.0067 0.0038 883 GLU 83 OE1 -0.0011 -0.0067 0.0029 884 GLU 83 OE2 -0.0010 -0.0064 0.0041 885 GLU 83 H -0.0007 -0.0058 0.0057 886 GLU 83 HA -0.0012 -0.0067 0.0066 887 GLU 83 HB2 -0.0007 -0.0057 0.0052 888 GLU 83 HB3 -0.0009 -0.0062 0.0043 889 GLU 83 HG2 -0.0016 -0.0077 0.0044 890 GLU 83 HG3 -0.0014 -0.0072 0.0054 891 ALA 84 N -0.0013 -0.0076 0.0047 892 ALA 84 CA -0.0017 -0.0085 0.0044 893 ALA 84 C -0.0018 -0.0085 0.0048 894 ALA 84 O -0.0021 -0.0091 0.0044 895 ALA 84 CB -0.0017 -0.0087 0.0033 896 ALA 84 H -0.0009 -0.0071 0.0042 897 ALA 84 HA -0.0021 -0.0090 0.0048 898 ALA 84 HB1 -0.0020 -0.0094 0.0031 899 ALA 84 HB2 -0.0013 -0.0082 0.0029 900 ALA 84 HB3 -0.0017 -0.0088 0.0030 901 GLU 85 N -0.0015 -0.0077 0.0055 902 GLU 85 CA -0.0015 -0.0076 0.0059 903 GLU 85 C -0.0013 -0.0071 0.0065 904 GLU 85 O -0.0010 -0.0066 0.0064 905 GLU 85 CB -0.0013 -0.0073 0.0054 906 GLU 85 CG -0.0013 -0.0072 0.0056 907 GLU 85 CD -0.0010 -0.0067 0.0062 908 GLU 85 OE1 -0.0007 -0.0062 0.0061 909 GLU 85 OE2 -0.0012 -0.0069 0.0069 910 GLU 85 H -0.0014 -0.0075 0.0057 911 GLU 85 HA -0.0017 -0.0080 0.0061 912 GLU 85 HB2 -0.0014 -0.0075 0.0049 913 GLU 85 HB3 -0.0010 -0.0068 0.0053 914 GLU 85 HG2 -0.0015 -0.0077 0.0059 915 GLU 85 HG3 -0.0012 -0.0072 0.0052 916 ARG 86 N -0.0026 -0.0063 0.0050 917 ARG 86 CA -0.0012 -0.0072 0.0061 918 ARG 86 C -0.0011 -0.0071 0.0043 919 ARG 86 O -0.0028 -0.0059 0.0028 920 ARG 86 CB -0.0021 -0.0070 0.0093 921 ARG 86 CG -0.0049 -0.0054 0.0099 922 ARG 86 CD -0.0062 -0.0045 0.0084 923 ARG 86 NE -0.0089 -0.0030 0.0089 924 ARG 86 CZ -0.0106 -0.0019 0.0074 925 ARG 86 NH1 -0.0098 -0.0021 0.0054 926 ARG 86 NH2 -0.0129 -0.0006 0.0080 927 ARG 86 H -0.0044 -0.0052 0.0045 928 ARG 86 HA 0.0007 -0.0083 0.0062 929 ARG 86 HB2 -0.0013 -0.0075 0.0099 930 ARG 86 HB3 -0.0013 -0.0075 0.0106 931 ARG 86 HG2 -0.0052 -0.0054 0.0122 932 ARG 86 HG3 -0.0057 -0.0049 0.0093 933 ARG 86 HD2 -0.0057 -0.0046 0.0061 934 ARG 86 HD3 -0.0055 -0.0050 0.0092 935 ARG 86 HE -0.0095 -0.0028 0.0104 936 ARG 86 HH11 -0.0081 -0.0031 0.0049 937 ARG 86 HH12 -0.0111 -0.0013 0.0043 938 ARG 86 HH21 -0.0136 -0.0004 0.0095 939 ARG 86 HH22 -0.0143 0.0003 0.0070 940 ALA 87 N 0.0002 -0.0076 0.0050 941 ALA 87 CA 0.0025 -0.0077 0.0031 942 ALA 87 C 0.0030 -0.0095 0.0035 943 ALA 87 O 0.0049 -0.0110 0.0026 944 ALA 87 CB 0.0041 -0.0089 0.0022 945 ALA 87 H 0.0000 -0.0091 0.0060 946 ALA 87 HA 0.0025 -0.0057 0.0020 947 ALA 87 HB1 0.0040 -0.0109 0.0033 948 ALA 87 HB2 0.0037 -0.0077 0.0020 949 ALA 87 HB3 0.0058 -0.0091 0.0008 950 ALA 88 N 0.0004 -0.0082 0.0066 951 ALA 88 CA -0.0004 -0.0082 0.0099 952 ALA 88 C -0.0045 -0.0053 0.0097 953 ALA 88 O -0.0072 -0.0038 0.0123 954 ALA 88 CB 0.0002 -0.0095 0.0148 955 ALA 88 H -0.0015 -0.0068 0.0065 956 ALA 88 HA 0.0015 -0.0094 0.0090 957 ALA 88 HB1 -0.0018 -0.0083 0.0158 958 ALA 88 HB2 0.0031 -0.0116 0.0148 959 ALA 88 HB3 -0.0004 -0.0096 0.0172 960 GLY 89 N -0.0031 -0.0069 0.0123 961 GLY 89 CA -0.0143 -0.0034 0.0117 962 GLY 89 C -0.0093 -0.0031 0.0070 963 GLY 89 O -0.0010 -0.0079 0.0131 964 GLY 89 H 0.0058 -0.0076 0.0074 965 GLY 89 HA2 -0.0196 -0.0057 0.0215 966 GLY 89 HA3 -0.0211 0.0012 0.0050 967 MET 90 N -0.0310 0.0060 -0.0078 968 MET 90 CA -0.0179 0.0100 -0.0227 969 MET 90 C -0.0276 0.0001 0.0025 970 MET 90 O -0.0077 -0.0161 0.0249 971 MET 90 CB 0.0240 0.0055 -0.0355 972 MET 90 CG 0.0396 0.0127 -0.0580 973 MET 90 SD 0.0363 0.0035 -0.0377 974 MET 90 CE 0.0599 0.0135 -0.0704 975 MET 90 H -0.0495 0.0164 -0.0191 976 MET 90 HA -0.0332 0.0246 -0.0442 977 MET 90 HB2 0.0297 0.0113 -0.0501 978 MET 90 HB3 0.0389 -0.0093 -0.0134 979 MET 90 HG2 0.0247 0.0274 -0.0801 980 MET 90 HG3 0.0682 0.0095 -0.0665 981 MET 90 HE1 0.0459 0.0283 -0.0930 982 MET 90 HE2 0.0603 0.0091 -0.0617 983 MET 90 HE3 0.0878 0.0093 -0.0763 984 GLY 91 N -0.0687 0.0062 0.0019 985 GLY 91 CA -0.0840 -0.0034 0.0287 986 GLY 91 C -0.0917 0.0100 0.0041 987 GLY 91 O -0.1294 0.0193 0.0012 988 GLY 91 H -0.0873 0.0204 -0.0196 989 GLY 91 HA2 -0.0594 -0.0187 0.0498 990 GLY 91 HA3 -0.1149 -0.0049 0.0454 991 SER 92 N -0.0536 0.0118 -0.0134 992 SER 92 CA -0.0527 0.0273 -0.0405 993 SER 92 C -0.0270 0.0115 -0.0264 994 SER 92 O 0.0126 -0.0022 -0.0229 995 SER 92 CB -0.0328 0.0455 -0.0820 996 SER 92 OG -0.0576 0.0600 -0.0942 997 SER 92 H -0.0254 0.0016 -0.0101 998 SER 92 HA -0.0865 0.0378 -0.0415 999 SER 92 HB2 0.0010 0.0352 -0.0815 1000 SER 92 HB3 -0.0337 0.0580 -0.1029 1001 SER 92 HG -0.0768 0.0519 -0.0706 1002 TYR 93 N -0.0567 0.0181 -0.0183 1003 TYR 93 CA -0.0293 -0.0003 -0.0058 1004 TYR 93 C -0.0353 0.0322 -0.0573 1005 TYR 93 O -0.0734 0.0667 -0.0902 1006 TYR 93 CB -0.0671 -0.0199 0.0539 1007 TYR 93 CG -0.0383 -0.0453 0.0776 1008 TYR 93 CD1 0.0067 -0.0844 0.1137 1009 TYR 93 CD2 -0.0559 -0.0304 0.0642 1010 TYR 93 CE1 0.0335 -0.1079 0.1355 1011 TYR 93 CE2 -0.0292 -0.0538 0.0859 1012 TYR 93 CZ 0.0152 -0.0924 0.1214 1013 TYR 93 OH 0.0422 -0.1157 0.1428 1014 TYR 93 H -0.1028 0.0364 -0.0179 1015 TYR 93 HA 0.0201 -0.0219 -0.0029 1016 TYR 93 HB2 -0.0702 -0.0382 0.0874 1017 TYR 93 HB3 -0.1147 0.0027 0.0481 1018 TYR 93 HD1 0.0208 -0.0965 0.1247 1019 TYR 93 HD2 -0.0909 0.0001 0.0361 1020 TYR 93 HE1 0.0686 -0.1384 0.1635 1021 TYR 93 HE2 -0.0434 -0.0417 0.0750 1022 TYR 93 HH 0.0563 -0.1018 0.1092 1023 VAL 94 N 0.0023 0.0222 -0.0690 1024 VAL 94 CA -0.0014 0.0529 -0.1193 1025 VAL 94 C -0.0702 0.0786 -0.1108 1026 VAL 94 O -0.0887 0.0615 -0.0668 1027 VAL 94 CB 0.0559 0.0335 -0.1302 1028 VAL 94 CG1 0.0580 -0.0011 -0.0717 1029 VAL 94 CG2 0.0515 0.0671 -0.1850 1030 VAL 94 H 0.0345 -0.0073 -0.0426 1031 VAL 94 HA 0.0034 0.0746 -0.1608 1032 VAL 94 HB 0.1017 0.0199 -0.1419 1033 VAL 94 HG11 0.0982 -0.0133 -0.0816 1034 VAL 94 HG12 0.0120 0.0112 -0.0574 1035 VAL 94 HG13 0.0653 -0.0256 -0.0347 1036 VAL 94 HG21 0.0049 0.0824 -0.1754 1037 VAL 94 HG22 0.0912 0.0530 -0.1913 1038 VAL 94 HG23 0.0552 0.0897 -0.2270