1 PRO 19 N 0.0299 0.0307 -0.0045 2 PRO 19 CA 0.0237 0.0243 -0.0062 3 PRO 19 C 0.0218 0.0183 0.0035 4 PRO 19 O 0.0197 0.0157 0.0042 5 PRO 19 CB 0.0250 0.0282 -0.0126 6 PRO 19 CG 0.0306 0.0363 -0.0171 7 PRO 19 CD 0.0350 0.0381 -0.0084 8 ARG 20 N 0.0117 0.0165 0.0024 9 ARG 20 CA 0.0092 0.0156 0.0074 10 ARG 20 C 0.0084 0.0116 0.0050 11 ARG 20 O 0.0076 0.0065 0.0016 12 ARG 20 CB 0.0057 0.0130 0.0129 13 ARG 20 CG 0.0036 0.0065 0.0111 14 ARG 20 CD 0.0033 0.0064 0.0117 15 ARG 20 NE 0.0017 0.0003 0.0090 16 ARG 20 CZ 0.0034 -0.0018 0.0028 17 ARG 20 NH1 0.0069 0.0017 -0.0017 18 ARG 20 NH2 0.0016 -0.0075 0.0010 19 THR 21 N 0.0103 0.0021 -0.0006 20 THR 21 CA 0.0096 0.0015 -0.0004 21 THR 21 C 0.0108 0.0008 -0.0007 22 THR 21 O 0.0118 0.0002 -0.0009 23 THR 21 CB 0.0086 0.0004 -0.0003 24 THR 21 OG1 0.0075 0.0011 -0.0000 25 THR 21 CG2 0.0079 -0.0006 -0.0002 26 VAL 22 N 0.0083 0.0002 -0.0044 27 VAL 22 CA 0.0081 -0.0003 -0.0037 28 VAL 22 C 0.0062 -0.0010 -0.0023 29 VAL 22 O 0.0049 -0.0009 -0.0023 30 VAL 22 CB 0.0077 0.0007 -0.0051 31 VAL 22 CG1 0.0094 0.0014 -0.0065 32 VAL 22 CG2 0.0055 0.0015 -0.0058 33 MET 23 N 0.0105 -0.0028 -0.0054 34 MET 23 CA 0.0081 -0.0035 -0.0029 35 MET 23 C 0.0054 -0.0025 -0.0039 36 MET 23 O 0.0062 -0.0020 -0.0052 37 MET 23 CB 0.0099 -0.0050 -0.0003 38 MET 23 CG 0.0078 -0.0060 0.0027 39 MET 23 SD 0.0102 -0.0079 0.0059 40 MET 23 CE 0.0116 -0.0079 0.0053 41 VAL 24 N 0.0024 -0.0023 -0.0017 42 VAL 24 CA 0.0007 -0.0013 -0.0023 43 VAL 24 C -0.0004 -0.0009 -0.0006 44 VAL 24 O -0.0005 -0.0011 0.0007 45 VAL 24 CB 0.0001 -0.0008 -0.0033 46 VAL 24 CG1 -0.0016 0.0002 -0.0040 47 VAL 24 CG2 0.0012 -0.0013 -0.0049 48 ASN 25 N -0.0008 -0.0012 -0.0030 49 ASN 25 CA -0.0013 0.0019 -0.0017 50 ASN 25 C -0.0018 0.0050 -0.0006 51 ASN 25 O -0.0021 0.0063 -0.0030 52 ASN 25 CB -0.0015 0.0031 -0.0047 53 ASN 25 CG -0.0020 0.0062 -0.0036 54 ASN 25 OD1 -0.0022 0.0074 -0.0004 55 ASN 25 ND2 -0.0023 0.0076 -0.0063 56 LEU 26 N -0.0034 0.0061 0.0016 57 LEU 26 CA -0.0043 0.0082 0.0022 58 LEU 26 C -0.0049 0.0100 0.0020 59 LEU 26 O -0.0057 0.0118 0.0026 60 LEU 26 CB -0.0051 0.0078 0.0045 61 LEU 26 CG -0.0047 0.0062 0.0049 62 LEU 26 CD1 -0.0057 0.0061 0.0073 63 LEU 26 CD2 -0.0043 0.0068 0.0034 64 ASN 27 N -0.0032 0.0167 0.0041 65 ASN 27 CA -0.0039 0.0235 0.0021 66 ASN 27 C -0.0040 0.0262 -0.0041 67 ASN 27 O -0.0036 0.0240 -0.0100 68 ASN 27 CB -0.0038 0.0231 0.0006 69 ASN 27 CG -0.0041 0.0248 0.0070 70 ASN 27 OD1 -0.0048 0.0298 0.0106 71 ASN 27 ND2 -0.0038 0.0208 0.0085 72 ILE 28 N 0.0076 0.0303 -0.0059 73 ILE 28 CA 0.0047 0.0271 -0.0071 74 ILE 28 C 0.0002 0.0309 -0.0104 75 ILE 28 O 0.0011 0.0366 -0.0108 76 ILE 28 CB 0.0088 0.0251 -0.0043 77 ILE 28 CG1 0.0122 0.0199 -0.0014 78 ILE 28 CG2 0.0063 0.0230 -0.0054 79 ILE 28 CD1 0.0174 0.0187 0.0019 80 HIS 29 N 0.0035 0.0349 -0.0149 81 HIS 29 CA -0.0075 0.0373 -0.0189 82 HIS 29 C -0.0037 0.0501 -0.0237 83 HIS 29 O -0.0106 0.0599 -0.0300 84 HIS 29 CB -0.0108 0.0241 -0.0137 85 HIS 29 CG -0.0049 0.0235 -0.0119 86 HIS 29 ND1 0.0096 0.0250 -0.0088 87 HIS 29 CD2 -0.0119 0.0215 -0.0128 88 HIS 29 CE1 0.0108 0.0239 -0.0080 89 HIS 29 NE2 -0.0018 0.0218 -0.0104 90 SER 40 N 0.0373 -0.0320 -0.0156 91 SER 40 CA 0.0338 -0.0287 -0.0144 92 SER 40 C 0.0233 -0.0304 -0.0129 93 SER 40 O 0.0189 -0.0255 -0.0113 94 SER 40 CB 0.0391 -0.0320 -0.0159 95 SER 40 OG 0.0383 -0.0415 -0.0173 96 SER 41 N 0.0326 -0.0272 -0.0026 97 SER 41 CA 0.0226 -0.0300 -0.0061 98 SER 41 C 0.0194 -0.0236 0.0066 99 SER 41 O 0.0070 -0.0246 0.0067 100 SER 41 CB 0.0320 -0.0358 -0.0188 101 SER 41 OG 0.0350 -0.0419 -0.0311 102 ASP 42 N 0.0176 -0.0103 0.0073 103 ASP 42 CA 0.0136 -0.0053 0.0087 104 ASP 42 C 0.0156 -0.0051 0.0035 105 ASP 42 O 0.0125 -0.0009 0.0039 106 ASP 42 CB 0.0089 0.0020 0.0077 107 ASP 42 CG 0.0099 0.0053 -0.0003 108 ASP 42 OD1 0.0143 0.0017 -0.0051 109 ASP 42 OD2 0.0060 0.0116 -0.0016 110 TYR 43 N 0.0142 -0.0080 -0.0052 111 TYR 43 CA 0.0143 -0.0069 -0.0052 112 TYR 43 C 0.0126 -0.0067 -0.0038 113 TYR 43 O 0.0124 -0.0051 -0.0036 114 TYR 43 CB 0.0154 -0.0081 -0.0062 115 TYR 43 CG 0.0172 -0.0082 -0.0077 116 TYR 43 CD1 0.0181 -0.0068 -0.0082 117 TYR 43 CD2 0.0182 -0.0097 -0.0085 118 TYR 43 CE1 0.0198 -0.0069 -0.0096 119 TYR 43 CE2 0.0199 -0.0099 -0.0099 120 TYR 43 CZ 0.0207 -0.0085 -0.0105 121 TYR 43 OH 0.0223 -0.0086 -0.0118 122 TYR 44 N 0.0163 -0.0061 0.0046 123 TYR 44 CA 0.0155 -0.0066 0.0069 124 TYR 44 C 0.0127 -0.0032 0.0076 125 TYR 44 O 0.0121 -0.0030 0.0084 126 TYR 44 CB 0.0158 -0.0093 0.0107 127 TYR 44 CG 0.0136 -0.0083 0.0137 128 TYR 44 CD1 0.0114 -0.0073 0.0167 129 TYR 44 CD2 0.0137 -0.0082 0.0134 130 TYR 44 CE1 0.0093 -0.0061 0.0193 131 TYR 44 CE2 0.0116 -0.0071 0.0161 132 TYR 44 CZ 0.0094 -0.0060 0.0190 133 TYR 44 OH 0.0073 -0.0048 0.0216 134 ASN 45 N 0.0134 -0.0046 0.0091 135 ASN 45 CA 0.0104 -0.0018 0.0094 136 ASN 45 C 0.0077 -0.0018 0.0037 137 ASN 45 O 0.0075 -0.0021 0.0024 138 ASN 45 CB 0.0074 0.0025 0.0129 139 ASN 45 CG 0.0081 0.0041 0.0183 140 ASN 45 OD1 0.0109 0.0022 0.0197 141 ASN 45 ND2 0.0057 0.0078 0.0214 142 ARG 46 N 0.0102 -0.0045 -0.0055 143 ARG 46 CA 0.0087 -0.0031 -0.0098 144 ARG 46 C 0.0105 -0.0058 -0.0132 145 ARG 46 O 0.0093 -0.0047 -0.0168 146 ARG 46 CB 0.0072 -0.0016 -0.0118 147 ARG 46 CG 0.0046 0.0020 -0.0096 148 ARG 46 CD 0.0027 0.0040 -0.0123 149 ARG 46 NE 0.0041 0.0022 -0.0127 150 ARG 46 CZ 0.0050 0.0008 -0.0163 151 ARG 46 NH1 0.0046 0.0007 -0.0203 152 ARG 46 NH2 0.0061 -0.0006 -0.0156 153 SER 47 N 0.0051 -0.0097 -0.0072 154 SER 47 CA 0.0053 -0.0095 -0.0075 155 SER 47 C 0.0049 -0.0088 -0.0074 156 SER 47 O 0.0043 -0.0087 -0.0070 157 SER 47 CB 0.0055 -0.0101 -0.0073 158 SER 47 OG 0.0057 -0.0099 -0.0075 159 THR 48 N -0.0016 -0.0113 -0.0042 160 THR 48 CA -0.0018 -0.0110 -0.0028 161 THR 48 C -0.0017 -0.0137 -0.0004 162 THR 48 O -0.0020 -0.0134 0.0017 163 THR 48 CB -0.0015 -0.0110 -0.0054 164 THR 48 OG1 -0.0010 -0.0139 -0.0072 165 THR 48 CG2 -0.0016 -0.0083 -0.0079 166 SER 49 N 0.0013 -0.0058 0.0014 167 SER 49 CA 0.0032 -0.0063 0.0021 168 SER 49 C 0.0037 -0.0047 0.0036 169 SER 49 O 0.0040 -0.0045 0.0039 170 SER 49 CB 0.0035 -0.0076 0.0012 171 SER 49 OG 0.0024 -0.0069 0.0011 172 PRO 50 N 0.0064 -0.0037 0.0087 173 PRO 50 CA 0.0066 -0.0024 0.0104 174 PRO 50 C 0.0085 -0.0030 0.0118 175 PRO 50 O 0.0097 -0.0043 0.0116 176 PRO 50 CB 0.0057 -0.0010 0.0112 177 PRO 50 CG 0.0061 -0.0020 0.0104 178 PRO 50 CD 0.0059 -0.0034 0.0085 179 TRP 51 N 0.0130 0.0002 0.0100 180 TRP 51 CA 0.0145 -0.0010 0.0118 181 TRP 51 C 0.0150 0.0013 0.0137 182 TRP 51 O 0.0140 0.0039 0.0135 183 TRP 51 CB 0.0142 -0.0031 0.0103 184 TRP 51 CG 0.0128 -0.0019 0.0088 185 TRP 51 CD1 0.0130 -0.0009 0.0095 186 TRP 51 CD2 0.0110 -0.0016 0.0061 187 TRP 51 NE1 0.0114 -0.0001 0.0075 188 TRP 51 CE2 0.0102 -0.0005 0.0053 189 TRP 51 CE3 0.0100 -0.0023 0.0042 190 TRP 51 CZ2 0.0084 -0.0000 0.0029 191 TRP 51 CZ3 0.0082 -0.0018 0.0017 192 TRP 51 CH2 0.0075 -0.0006 0.0011 193 ASN 52 N 0.0208 0.0053 0.0176 194 ASN 52 CA 0.0217 0.0074 0.0190 195 ASN 52 C 0.0220 0.0068 0.0191 196 ASN 52 O 0.0226 0.0046 0.0189 197 ASN 52 CB 0.0238 0.0074 0.0208 198 ASN 52 CG 0.0237 0.0076 0.0208 199 ASN 52 OD1 0.0223 0.0090 0.0201 200 ASN 52 ND2 0.0252 0.0062 0.0216 201 LEU 53 N 0.0291 0.0141 0.0133 202 LEU 53 CA 0.0254 0.0125 0.0106 203 LEU 53 C 0.0258 0.0118 0.0126 204 LEU 53 O 0.0295 0.0140 0.0142 205 LEU 53 CB 0.0251 0.0149 0.0048 206 LEU 53 CG 0.0243 0.0153 0.0024 207 LEU 53 CD1 0.0248 0.0181 -0.0031 208 LEU 53 CD2 0.0197 0.0117 0.0027 209 HIS 54 N 0.0196 0.0079 0.0079 210 HIS 54 CA 0.0166 0.0061 0.0090 211 HIS 54 C 0.0111 0.0038 0.0020 212 HIS 54 O 0.0062 0.0013 0.0006 213 HIS 54 CB 0.0133 0.0035 0.0173 214 HIS 54 CG 0.0095 0.0012 0.0189 215 HIS 54 ND1 0.0022 -0.0026 0.0172 216 HIS 54 CD2 0.0119 0.0022 0.0220 217 HIS 54 CE1 0.0006 -0.0037 0.0191 218 HIS 54 NE2 0.0062 -0.0009 0.0221 219 ARG 55 N 0.0035 -0.0016 -0.0069 220 ARG 55 CA 0.0027 -0.0069 -0.0095 221 ARG 55 C -0.0040 -0.0067 -0.0093 222 ARG 55 O -0.0090 -0.0077 -0.0097 223 ARG 55 CB 0.0031 -0.0123 -0.0120 224 ARG 55 CG 0.0029 -0.0184 -0.0149 225 ARG 55 CD 0.0032 -0.0235 -0.0174 226 ARG 55 NE -0.0007 -0.0287 -0.0198 227 ARG 55 CZ -0.0073 -0.0291 -0.0199 228 ARG 55 NH1 -0.0112 -0.0245 -0.0177 229 ARG 55 NH2 -0.0102 -0.0342 -0.0223 230 ASN 56 N -0.0049 -0.0128 -0.0103 231 ASN 56 CA -0.0050 -0.0137 -0.0098 232 ASN 56 C -0.0051 -0.0140 -0.0103 233 ASN 56 O -0.0052 -0.0140 -0.0112 234 ASN 56 CB -0.0052 -0.0145 -0.0100 235 ASN 56 CG -0.0054 -0.0155 -0.0100 236 ASN 56 OD1 -0.0055 -0.0160 -0.0108 237 ASN 56 ND2 -0.0054 -0.0159 -0.0093 238 GLU 57 N -0.0006 -0.0168 -0.0170 239 GLU 57 CA 0.0011 -0.0125 -0.0124 240 GLU 57 C 0.0067 -0.0085 -0.0140 241 GLU 57 O 0.0094 -0.0092 -0.0191 242 GLU 57 CB -0.0001 -0.0127 -0.0110 243 GLU 57 CG 0.0013 -0.0084 -0.0059 244 GLU 57 CD -0.0013 -0.0094 -0.0037 245 GLU 57 OE1 -0.0048 -0.0096 0.0010 246 GLU 57 OE2 -0.0004 -0.0106 -0.0071 247 ASP 58 N 0.0163 -0.0067 -0.0016 248 ASP 58 CA 0.0206 -0.0052 -0.0016 249 ASP 58 C 0.0188 0.0024 0.0019 250 ASP 58 O 0.0124 0.0034 0.0032 251 ASP 58 CB 0.0184 -0.0108 -0.0036 252 ASP 58 CG 0.0220 -0.0098 -0.0037 253 ASP 58 OD1 0.0261 -0.0045 -0.0020 254 ASP 58 OD2 0.0201 -0.0145 -0.0054 255 PRO 59 N 0.0385 0.0155 0.0100 256 PRO 59 CA 0.0344 0.0309 0.0140 257 PRO 59 C 0.0320 0.0253 0.0104 258 PRO 59 O 0.0230 0.0366 0.0102 259 PRO 59 CB 0.0496 0.0419 0.0264 260 PRO 59 CG 0.0650 0.0276 0.0288 261 PRO 59 CD 0.0561 0.0145 0.0188 262 GLU 60 N 0.0246 0.0209 0.0147 263 GLU 60 CA 0.0172 0.0152 0.0117 264 GLU 60 C 0.0138 0.0131 0.0093 265 GLU 60 O 0.0077 0.0077 0.0082 266 GLU 60 CB 0.0150 0.0093 0.0182 267 GLU 60 CG 0.0173 0.0110 0.0194 268 GLU 60 CD 0.0139 0.0118 0.0118 269 GLU 60 OE1 0.0077 0.0078 0.0079 270 GLU 60 OE2 0.0174 0.0168 0.0092 271 ARG 61 N 0.0088 0.0089 0.0025 272 ARG 61 CA 0.0036 0.0063 0.0017 273 ARG 61 C -0.0016 0.0094 0.0040 274 ARG 61 O -0.0017 0.0115 0.0052 275 ARG 61 CB 0.0030 0.0010 -0.0013 276 ARG 61 CG -0.0016 -0.0027 -0.0028 277 ARG 61 CD -0.0016 -0.0080 -0.0058 278 ARG 61 NE -0.0030 -0.0081 -0.0057 279 ARG 61 CZ -0.0018 -0.0117 -0.0079 280 ARG 61 NH1 0.0007 -0.0159 -0.0105 281 ARG 61 NH2 -0.0032 -0.0112 -0.0074 282 TYR 62 N -0.0056 0.0070 0.0007 283 TYR 62 CA -0.0071 0.0077 0.0007 284 TYR 62 C -0.0082 0.0066 -0.0002 285 TYR 62 O -0.0082 0.0058 -0.0007 286 TYR 62 CB -0.0076 0.0088 0.0011 287 TYR 62 CG -0.0092 0.0096 0.0011 288 TYR 62 CD1 -0.0093 0.0109 0.0018 289 TYR 62 CD2 -0.0105 0.0090 0.0004 290 TYR 62 CE1 -0.0107 0.0117 0.0019 291 TYR 62 CE2 -0.0120 0.0098 0.0005 292 TYR 62 CZ -0.0121 0.0111 0.0012 293 TYR 62 OH -0.0135 0.0118 0.0012 294 PRO 63 N -0.0116 0.0005 -0.0023 295 PRO 63 CA -0.0114 0.0015 -0.0019 296 PRO 63 C -0.0091 0.0008 -0.0021 297 PRO 63 O -0.0083 -0.0009 -0.0030 298 PRO 63 CB -0.0135 0.0007 -0.0023 299 PRO 63 CG -0.0140 -0.0014 -0.0033 300 PRO 63 CD -0.0133 -0.0010 -0.0032 301 SER 64 N -0.0103 0.0073 0.0037 302 SER 64 CA -0.0030 0.0061 0.0023 303 SER 64 C -0.0057 0.0006 -0.0021 304 SER 64 O -0.0005 -0.0039 -0.0062 305 SER 64 CB 0.0002 0.0131 0.0080 306 SER 64 OG -0.0073 0.0168 0.0114 307 VAL 65 N -0.0045 -0.0081 -0.0115 308 VAL 65 CA -0.0040 -0.0114 -0.0117 309 VAL 65 C -0.0058 -0.0131 -0.0097 310 VAL 65 O -0.0076 -0.0124 -0.0077 311 VAL 65 CB -0.0041 -0.0124 -0.0115 312 VAL 65 CG1 -0.0035 -0.0159 -0.0119 313 VAL 65 CG2 -0.0027 -0.0105 -0.0132 314 ILE 66 N -0.0087 -0.0141 -0.0163 315 ILE 66 CA -0.0083 -0.0140 -0.0143 316 ILE 66 C -0.0063 -0.0141 -0.0130 317 ILE 66 O -0.0062 -0.0141 -0.0127 318 ILE 66 CB -0.0105 -0.0137 -0.0127 319 ILE 66 CG1 -0.0124 -0.0137 -0.0139 320 ILE 66 CG2 -0.0101 -0.0136 -0.0103 321 ILE 66 CD1 -0.0146 -0.0134 -0.0126 322 TRP 67 N 0.0009 -0.0084 -0.0122 323 TRP 67 CA 0.0066 -0.0051 -0.0077 324 TRP 67 C 0.0064 -0.0029 -0.0011 325 TRP 67 O 0.0092 -0.0022 -0.0017 326 TRP 67 CB 0.0139 -0.0042 -0.0121 327 TRP 67 CG 0.0153 -0.0057 -0.0178 328 TRP 67 CD1 0.0141 -0.0084 -0.0248 329 TRP 67 CD2 0.0182 -0.0045 -0.0172 330 TRP 67 NE1 0.0163 -0.0089 -0.0285 331 TRP 67 CE2 0.0190 -0.0066 -0.0242 332 TRP 67 CE3 0.0204 -0.0019 -0.0115 333 TRP 67 CZ2 0.0220 -0.0060 -0.0254 334 TRP 67 CZ3 0.0236 -0.0013 -0.0127 335 TRP 67 CH2 0.0245 -0.0033 -0.0196 336 GLU 68 N 0.0053 0.0002 0.0003 337 GLU 68 CA 0.0052 0.0027 0.0050 338 GLU 68 C 0.0095 0.0054 0.0077 339 GLU 68 O 0.0106 0.0055 0.0075 340 GLU 68 CB -0.0001 0.0028 0.0080 341 GLU 68 CG -0.0047 0.0002 0.0058 342 GLU 68 CD -0.0088 0.0011 0.0097 343 GLU 68 OE1 -0.0131 0.0002 0.0102 344 GLU 68 OE2 -0.0074 0.0027 0.0120 345 ALA 69 N 0.0096 0.0048 0.0096 346 ALA 69 CA 0.0115 0.0056 0.0113 347 ALA 69 C 0.0116 0.0044 0.0144 348 ALA 69 O 0.0097 0.0026 0.0152 349 ALA 69 CB 0.0110 0.0055 0.0105 350 LYS 70 N 0.0166 -0.0003 0.0174 351 LYS 70 CA 0.0191 -0.0047 0.0211 352 LYS 70 C 0.0166 0.0008 0.0176 353 LYS 70 O 0.0158 0.0100 0.0181 354 LYS 70 CB 0.0242 -0.0029 0.0313 355 LYS 70 CG 0.0275 -0.0070 0.0366 356 LYS 70 CD 0.0323 -0.0035 0.0465 357 LYS 70 CE 0.0326 0.0047 0.0490 358 LYS 70 NZ 0.0361 0.0108 0.0571 359 CYS 71 N 0.0118 0.0013 0.0158 360 CYS 71 CA 0.0112 0.0021 0.0151 361 CYS 71 C 0.0130 0.0035 0.0176 362 CYS 71 O 0.0147 0.0023 0.0196 363 CYS 71 CB 0.0105 -0.0008 0.0139 364 CYS 71 SG 0.0089 -0.0033 0.0116 365 ARG 72 N 0.0130 -0.0020 0.0196 366 ARG 72 CA 0.0119 -0.0009 0.0208 367 ARG 72 C 0.0115 0.0000 0.0209 368 ARG 72 O 0.0106 0.0004 0.0221 369 ARG 72 CB 0.0116 0.0004 0.0205 370 ARG 72 CG 0.0119 -0.0004 0.0205 371 ARG 72 CD 0.0116 0.0010 0.0203 372 ARG 72 NE 0.0119 0.0003 0.0201 373 ARG 72 CZ 0.0120 0.0011 0.0196 374 ARG 72 NH1 0.0117 0.0028 0.0191 375 ARG 72 NH2 0.0123 0.0003 0.0195 376 HIS 73 N 0.0068 0.0005 0.0222 377 HIS 73 CA 0.0069 -0.0006 0.0200 378 HIS 73 C 0.0086 -0.0017 0.0186 379 HIS 73 O 0.0091 -0.0015 0.0192 380 HIS 73 CB 0.0042 -0.0006 0.0188 381 HIS 73 CG 0.0023 0.0006 0.0203 382 HIS 73 ND1 0.0025 0.0011 0.0213 383 HIS 73 CD2 0.0003 0.0014 0.0211 384 HIS 73 CE1 0.0005 0.0021 0.0226 385 HIS 73 NE2 -0.0008 0.0024 0.0225 386 LEU 74 N 0.0090 0.0039 0.0212 387 LEU 74 CA 0.0101 -0.0023 0.0171 388 LEU 74 C 0.0052 -0.0028 0.0110 389 LEU 74 O 0.0043 -0.0063 0.0069 390 LEU 74 CB 0.0147 -0.0066 0.0188 391 LEU 74 CG 0.0203 -0.0082 0.0239 392 LEU 74 CD1 0.0208 -0.0039 0.0281 393 LEU 74 CD2 0.0239 -0.0092 0.0271 394 GLY 75 N -0.0006 -0.0048 0.0096 395 GLY 75 CA -0.0018 -0.0045 0.0081 396 GLY 75 C -0.0026 -0.0043 0.0092 397 GLY 75 O -0.0021 -0.0044 0.0110 398 CYS 76 N -0.0056 -0.0062 0.0073 399 CYS 76 CA -0.0069 -0.0063 0.0092 400 CYS 76 C -0.0099 -0.0066 0.0090 401 CYS 76 O -0.0109 -0.0067 0.0070 402 CYS 76 CB -0.0063 -0.0063 0.0085 403 CYS 76 SG -0.0029 -0.0060 0.0087 404 ILE 77 N -0.0109 -0.0099 0.0070 405 ILE 77 CA -0.0133 -0.0083 0.0072 406 ILE 77 C -0.0158 -0.0086 0.0046 407 ILE 77 O -0.0165 -0.0088 0.0038 408 ILE 77 CB -0.0142 -0.0059 0.0097 409 ILE 77 CG1 -0.0117 -0.0055 0.0124 410 ILE 77 CG2 -0.0168 -0.0041 0.0100 411 ILE 77 CD1 -0.0104 -0.0060 0.0129 412 ASN 78 N -0.0317 -0.0181 0.0078 413 ASN 78 CA -0.0324 -0.0179 0.0067 414 ASN 78 C -0.0297 -0.0113 0.0033 415 ASN 78 O -0.0276 -0.0071 0.0016 416 ASN 78 CB -0.0306 -0.0216 0.0127 417 ASN 78 CG -0.0245 -0.0192 0.0177 418 ASN 78 OD1 -0.0211 -0.0141 0.0167 419 ASN 78 ND2 -0.0232 -0.0228 0.0230 420 ALA 79 N -0.0532 -0.0140 -0.0155 421 ALA 79 CA -0.0587 0.0017 -0.0198 422 ALA 79 C -0.0369 0.0113 -0.0145 423 ALA 79 O -0.0373 0.0309 -0.0179 424 ALA 79 CB -0.0757 -0.0124 -0.0229 425 ASP 80 N 0.0090 -0.0078 0.0219 426 ASP 80 CA 0.0319 -0.0055 0.0236 427 ASP 80 C 0.0297 -0.0008 0.0020 428 ASP 80 O 0.0489 0.0023 -0.0017 429 ASP 80 CB 0.0350 -0.0115 0.0514 430 ASP 80 CG 0.0344 -0.0170 0.0753 431 ASP 80 OD1 0.0233 -0.0230 0.0957 432 ASP 80 OD2 0.0467 -0.0153 0.0739 433 GLY 81 N -0.0123 -0.0041 0.0005 434 GLY 81 CA -0.0199 -0.0154 0.0008 435 GLY 81 C -0.0320 -0.0171 0.0095 436 GLY 81 O -0.0394 -0.0253 0.0112 437 ASN 82 N -0.0328 -0.0170 0.0144 438 ASN 82 CA -0.0393 -0.0137 0.0143 439 ASN 82 C -0.0336 -0.0145 0.0138 440 ASN 82 O -0.0244 -0.0141 0.0125 441 ASN 82 CB -0.0429 -0.0030 0.0119 442 ASN 82 CG -0.0500 -0.0013 0.0124 443 ASN 82 OD1 -0.0503 0.0066 0.0103 444 ASN 82 ND2 -0.0561 -0.0083 0.0151 445 VAL 83 N -0.0211 -0.0130 0.0098 446 VAL 83 CA -0.0171 -0.0115 0.0093 447 VAL 83 C -0.0167 -0.0131 0.0050 448 VAL 83 O -0.0164 -0.0145 0.0015 449 VAL 83 CB -0.0129 -0.0098 0.0091 450 VAL 83 CG1 -0.0086 -0.0081 0.0087 451 VAL 83 CG2 -0.0131 -0.0082 0.0131 452 ASP 84 N -0.0151 -0.0147 0.0039 453 ASP 84 CA -0.0149 -0.0147 0.0032 454 ASP 84 C -0.0119 -0.0081 0.0025 455 ASP 84 O -0.0111 -0.0038 0.0061 456 ASP 84 CB -0.0175 -0.0172 0.0091 457 ASP 84 CG -0.0180 -0.0191 0.0082 458 ASP 84 OD1 -0.0159 -0.0164 0.0045 459 ASP 84 OD2 -0.0206 -0.0230 0.0117 460 TYR 85 N -0.0138 -0.0071 0.0028 461 TYR 85 CA -0.0096 -0.0041 0.0015 462 TYR 85 C -0.0084 -0.0032 0.0008 463 TYR 85 O -0.0049 -0.0006 -0.0002 464 TYR 85 CB -0.0083 -0.0040 -0.0030 465 TYR 85 CG -0.0085 -0.0040 -0.0020 466 TYR 85 CD1 -0.0056 -0.0011 0.0001 467 TYR 85 CD2 -0.0117 -0.0068 -0.0031 468 TYR 85 CE1 -0.0058 -0.0011 0.0009 469 TYR 85 CE2 -0.0119 -0.0068 -0.0022 470 TYR 85 CZ -0.0089 -0.0039 -0.0003 471 TYR 85 OH -0.0090 -0.0038 0.0004 472 HIS 86 N -0.0165 -0.0037 0.0028 473 HIS 86 CA -0.0085 0.0035 0.0056 474 HIS 86 C -0.0019 -0.0022 0.0062 475 HIS 86 O 0.0032 0.0035 0.0081 476 HIS 86 CB -0.0007 0.0080 0.0079 477 HIS 86 CG -0.0058 0.0148 0.0078 478 HIS 86 ND1 -0.0076 0.0107 0.0068 479 HIS 86 CD2 -0.0092 0.0257 0.0087 480 HIS 86 CE1 -0.0119 0.0188 0.0071 481 HIS 86 NE2 -0.0131 0.0282 0.0082 482 MET 87 N -0.0023 -0.0025 0.0071 483 MET 87 CA -0.0024 -0.0023 0.0073 484 MET 87 C -0.0027 -0.0020 0.0065 485 MET 87 O -0.0027 -0.0022 0.0059 486 MET 87 CB -0.0021 -0.0029 0.0077 487 MET 87 CG -0.0018 -0.0033 0.0084 488 MET 87 SD -0.0019 -0.0025 0.0093 489 MET 87 CE -0.0018 -0.0025 0.0097 490 ASN 88 N -0.0004 -0.0019 0.0076 491 ASN 88 CA -0.0007 -0.0011 0.0063 492 ASN 88 C -0.0007 -0.0010 0.0060 493 ASN 88 O -0.0010 -0.0007 0.0069 494 ASN 88 CB -0.0015 0.0001 0.0063 495 ASN 88 CG -0.0016 0.0002 0.0065 496 ASN 88 OD1 -0.0022 0.0011 0.0071 497 ASN 88 ND2 -0.0010 -0.0006 0.0060 498 SER 89 N 0.0022 -0.0033 0.0072 499 SER 89 CA 0.0022 -0.0025 0.0076 500 SER 89 C 0.0025 -0.0014 0.0075 501 SER 89 O 0.0031 -0.0012 0.0068 502 SER 89 CB 0.0025 -0.0026 0.0071 503 SER 89 OG 0.0021 -0.0034 0.0074 504 VAL 90 N -0.0008 0.0060 0.0042 505 VAL 90 CA -0.0009 0.0074 0.0040 506 VAL 90 C -0.0011 0.0080 0.0043 507 VAL 90 O -0.0013 0.0076 0.0051 508 VAL 90 CB -0.0013 0.0078 0.0048 509 VAL 90 CG1 -0.0010 0.0073 0.0045 510 VAL 90 CG2 -0.0017 0.0075 0.0061 511 PRO 91 N 0.0009 0.0111 0.0097 512 PRO 91 CA -0.0000 0.0133 0.0089 513 PRO 91 C -0.0027 0.0129 0.0082 514 PRO 91 O -0.0033 0.0109 0.0084 515 PRO 91 CB 0.0018 0.0139 0.0094 516 PRO 91 CG 0.0027 0.0114 0.0102 517 PRO 91 CD 0.0028 0.0100 0.0105 518 ILE 92 N -0.0021 0.0137 0.0057 519 ILE 92 CA -0.0021 0.0134 0.0053 520 ILE 92 C -0.0020 0.0129 0.0056 521 ILE 92 O -0.0020 0.0131 0.0058 522 ILE 92 CB -0.0022 0.0137 0.0049 523 ILE 92 CG1 -0.0023 0.0142 0.0046 524 ILE 92 CG2 -0.0021 0.0134 0.0044 525 ILE 92 CD1 -0.0024 0.0147 0.0044 526 GLN 93 N -0.0045 0.0210 0.0107 527 GLN 93 CA -0.0057 0.0201 0.0102 528 GLN 93 C -0.0047 0.0194 0.0098 529 GLN 93 O -0.0037 0.0202 0.0102 530 GLN 93 CB -0.0072 0.0211 0.0109 531 GLN 93 CG -0.0081 0.0219 0.0114 532 GLN 93 CD -0.0101 0.0215 0.0112 533 GLN 93 OE1 -0.0111 0.0224 0.0118 534 GLN 93 NE2 -0.0106 0.0202 0.0105 535 GLN 94 N -0.0071 0.0162 0.0064 536 GLN 94 CA -0.0056 0.0154 0.0069 537 GLN 94 CA -0.0053 0.0152 0.0070 538 GLN 94 C -0.0076 0.0151 0.0058 539 GLN 94 O -0.0093 0.0138 0.0044 540 GLN 94 CB -0.0036 0.0129 0.0070 541 GLN 94 CB -0.0034 0.0125 0.0069 542 GLN 94 CG -0.0022 0.0114 0.0072 543 GLN 94 CG -0.0023 0.0111 0.0070 544 GLN 94 CD -0.0019 0.0083 0.0061 545 GLN 94 CD -0.0001 0.0122 0.0086 546 GLN 94 OE1 0.0002 0.0068 0.0067 547 GLN 94 OE1 0.0017 0.0130 0.0098 548 GLN 94 NE2 -0.0040 0.0072 0.0046 549 GLN 94 NE2 -0.0003 0.0123 0.0085 550 GLU 95 N -0.0100 0.0142 -0.0014 551 GLU 95 CA -0.0092 0.0088 0.0007 552 GLU 95 C -0.0092 0.0093 -0.0002 553 GLU 95 O -0.0091 0.0100 -0.0054 554 GLU 95 CB -0.0080 0.0033 -0.0027 555 GLU 95 CG -0.0076 -0.0005 0.0009 556 GLU 95 CD -0.0064 -0.0062 -0.0023 557 GLU 95 OE1 -0.0060 -0.0067 -0.0079 558 GLU 95 OE2 -0.0058 -0.0104 0.0007 559 ILE 96 N -0.0125 0.0049 -0.0020 560 ILE 96 CA -0.0118 0.0020 -0.0030 561 ILE 96 C -0.0136 0.0003 -0.0033 562 ILE 96 O -0.0159 0.0012 -0.0028 563 ILE 96 CB -0.0123 0.0011 -0.0032 564 ILE 96 CG1 -0.0095 0.0002 -0.0037 565 ILE 96 CG2 -0.0147 -0.0010 -0.0036 566 ILE 96 CD1 -0.0096 -0.0001 -0.0038 567 LEU 97 N -0.0168 -0.0045 -0.0058 568 LEU 97 CA -0.0160 -0.0043 -0.0053 569 LEU 97 C -0.0155 -0.0027 -0.0045 570 LEU 97 O -0.0162 -0.0017 -0.0045 571 LEU 97 CB -0.0170 -0.0042 -0.0058 572 LEU 97 CG -0.0176 -0.0057 -0.0067 573 LEU 97 CD1 -0.0188 -0.0054 -0.0073 574 LEU 97 CD2 -0.0166 -0.0070 -0.0065 575 VAL 98 N -0.0148 -0.0055 -0.0045 576 VAL 98 CA -0.0138 -0.0033 -0.0031 577 VAL 98 C -0.0121 -0.0021 -0.0021 578 VAL 98 O -0.0111 -0.0033 -0.0027 579 VAL 98 CB -0.0119 -0.0039 -0.0031 580 VAL 98 CG1 -0.0135 -0.0050 -0.0040 581 VAL 98 CG2 -0.0091 -0.0055 -0.0036 582 LEU 99 N -0.0074 0.0027 -0.0016 583 LEU 99 CA -0.0065 0.0028 -0.0009 584 LEU 99 C -0.0049 0.0028 0.0002 585 LEU 99 O -0.0047 0.0038 0.0008 586 LEU 99 CB -0.0072 0.0045 -0.0005 587 LEU 99 CG -0.0089 0.0049 -0.0015 588 LEU 99 CD1 -0.0094 0.0066 -0.0010 589 LEU 99 CD2 -0.0094 0.0035 -0.0025 590 ARG 100 N -0.0031 0.0016 0.0036 591 ARG 100 CA -0.0001 0.0020 0.0034 592 ARG 100 C -0.0007 0.0053 0.0020 593 ARG 100 O -0.0038 0.0059 0.0018 594 ARG 100 CB -0.0002 -0.0009 0.0046 595 ARG 100 CG 0.0025 -0.0008 0.0045 596 ARG 100 CD 0.0066 -0.0007 0.0044 597 ARG 100 NE 0.0076 -0.0036 0.0056 598 ARG 100 CZ 0.0102 -0.0040 0.0057 599 ARG 100 NH1 0.0127 -0.0017 0.0046 600 ARG 100 NH2 0.0102 -0.0068 0.0069 601 ARG 101 N -0.0010 0.0069 0.0068 602 ARG 101 CA -0.0028 0.0069 0.0043 603 ARG 101 C -0.0059 0.0054 0.0055 604 ARG 101 O -0.0059 0.0047 0.0082 605 ARG 101 CB -0.0008 0.0079 0.0035 606 ARG 101 CG 0.0021 0.0094 0.0019 607 ARG 101 CD 0.0025 0.0104 -0.0014 608 ARG 101 NE 0.0051 0.0114 -0.0012 609 ARG 101 CZ 0.0082 0.0126 -0.0015 610 ARG 101 NH1 0.0092 0.0132 -0.0023 611 ARG 101 NH2 0.0102 0.0133 -0.0009 612 GLU 102 N -0.0072 0.0055 0.0026 613 GLU 102 CA -0.0066 0.0036 0.0027 614 GLU 102 C -0.0060 0.0011 0.0030 615 GLU 102 O -0.0049 0.0007 0.0016 616 GLU 102 CB -0.0054 0.0041 0.0006 617 GLU 102 CG -0.0048 0.0021 0.0007 618 GLU 102 CD -0.0038 0.0028 -0.0011 619 GLU 102 OE1 -0.0044 0.0047 -0.0012 620 GLU 102 OE2 -0.0024 0.0014 -0.0025 621 PRO 103 N -0.0209 -0.0029 0.0012 622 PRO 103 CA -0.0264 -0.0012 0.0051 623 PRO 103 C -0.0226 0.0000 0.0052 624 PRO 103 O -0.0170 -0.0020 0.0007 625 PRO 103 CB -0.0338 -0.0063 0.0020 626 PRO 103 CG -0.0307 -0.0114 -0.0049 627 PRO 103 CD -0.0238 -0.0088 -0.0046 628 PRO 104 N -0.0302 -0.0002 0.0084 629 PRO 104 CA -0.0262 0.0030 0.0098 630 PRO 104 C -0.0254 0.0005 0.0042 631 PRO 104 O -0.0305 -0.0038 0.0019 632 PRO 104 CB -0.0302 0.0046 0.0174 633 PRO 104 CG -0.0335 0.0045 0.0211 634 PRO 104 CD -0.0355 0.0001 0.0149 635 HIS 105 N -0.0180 0.0046 0.0025 636 HIS 105 CA -0.0150 0.0009 -0.0052 637 HIS 105 C -0.0129 -0.0045 -0.0149 638 HIS 105 O -0.0092 -0.0074 -0.0215 639 HIS 105 CB -0.0220 -0.0014 -0.0046 640 HIS 105 CG -0.0231 0.0038 0.0043 641 HIS 105 ND1 -0.0308 0.0057 0.0118 642 HIS 105 CD2 -0.0175 0.0077 0.0070 643 HIS 105 CE1 -0.0296 0.0105 0.0185 644 HIS 105 NE2 -0.0217 0.0119 0.0160 645 CYS 106 N -0.0134 0.0017 -0.0091 646 CYS 106 CA -0.0130 0.0006 -0.0114 647 CYS 106 C -0.0081 0.0001 -0.0104 648 CYS 106 O -0.0070 0.0015 -0.0069 649 CYS 106 CB -0.0168 0.0018 -0.0102 650 CYS 106 SG -0.0171 0.0003 -0.0136 651 PRO 107 N -0.0064 0.0019 -0.0128 652 PRO 107 CA -0.0008 -0.0005 -0.0107 653 PRO 107 C 0.0003 -0.0004 -0.0072 654 PRO 107 O 0.0049 -0.0023 -0.0053 655 PRO 107 CB 0.0020 -0.0027 -0.0164 656 PRO 107 CG -0.0022 -0.0014 -0.0209 657 PRO 107 CD -0.0071 0.0012 -0.0191 658 ASN 108 N -0.0043 0.0004 -0.0007 659 ASN 108 N -0.0044 0.0002 -0.0005 660 ASN 108 CA -0.0035 0.0004 0.0007 661 ASN 108 CA -0.0040 0.0002 0.0007 662 ASN 108 C -0.0021 0.0017 0.0001 663 ASN 108 C -0.0023 0.0015 0.0002 664 ASN 108 O -0.0014 0.0018 0.0012 665 ASN 108 O -0.0014 0.0017 0.0014 666 ASN 108 CB -0.0030 0.0001 0.0027 667 ASN 108 CB -0.0038 -0.0006 0.0029 668 ASN 108 CG -0.0016 0.0010 0.0029 669 ASN 108 CG -0.0055 -0.0020 0.0035 670 ASN 108 OD1 -0.0012 0.0018 0.0015 671 ASN 108 OD1 -0.0064 -0.0028 0.0041 672 ASN 108 ND2 -0.0009 0.0009 0.0047 673 ASN 108 ND2 -0.0058 -0.0022 0.0034 674 SER 109 N -0.0030 0.0014 -0.0027 675 SER 109 CA -0.0032 0.0015 -0.0024 676 SER 109 C -0.0033 0.0029 -0.0013 677 SER 109 O -0.0041 0.0033 -0.0005 678 SER 109 CB -0.0044 0.0003 -0.0023 679 SER 109 OG -0.0046 0.0002 -0.0022 680 PHE 110 N -0.0021 0.0035 0.0012 681 PHE 110 CA -0.0022 0.0046 0.0015 682 PHE 110 C -0.0019 0.0044 0.0009 683 PHE 110 O -0.0014 0.0037 0.0001 684 PHE 110 CB -0.0019 0.0060 0.0009 685 PHE 110 CG -0.0022 0.0065 0.0014 686 PHE 110 CD1 -0.0027 0.0074 0.0023 687 PHE 110 CD2 -0.0019 0.0058 0.0009 688 PHE 110 CE1 -0.0029 0.0078 0.0027 689 PHE 110 CE2 -0.0021 0.0062 0.0013 690 PHE 110 CZ -0.0027 0.0072 0.0022 691 ARG 111 N 0.0017 0.0052 0.0045 692 ARG 111 CA 0.0019 0.0031 0.0006 693 ARG 111 C -0.0035 0.0005 -0.0019 694 ARG 111 O -0.0058 -0.0005 -0.0026 695 ARG 111 CB 0.0069 0.0022 -0.0035 696 ARG 111 CG 0.0083 0.0005 -0.0072 697 ARG 111 CD 0.0120 -0.0013 -0.0121 698 ARG 111 NE 0.0148 -0.0019 -0.0145 699 ARG 111 CZ 0.0194 0.0000 -0.0130 700 ARG 111 NH1 0.0217 0.0028 -0.0090 701 ARG 111 NH2 0.0216 -0.0008 -0.0156 702 LEU 112 N -0.0026 -0.0011 -0.0029 703 LEU 112 CA -0.0053 -0.0032 -0.0048 704 LEU 112 C -0.0031 -0.0062 -0.0069 705 LEU 112 O -0.0012 -0.0079 -0.0081 706 LEU 112 CB -0.0083 -0.0039 -0.0056 707 LEU 112 CG -0.0123 -0.0049 -0.0068 708 LEU 112 CD1 -0.0144 -0.0024 -0.0050 709 LEU 112 CD2 -0.0149 -0.0058 -0.0077 710 GLU 113 N -0.0048 -0.0085 -0.0019 711 GLU 113 CA -0.0033 -0.0122 -0.0032 712 GLU 113 C -0.0076 -0.0135 -0.0062 713 GLU 113 O -0.0115 -0.0109 -0.0068 714 GLU 113 CB -0.0004 -0.0109 -0.0008 715 GLU 113 CG 0.0047 -0.0110 0.0018 716 GLU 113 CD 0.0077 -0.0099 0.0040 717 GLU 113 OE1 0.0119 -0.0105 0.0060 718 GLU 113 OE2 0.0059 -0.0083 0.0040 719 LYS 114 N -0.0083 -0.0219 -0.0052 720 LYS 114 CA -0.0099 -0.0214 -0.0073 721 LYS 114 C -0.0075 -0.0210 -0.0040 722 LYS 114 O -0.0052 -0.0240 -0.0012 723 LYS 114 CB -0.0118 -0.0261 -0.0104 724 LYS 114 CG -0.0134 -0.0262 -0.0126 725 LYS 114 CD -0.0158 -0.0300 -0.0164 726 LYS 114 CE -0.0190 -0.0274 -0.0206 727 LYS 114 NZ -0.0211 -0.0308 -0.0239 728 ILE 115 N -0.0161 -0.0059 -0.0005 729 ILE 115 CA -0.0165 -0.0039 0.0015 730 ILE 115 C -0.0150 -0.0015 0.0010 731 ILE 115 O -0.0136 -0.0014 -0.0010 732 ILE 115 CB -0.0169 -0.0038 0.0022 733 ILE 115 CG1 -0.0155 -0.0033 0.0004 734 ILE 115 CG2 -0.0185 -0.0061 0.0030 735 ILE 115 CD1 -0.0157 -0.0027 0.0012 736 LEU 116 N -0.0215 0.0070 0.0064 737 LEU 116 CA -0.0178 0.0114 0.0075 738 LEU 116 C -0.0172 0.0117 0.0074 739 LEU 116 O -0.0212 0.0114 0.0089 740 LEU 116 CB -0.0202 0.0157 0.0110 741 LEU 116 CG -0.0163 0.0205 0.0123 742 LEU 116 CD1 -0.0126 0.0203 0.0107 743 LEU 116 CD2 -0.0192 0.0247 0.0159 744 VAL 117 N -0.0130 0.0104 0.0065 745 VAL 117 CA -0.0117 0.0089 0.0055 746 VAL 117 C -0.0085 0.0113 0.0074 747 VAL 117 O -0.0056 0.0126 0.0085 748 VAL 117 CB -0.0096 0.0051 0.0029 749 VAL 117 CG1 -0.0070 0.0035 0.0020 750 VAL 117 CG2 -0.0130 0.0024 0.0009 751 SER 118 N -0.0046 0.0102 0.0085 752 SER 118 CA -0.0020 0.0092 0.0103 753 SER 118 C 0.0003 0.0081 0.0090 754 SER 118 O 0.0012 0.0075 0.0065 755 SER 118 CB -0.0012 0.0089 0.0106 756 SER 118 OG -0.0027 0.0098 0.0129 757 VAL 119 N -0.0011 0.0074 0.0055 758 VAL 119 CA 0.0001 0.0071 0.0046 759 VAL 119 C 0.0024 0.0060 0.0052 760 VAL 119 O 0.0038 0.0057 0.0039 761 VAL 119 CB -0.0011 0.0074 0.0053 762 VAL 119 CG1 -0.0000 0.0071 0.0044 763 VAL 119 CG2 -0.0034 0.0084 0.0047 764 GLY 120 N 0.0027 0.0070 0.0062 765 GLY 120 CA 0.0040 0.0029 0.0066 766 GLY 120 C 0.0040 0.0023 0.0075 767 GLY 120 O 0.0031 0.0050 0.0073 768 CYS 121 N 0.0051 -0.0003 0.0052 769 CYS 121 CA 0.0053 -0.0009 0.0044 770 CYS 121 C 0.0043 -0.0002 0.0021 771 CYS 121 O 0.0033 0.0013 0.0015 772 CYS 121 CB 0.0053 -0.0002 0.0061 773 CYS 121 SG 0.0066 -0.0011 0.0088 774 THR 122 N -0.0014 0.0044 -0.0011 775 THR 122 CA -0.0014 0.0045 -0.0012 776 THR 122 C -0.0011 0.0043 -0.0001 777 THR 122 O -0.0011 0.0039 0.0007 778 THR 122 CB -0.0023 0.0038 -0.0019 779 THR 122 OG1 -0.0023 0.0040 -0.0023 780 THR 122 CG2 -0.0029 0.0029 -0.0013 781 CYS 123 N -0.0022 -0.0014 -0.0019 782 CYS 123 CA -0.0018 -0.0016 -0.0010 783 CYS 123 C -0.0024 -0.0013 0.0002 784 CYS 123 O -0.0022 -0.0014 0.0008 785 CYS 123 CB -0.0006 -0.0022 -0.0009 786 CYS 123 SG -0.0001 -0.0024 0.0002 787 VAL 124 N -0.0033 0.0013 0.0023 788 VAL 124 CA -0.0046 0.0014 0.0043 789 VAL 124 C -0.0037 0.0000 0.0053 790 VAL 124 O -0.0025 -0.0004 0.0041 791 VAL 124 CB -0.0063 0.0033 0.0038 792 VAL 124 CG1 -0.0075 0.0048 0.0030 793 VAL 124 CG2 -0.0059 0.0038 0.0021 794 THR 125 N -0.0064 0.0023 0.0089 795 THR 125 CA -0.0061 0.0009 0.0099 796 THR 125 C -0.0067 0.0027 0.0088 797 THR 125 O -0.0082 0.0050 0.0089 798 THR 125 CB -0.0075 0.0003 0.0129 799 THR 125 OG1 -0.0074 -0.0007 0.0139 800 THR 125 CG2 -0.0069 -0.0017 0.0142 801 PRO 126 N -0.0082 0.0056 0.0089 802 PRO 126 CA -0.0103 0.0082 0.0083 803 PRO 126 C -0.0121 0.0095 0.0124 804 PRO 126 O -0.0123 0.0091 0.0155 805 PRO 126 CB -0.0085 0.0065 0.0063 806 PRO 126 CG -0.0057 0.0035 0.0048 807 PRO 126 CD -0.0055 0.0026 0.0080 808 ILE 127 N -0.0026 0.0105 -0.0074 809 ILE 127 CA 0.0016 0.0093 -0.0167 810 ILE 127 C 0.0058 0.0082 -0.0261 811 ILE 127 O 0.0083 0.0088 -0.0249 812 ILE 127 CB 0.0108 0.0115 -0.0130 813 ILE 127 CG1 0.0130 0.0101 -0.0218 814 ILE 127 CG2 0.0219 0.0139 -0.0096 815 ILE 127 CD1 0.0032 0.0084 -0.0227 816 PRO 19 N -0.0062 0.0175 0.0023 817 PRO 19 CA -0.0049 0.0043 0.0143 818 PRO 19 C -0.0064 0.0003 0.0292 819 PRO 19 O -0.0069 -0.0065 0.0421 820 PRO 19 CB -0.0071 0.0089 0.0203 821 PRO 19 CG -0.0071 0.0188 0.0053 822 PRO 19 CD -0.0086 0.0287 -0.0000 823 ARG 20 N -0.0083 0.0019 0.0196 824 ARG 20 CA -0.0071 0.0021 0.0173 825 ARG 20 C -0.0027 0.0024 0.0128 826 ARG 20 O -0.0040 0.0033 0.0080 827 ARG 20 CB -0.0125 0.0030 0.0156 828 ARG 20 CG -0.0117 0.0033 0.0127 829 ARG 20 CD -0.0167 0.0038 0.0128 830 ARG 20 NE -0.0164 0.0045 0.0086 831 ARG 20 CZ -0.0126 0.0042 0.0077 832 ARG 20 NH1 -0.0082 0.0033 0.0107 833 ARG 20 NH2 -0.0132 0.0049 0.0035 834 THR 21 N -0.0018 -0.0036 0.0120 835 THR 21 CA 0.0004 -0.0035 0.0105 836 THR 21 C -0.0005 -0.0031 0.0107 837 THR 21 O -0.0019 -0.0042 0.0127 838 THR 21 CB 0.0030 -0.0059 0.0112 839 THR 21 OG1 0.0037 -0.0062 0.0111 840 THR 21 CG2 0.0056 -0.0060 0.0096 841 VAL 22 N -0.0004 -0.0014 0.0056 842 VAL 22 CA -0.0001 -0.0011 0.0049 843 VAL 22 C 0.0019 -0.0009 0.0037 844 VAL 22 O 0.0029 -0.0008 0.0031 845 VAL 22 CB -0.0019 0.0000 0.0039 846 VAL 22 CG1 -0.0040 -0.0002 0.0052 847 VAL 22 CG2 -0.0021 0.0012 0.0021 848 MET 23 N 0.0011 -0.0003 0.0016 849 MET 23 CA 0.0023 -0.0000 0.0010 850 MET 23 C 0.0017 0.0014 0.0002 851 MET 23 O 0.0004 0.0018 0.0006 852 MET 23 CB 0.0025 -0.0012 0.0016 853 MET 23 CG 0.0038 -0.0012 0.0010 854 MET 23 SD 0.0045 -0.0029 0.0018 855 MET 23 CE 0.0029 -0.0031 0.0027 856 VAL 24 N 0.0001 0.0022 0.0019 857 VAL 24 CA -0.0001 0.0025 0.0003 858 VAL 24 C 0.0013 0.0027 -0.0005 859 VAL 24 O 0.0020 0.0027 -0.0003 860 VAL 24 CB -0.0013 0.0025 -0.0004 861 VAL 24 CG1 -0.0016 0.0028 -0.0020 862 VAL 24 CG2 -0.0028 0.0023 0.0004 863 ASN 25 N 0.0020 0.0036 0.0015 864 ASN 25 CA 0.0041 0.0041 -0.0004 865 ASN 25 C 0.0020 0.0022 -0.0027 866 ASN 25 O 0.0008 0.0008 -0.0052 867 ASN 25 CB 0.0072 0.0050 -0.0028 868 ASN 25 CG 0.0096 0.0056 -0.0047 869 ASN 25 OD1 0.0106 0.0052 -0.0080 870 ASN 25 ND2 0.0103 0.0066 -0.0029 871 LEU 26 N 0.0014 -0.0012 -0.0013 872 LEU 26 CA 0.0008 -0.0014 -0.0023 873 LEU 26 C 0.0014 -0.0018 -0.0031 874 LEU 26 O 0.0012 -0.0021 -0.0039 875 LEU 26 CB 0.0003 -0.0013 -0.0024 876 LEU 26 CG -0.0004 -0.0009 -0.0017 877 LEU 26 CD1 -0.0008 -0.0009 -0.0019 878 LEU 26 CD2 -0.0013 -0.0007 -0.0017 879 ASN 27 N 0.0020 -0.0019 -0.0057 880 ASN 27 CA 0.0067 -0.0047 -0.0120 881 ASN 27 C 0.0048 -0.0061 -0.0154 882 ASN 27 O 0.0068 -0.0048 -0.0123 883 ASN 27 CB 0.0154 -0.0041 -0.0103 884 ASN 27 CG 0.0196 -0.0069 -0.0164 885 ASN 27 OD1 0.0187 -0.0073 -0.0175 886 ASN 27 ND2 0.0237 -0.0088 -0.0207 887 ILE 28 N 0.0009 -0.0218 -0.0142 888 ILE 28 CA 0.0024 -0.0240 -0.0151 889 ILE 28 C 0.0086 -0.0267 -0.0158 890 ILE 28 O 0.0108 -0.0286 -0.0165 891 ILE 28 CB -0.0025 -0.0279 -0.0173 892 ILE 28 CG1 -0.0082 -0.0246 -0.0163 893 ILE 28 CG2 -0.0008 -0.0315 -0.0189 894 ILE 28 CD1 -0.0138 -0.0276 -0.0182 895 HIS 29 N 0.0075 -0.0279 -0.0135 896 HIS 29 CA 0.0216 -0.0339 -0.0105 897 HIS 29 C 0.0242 -0.0480 -0.0118 898 HIS 29 O 0.0349 -0.0506 -0.0092 899 HIS 29 CB 0.0241 -0.0346 -0.0099 900 HIS 29 CG 0.0237 -0.0483 -0.0120 901 HIS 29 ND1 0.0123 -0.0568 -0.0164 902 HIS 29 CD2 0.0335 -0.0543 -0.0101 903 HIS 29 CE1 0.0156 -0.0674 -0.0170 904 HIS 29 NE2 0.0280 -0.0664 -0.0134 905 SER 41 N -0.0181 0.0219 0.0049 906 SER 41 CA -0.0179 0.0198 0.0049 907 SER 41 C -0.0208 0.0197 0.0040 908 SER 41 O -0.0228 0.0214 0.0034 909 SER 41 CB -0.0154 0.0205 0.0057 910 SER 41 OG -0.0150 0.0183 0.0058 911 ASP 42 N -0.0204 0.0181 0.0049 912 ASP 42 CA -0.0188 0.0177 0.0068 913 ASP 42 C -0.0161 0.0165 0.0063 914 ASP 42 O -0.0145 0.0161 0.0079 915 ASP 42 CB -0.0193 0.0183 0.0096 916 ASP 42 CG -0.0189 0.0182 0.0104 917 ASP 42 OD1 -0.0198 0.0184 0.0090 918 ASP 42 OD2 -0.0177 0.0180 0.0125 919 TYR 43 N -0.0103 0.0137 0.0025 920 TYR 43 N -0.0104 0.0138 0.0025 921 TYR 43 CA -0.0102 0.0147 0.0027 922 TYR 43 CA -0.0103 0.0148 0.0026 923 TYR 43 C -0.0114 0.0155 0.0020 924 TYR 43 C -0.0115 0.0153 0.0019 925 TYR 43 O -0.0115 0.0160 0.0020 926 TYR 43 O -0.0118 0.0154 0.0017 927 TYR 43 CB -0.0093 0.0158 0.0032 928 TYR 43 CB -0.0096 0.0161 0.0030 929 TYR 43 CG -0.0081 0.0153 0.0039 930 TYR 43 CG -0.0094 0.0166 0.0032 931 TYR 43 CD1 -0.0076 0.0141 0.0041 932 TYR 43 CD1 -0.0083 0.0170 0.0038 933 TYR 43 CD2 -0.0073 0.0160 0.0044 934 TYR 43 CD2 -0.0103 0.0168 0.0027 935 TYR 43 CE1 -0.0065 0.0137 0.0048 936 TYR 43 CE1 -0.0081 0.0175 0.0040 937 TYR 43 CE2 -0.0062 0.0156 0.0051 938 TYR 43 CE2 -0.0101 0.0174 0.0028 939 TYR 43 CZ -0.0057 0.0145 0.0053 940 TYR 43 CZ -0.0089 0.0177 0.0035 941 TYR 43 OH -0.0046 0.0141 0.0059 942 TYR 43 OH -0.0086 0.0182 0.0037 943 TYR 44 N -0.0129 0.0167 -0.0025 944 TYR 44 CA -0.0121 0.0165 -0.0023 945 TYR 44 C -0.0113 0.0162 0.0001 946 TYR 44 O -0.0099 0.0158 0.0003 947 TYR 44 CB -0.0139 0.0170 -0.0031 948 TYR 44 CG -0.0158 0.0176 -0.0015 949 TYR 44 CD1 -0.0176 0.0182 -0.0017 950 TYR 44 CD2 -0.0157 0.0176 0.0001 951 TYR 44 CE1 -0.0193 0.0188 -0.0002 952 TYR 44 CE2 -0.0174 0.0181 0.0017 953 TYR 44 CZ -0.0192 0.0187 0.0016 954 TYR 44 OH -0.0208 0.0192 0.0031 955 ASN 45 N -0.0157 0.0163 0.0012 956 ASN 45 CA -0.0157 0.0141 0.0043 957 ASN 45 C -0.0126 0.0118 0.0044 958 ASN 45 O -0.0116 0.0101 0.0057 959 ASN 45 CB -0.0180 0.0144 0.0061 960 ASN 45 CG -0.0210 0.0152 0.0080 961 ASN 45 OD1 -0.0211 0.0142 0.0095 962 ASN 45 ND2 -0.0235 0.0169 0.0081 963 ARG 46 N -0.0128 0.0106 0.0081 964 ARG 46 CA -0.0103 0.0089 0.0085 965 ARG 46 C -0.0082 0.0093 0.0074 966 ARG 46 O -0.0062 0.0079 0.0077 967 ARG 46 CB -0.0091 0.0083 0.0085 968 ARG 46 CG -0.0110 0.0079 0.0096 969 ARG 46 CD -0.0095 0.0065 0.0101 970 ARG 46 NE -0.0072 0.0072 0.0086 971 ARG 46 CZ -0.0071 0.0090 0.0072 972 ARG 46 NH1 -0.0093 0.0103 0.0070 973 ARG 46 NH2 -0.0048 0.0094 0.0060 974 SER 47 N -0.0070 0.0050 -0.0017 975 SER 47 CA -0.0055 0.0050 -0.0028 976 SER 47 C -0.0043 0.0046 -0.0020 977 SER 47 O -0.0048 0.0045 -0.0013 978 SER 47 CB -0.0060 0.0055 -0.0045 979 SER 47 OG -0.0046 0.0056 -0.0055 980 THR 48 N -0.0078 -0.0018 -0.0072 981 THR 48 CA -0.0052 -0.0012 -0.0073 982 THR 48 C -0.0048 -0.0011 -0.0101 983 THR 48 O -0.0033 -0.0007 -0.0102 984 THR 48 CB -0.0029 -0.0006 -0.0069 985 THR 48 OG1 -0.0026 -0.0006 -0.0091 986 THR 48 CG2 -0.0030 -0.0006 -0.0042 987 SER 49 N -0.0010 0.0010 -0.0142 988 SER 49 CA -0.0012 0.0012 -0.0133 989 SER 49 C -0.0026 0.0042 -0.0125 990 SER 49 O -0.0030 0.0055 -0.0142 991 SER 49 CB -0.0005 0.0001 -0.0157 992 SER 49 OG -0.0010 0.0015 -0.0185 993 PRO 50 N -0.0059 0.0082 -0.0108 994 PRO 50 CA -0.0069 0.0101 -0.0103 995 PRO 50 C -0.0073 0.0108 -0.0098 996 PRO 50 O -0.0067 0.0096 -0.0093 997 PRO 50 CB -0.0072 0.0104 -0.0085 998 PRO 50 CG -0.0063 0.0085 -0.0073 999 PRO 50 CD -0.0055 0.0072 -0.0090 1000 TRP 51 N -0.0058 0.0143 -0.0073 1001 TRP 51 CA -0.0057 0.0146 -0.0066 1002 TRP 51 C -0.0050 0.0146 -0.0068 1003 TRP 51 O -0.0044 0.0144 -0.0074 1004 TRP 51 CB -0.0055 0.0149 -0.0058 1005 TRP 51 CG -0.0047 0.0149 -0.0057 1006 TRP 51 CD1 -0.0038 0.0151 -0.0054 1007 TRP 51 CD2 -0.0045 0.0148 -0.0060 1008 TRP 51 NE1 -0.0032 0.0151 -0.0055 1009 TRP 51 CE2 -0.0036 0.0150 -0.0058 1010 TRP 51 CE3 -0.0051 0.0147 -0.0064 1011 TRP 51 CZ2 -0.0033 0.0149 -0.0060 1012 TRP 51 CZ3 -0.0048 0.0146 -0.0066 1013 TRP 51 CH2 -0.0039 0.0148 -0.0064 1014 ASN 52 N -0.0069 0.0152 -0.0056 1015 ASN 52 CA -0.0053 0.0140 -0.0063 1016 ASN 52 C -0.0045 0.0135 -0.0043 1017 ASN 52 O -0.0056 0.0143 -0.0027 1018 ASN 52 CB -0.0057 0.0142 -0.0083 1019 ASN 52 CG -0.0061 0.0144 -0.0106 1020 ASN 52 OD1 -0.0060 0.0143 -0.0108 1021 ASN 52 ND2 -0.0066 0.0147 -0.0123 1022 LEU 53 N -0.0030 0.0054 -0.0028 1023 LEU 53 CA -0.0018 0.0071 -0.0007 1024 LEU 53 C -0.0065 0.0074 -0.0065 1025 LEU 53 O -0.0086 0.0020 -0.0112 1026 LEU 53 CB 0.0031 0.0008 0.0032 1027 LEU 53 CG 0.0082 0.0010 0.0096 1028 LEU 53 CD1 0.0127 -0.0059 0.0128 1029 LEU 53 CD2 0.0096 0.0088 0.0143 1030 HIS 54 N -0.0046 -0.0000 -0.0008 1031 HIS 54 CA -0.0205 0.0071 -0.0115 1032 HIS 54 C -0.0124 0.0101 -0.0042 1033 HIS 54 O -0.0008 0.0237 0.0088 1034 HIS 54 CB -0.0324 0.0304 -0.0146 1035 HIS 54 CG -0.0485 0.0416 -0.0243 1036 HIS 54 ND1 -0.0458 0.0576 -0.0178 1037 HIS 54 CD2 -0.0676 0.0389 -0.0403 1038 HIS 54 CE1 -0.0627 0.0636 -0.0296 1039 HIS 54 NE2 -0.0766 0.0536 -0.0435 1040 ARG 55 N -0.0128 0.0101 -0.0103 1041 ARG 55 CA -0.0084 0.0055 -0.0060 1042 ARG 55 C -0.0140 0.0158 -0.0089 1043 ARG 55 O -0.0221 0.0181 -0.0200 1044 ARG 55 CB -0.0075 -0.0101 -0.0134 1045 ARG 55 CG -0.0020 -0.0179 -0.0094 1046 ARG 55 CD -0.0018 -0.0332 -0.0177 1047 ARG 55 NE 0.0026 -0.0408 -0.0151 1048 ARG 55 CZ -0.0010 -0.0398 -0.0200 1049 ARG 55 NH1 -0.0095 -0.0306 -0.0279 1050 ARG 55 NH2 0.0042 -0.0482 -0.0169 1051 ASN 56 N -0.0026 0.0192 0.0099 1052 ASN 56 CA -0.0037 0.0214 0.0090 1053 ASN 56 C -0.0003 0.0151 0.0122 1054 ASN 56 O 0.0025 0.0136 0.0189 1055 ASN 56 CB -0.0053 0.0296 0.0130 1056 ASN 56 CG -0.0050 0.0315 0.0159 1057 ASN 56 OD1 -0.0037 0.0343 0.0226 1058 ASN 56 ND2 -0.0059 0.0298 0.0112 1059 GLU 57 N 0.0007 0.0100 0.0105 1060 GLU 57 CA 0.0021 0.0045 0.0121 1061 GLU 57 C 0.0015 0.0068 0.0112 1062 GLU 57 O -0.0001 0.0111 0.0071 1063 GLU 57 CB 0.0027 -0.0016 0.0076 1064 GLU 57 CG 0.0043 -0.0079 0.0086 1065 GLU 57 CD 0.0051 -0.0141 0.0054 1066 GLU 57 OE1 0.0068 -0.0191 0.0090 1067 GLU 57 OE2 0.0040 -0.0136 -0.0001 1068 ASP 58 N 0.0061 0.0042 0.0185 1069 ASP 58 CA 0.0065 0.0022 0.0164 1070 ASP 58 C 0.0041 -0.0004 0.0164 1071 ASP 58 O 0.0021 -0.0007 0.0181 1072 ASP 58 CB 0.0069 0.0030 0.0167 1073 ASP 58 CG 0.0073 0.0011 0.0148 1074 ASP 58 OD1 0.0069 -0.0011 0.0131 1075 ASP 58 OD2 0.0077 0.0019 0.0150 1076 PRO 59 N 0.0052 -0.0055 0.0135 1077 PRO 59 CA 0.0006 -0.0074 0.0129 1078 PRO 59 C -0.0005 -0.0089 0.0096 1079 PRO 59 O -0.0042 -0.0102 0.0098 1080 PRO 59 CB -0.0006 -0.0083 0.0116 1081 PRO 59 CG 0.0035 -0.0073 0.0095 1082 PRO 59 CD 0.0069 -0.0053 0.0120 1083 GLU 60 N -0.0030 -0.0125 0.0029 1084 GLU 60 CA -0.0032 -0.0130 0.0012 1085 GLU 60 C -0.0028 -0.0132 0.0010 1086 GLU 60 O -0.0027 -0.0136 -0.0004 1087 GLU 60 CB -0.0021 -0.0135 0.0002 1088 GLU 60 CG -0.0026 -0.0135 0.0002 1089 GLU 60 CD -0.0043 -0.0134 -0.0006 1090 GLU 60 OE1 -0.0045 -0.0138 -0.0021 1091 GLU 60 OE2 -0.0054 -0.0129 0.0002 1092 ARG 61 N -0.0003 -0.0074 0.0085 1093 ARG 61 CA -0.0013 -0.0060 0.0107 1094 ARG 61 C -0.0055 -0.0054 0.0138 1095 ARG 61 O -0.0063 -0.0046 0.0154 1096 ARG 61 CB 0.0025 -0.0028 0.0122 1097 ARG 61 CG 0.0024 -0.0012 0.0142 1098 ARG 61 CD 0.0063 0.0020 0.0156 1099 ARG 61 NE 0.0065 0.0046 0.0186 1100 ARG 61 CZ 0.0100 0.0073 0.0197 1101 ARG 61 NH1 0.0138 0.0080 0.0183 1102 ARG 61 NH2 0.0098 0.0094 0.0223 1103 TYR 62 N -0.0058 -0.0068 0.0036 1104 TYR 62 CA -0.0066 -0.0063 0.0041 1105 TYR 62 C -0.0054 -0.0069 0.0041 1106 TYR 62 O -0.0047 -0.0075 0.0027 1107 TYR 62 CB -0.0081 -0.0058 0.0028 1108 TYR 62 CG -0.0091 -0.0053 0.0032 1109 TYR 62 CD1 -0.0105 -0.0044 0.0043 1110 TYR 62 CD2 -0.0087 -0.0056 0.0026 1111 TYR 62 CE1 -0.0114 -0.0039 0.0047 1112 TYR 62 CE2 -0.0096 -0.0051 0.0031 1113 TYR 62 CZ -0.0109 -0.0042 0.0041 1114 TYR 62 OH -0.0117 -0.0038 0.0047 1115 PRO 63 N -0.0033 -0.0023 0.0145 1116 PRO 63 CA -0.0036 0.0011 0.0185 1117 PRO 63 C -0.0003 0.0005 0.0216 1118 PRO 63 O 0.0028 -0.0024 0.0217 1119 PRO 63 CB -0.0036 0.0020 0.0197 1120 PRO 63 CG -0.0045 -0.0001 0.0159 1121 PRO 63 CD -0.0026 -0.0036 0.0138 1122 SER 64 N 0.0009 -0.0037 0.0277 1123 SER 64 CA 0.0029 -0.0034 0.0250 1124 SER 64 C 0.0056 -0.0003 0.0271 1125 SER 64 O 0.0088 0.0013 0.0251 1126 SER 64 CB 0.0001 -0.0060 0.0238 1127 SER 64 OG -0.0024 -0.0065 0.0275 1128 VAL 65 N 0.0123 -0.0024 0.0306 1129 VAL 65 CA 0.0102 -0.0010 0.0274 1130 VAL 65 C 0.0116 0.0043 0.0337 1131 VAL 65 O 0.0156 0.0018 0.0400 1132 VAL 65 CB 0.0115 -0.0093 0.0244 1133 VAL 65 CG1 0.0093 -0.0081 0.0209 1134 VAL 65 CG2 0.0102 -0.0147 0.0183 1135 ILE 66 N 0.0122 0.0110 0.0318 1136 ILE 66 CA 0.0128 0.0135 0.0340 1137 ILE 66 C 0.0141 0.0160 0.0344 1138 ILE 66 O 0.0151 0.0162 0.0321 1139 ILE 66 CB 0.0138 0.0146 0.0329 1140 ILE 66 CG1 0.0124 0.0122 0.0329 1141 ILE 66 CG2 0.0148 0.0176 0.0349 1142 ILE 66 CD1 0.0133 0.0129 0.0317 1143 TRP 67 N 0.0165 0.0180 0.0292 1144 TRP 67 CA 0.0136 0.0154 0.0248 1145 TRP 67 C 0.0142 0.0263 0.0289 1146 TRP 67 O 0.0211 0.0286 0.0379 1147 TRP 67 CB 0.0192 0.0032 0.0278 1148 TRP 67 CG 0.0179 -0.0086 0.0227 1149 TRP 67 CD1 0.0224 -0.0149 0.0262 1150 TRP 67 CD2 0.0116 -0.0155 0.0130 1151 TRP 67 NE1 0.0194 -0.0255 0.0194 1152 TRP 67 CE2 0.0129 -0.0265 0.0112 1153 TRP 67 CE3 0.0052 -0.0139 0.0057 1154 TRP 67 CZ2 0.0081 -0.0355 0.0027 1155 TRP 67 CZ3 0.0004 -0.0229 -0.0029 1156 TRP 67 CH2 0.0019 -0.0338 -0.0043 1157 GLU 68 N 0.0151 0.0362 0.0239 1158 GLU 68 CA 0.0132 0.0352 0.0239 1159 GLU 68 C 0.0121 0.0337 0.0219 1160 GLU 68 O 0.0117 0.0333 0.0215 1161 GLU 68 CB 0.0116 0.0355 0.0262 1162 GLU 68 CG 0.0096 0.0346 0.0265 1163 GLU 68 CD 0.0092 0.0354 0.0286 1164 GLU 68 OE1 0.0078 0.0347 0.0286 1165 GLU 68 OE2 0.0104 0.0367 0.0301 1166 ALA 69 N 0.0108 0.0263 0.0137 1167 ALA 69 CA 0.0087 0.0252 0.0106 1168 ALA 69 C 0.0048 0.0254 0.0108 1169 ALA 69 O 0.0030 0.0264 0.0135 1170 ALA 69 CB 0.0088 0.0251 0.0103 1171 LYS 70 N 0.0034 0.0224 0.0029 1172 LYS 70 CA -0.0052 0.0260 -0.0014 1173 LYS 70 C -0.0026 0.0194 -0.0012 1174 LYS 70 O -0.0017 0.0082 -0.0028 1175 LYS 70 CB -0.0156 0.0223 -0.0083 1176 LYS 70 CG -0.0194 0.0289 -0.0093 1177 LYS 70 CD -0.0224 0.0425 -0.0084 1178 LYS 70 CE -0.0290 0.0488 -0.0111 1179 LYS 70 NZ -0.0397 0.0447 -0.0182 1180 CYS 71 N -0.0026 0.0131 -0.0094 1181 CYS 71 CA -0.0026 0.0094 -0.0113 1182 CYS 71 C -0.0051 0.0073 -0.0100 1183 CYS 71 O -0.0075 0.0077 -0.0076 1184 CYS 71 CB -0.0028 0.0078 -0.0119 1185 CYS 71 SG -0.0004 0.0102 -0.0129 1186 ARG 72 N -0.0093 0.0139 -0.0120 1187 ARG 72 CA -0.0092 0.0138 -0.0110 1188 ARG 72 C -0.0084 0.0133 -0.0107 1189 ARG 72 O -0.0082 0.0133 -0.0101 1190 ARG 72 CB -0.0096 0.0140 -0.0103 1191 ARG 72 CG -0.0105 0.0145 -0.0104 1192 ARG 72 CD -0.0108 0.0146 -0.0096 1193 ARG 72 NE -0.0116 0.0150 -0.0098 1194 ARG 72 CZ -0.0120 0.0152 -0.0094 1195 ARG 72 NH1 -0.0116 0.0150 -0.0089 1196 ARG 72 NH2 -0.0128 0.0156 -0.0097 1197 HIS 73 N -0.0126 0.0022 -0.0199 1198 HIS 73 CA -0.0098 -0.0013 -0.0187 1199 HIS 73 C -0.0077 -0.0027 -0.0221 1200 HIS 73 O -0.0081 -0.0014 -0.0258 1201 HIS 73 CB -0.0087 -0.0026 -0.0179 1202 HIS 73 CG -0.0108 -0.0010 -0.0149 1203 HIS 73 ND1 -0.0119 -0.0008 -0.0107 1204 HIS 73 CD2 -0.0122 0.0007 -0.0155 1205 HIS 73 CE1 -0.0138 0.0009 -0.0091 1206 HIS 73 NE2 -0.0142 0.0020 -0.0118 1207 LEU 74 N -0.0033 -0.0118 -0.0266 1208 LEU 74 CA 0.0042 -0.0140 -0.0333 1209 LEU 74 C 0.0059 -0.0130 -0.0297 1210 LEU 74 O 0.0050 -0.0148 -0.0357 1211 LEU 74 CB 0.0145 -0.0143 -0.0334 1212 LEU 74 CG 0.0236 -0.0166 -0.0401 1213 LEU 74 CD1 0.0210 -0.0200 -0.0514 1214 LEU 74 CD2 0.0339 -0.0160 -0.0375 1215 GLY 75 N 0.0062 -0.0116 -0.0291 1216 GLY 75 CA 0.0058 -0.0108 -0.0279 1217 GLY 75 C 0.0013 -0.0095 -0.0274 1218 GLY 75 O -0.0014 -0.0096 -0.0284 1219 CYS 76 N -0.0006 -0.0090 -0.0270 1220 CYS 76 CA -0.0034 -0.0089 -0.0255 1221 CYS 76 C -0.0035 -0.0090 -0.0210 1222 CYS 76 O -0.0005 -0.0092 -0.0192 1223 CYS 76 CB -0.0021 -0.0090 -0.0266 1224 CYS 76 SG -0.0017 -0.0089 -0.0319 1225 ILE 77 N -0.0106 -0.0067 -0.0145 1226 ILE 77 CA -0.0111 -0.0048 -0.0104 1227 ILE 77 C -0.0110 -0.0047 -0.0099 1228 ILE 77 O -0.0132 -0.0050 -0.0123 1229 ILE 77 CB -0.0152 -0.0030 -0.0091 1230 ILE 77 CG1 -0.0150 -0.0031 -0.0093 1231 ILE 77 CG2 -0.0162 -0.0010 -0.0049 1232 ILE 77 CD1 -0.0191 -0.0015 -0.0084 1233 ASN 78 N -0.0136 -0.0051 0.0007 1234 ASN 78 CA -0.0123 -0.0045 0.0034 1235 ASN 78 C -0.0142 -0.0052 0.0065 1236 ASN 78 O -0.0165 -0.0061 0.0065 1237 ASN 78 CB -0.0089 -0.0032 0.0038 1238 ASN 78 CG -0.0083 -0.0029 0.0053 1239 ASN 78 OD1 -0.0104 -0.0037 0.0064 1240 ASN 78 ND2 -0.0055 -0.0018 0.0055 1241 ALA 79 N -0.0024 -0.0026 0.0350 1242 ALA 79 CA -0.0063 -0.0137 0.0507 1243 ALA 79 C -0.0091 -0.0182 0.0436 1244 ALA 79 O -0.0158 -0.0334 0.0500 1245 ALA 79 CB 0.0005 -0.0028 0.0716 1246 ASP 80 N -0.0217 0.0051 0.0089 1247 ASP 80 CA -0.0183 0.0068 -0.0134 1248 ASP 80 C -0.0018 -0.0027 -0.0168 1249 ASP 80 O 0.0044 -0.0034 -0.0350 1250 ASP 80 CB -0.0353 0.0187 -0.0223 1251 ASP 80 CG -0.0534 0.0294 -0.0202 1252 ASP 80 OD1 -0.0529 0.0291 -0.0201 1253 ASP 80 OD2 -0.0679 0.0384 -0.0209 1254 GLY 81 N -0.0093 -0.0069 0.0097 1255 GLY 81 CA -0.0123 -0.0034 0.0113 1256 GLY 81 C -0.0135 -0.0040 0.0135 1257 GLY 81 O -0.0162 -0.0017 0.0155 1258 ASN 82 N -0.0128 -0.0010 0.0173 1259 ASN 82 CA -0.0053 -0.0053 0.0167 1260 ASN 82 C -0.0044 -0.0081 0.0036 1261 ASN 82 O -0.0062 -0.0085 -0.0043 1262 ASN 82 CB 0.0056 -0.0105 0.0227 1263 ASN 82 CG 0.0063 -0.0085 0.0363 1264 ASN 82 OD1 0.0141 -0.0120 0.0417 1265 ASN 82 ND2 -0.0014 -0.0031 0.0424 1266 VAL 83 N 0.0003 -0.0075 -0.0023 1267 VAL 83 CA 0.0015 -0.0087 -0.0089 1268 VAL 83 C 0.0082 -0.0100 -0.0098 1269 VAL 83 O 0.0124 -0.0104 -0.0073 1270 VAL 83 CB 0.0003 -0.0089 -0.0119 1271 VAL 83 CG1 0.0014 -0.0101 -0.0189 1272 VAL 83 CG2 -0.0063 -0.0075 -0.0107 1273 ASP 84 N 0.0061 -0.0104 -0.0150 1274 ASP 84 CA 0.0107 -0.0126 -0.0170 1275 ASP 84 C 0.0121 -0.0156 -0.0227 1276 ASP 84 O 0.0080 -0.0164 -0.0267 1277 ASP 84 CB 0.0087 -0.0123 -0.0176 1278 ASP 84 CG 0.0133 -0.0143 -0.0192 1279 ASP 84 OD1 0.0187 -0.0159 -0.0193 1280 ASP 84 OD2 0.0115 -0.0141 -0.0199 1281 TYR 85 N 0.0188 -0.0165 -0.0248 1282 TYR 85 CA 0.0205 -0.0196 -0.0285 1283 TYR 85 C 0.0224 -0.0228 -0.0322 1284 TYR 85 O 0.0240 -0.0256 -0.0356 1285 TYR 85 CB 0.0245 -0.0201 -0.0260 1286 TYR 85 CG 0.0224 -0.0173 -0.0230 1287 TYR 85 CD1 0.0197 -0.0174 -0.0254 1288 TYR 85 CD2 0.0231 -0.0146 -0.0179 1289 TYR 85 CE1 0.0179 -0.0148 -0.0227 1290 TYR 85 CE2 0.0212 -0.0120 -0.0151 1291 TYR 85 CZ 0.0187 -0.0121 -0.0175 1292 TYR 85 OH 0.0171 -0.0097 -0.0148 1293 HIS 86 N 0.0200 -0.0252 -0.0326 1294 HIS 86 CA 0.0173 -0.0343 -0.0411 1295 HIS 86 C 0.0008 -0.0395 -0.0506 1296 HIS 86 O -0.0017 -0.0487 -0.0591 1297 HIS 86 CB 0.0179 -0.0278 -0.0355 1298 HIS 86 CG 0.0334 -0.0223 -0.0259 1299 HIS 86 ND1 0.0337 -0.0089 -0.0146 1300 HIS 86 CD2 0.0492 -0.0282 -0.0258 1301 HIS 86 CE1 0.0490 -0.0072 -0.0083 1302 HIS 86 NE2 0.0592 -0.0184 -0.0145 1303 MET 87 N 0.0017 -0.0203 -0.0407 1304 MET 87 CA 0.0007 -0.0220 -0.0403 1305 MET 87 C 0.0024 -0.0237 -0.0407 1306 MET 87 O 0.0044 -0.0233 -0.0413 1307 MET 87 CB -0.0006 -0.0209 -0.0400 1308 MET 87 CG -0.0024 -0.0192 -0.0396 1309 MET 87 SD -0.0045 -0.0205 -0.0389 1310 MET 87 CE -0.0060 -0.0219 -0.0384 1311 ASN 88 N 0.0052 -0.0147 -0.0348 1312 ASN 88 CA 0.0055 -0.0148 -0.0346 1313 ASN 88 C 0.0053 -0.0145 -0.0347 1314 ASN 88 O 0.0049 -0.0146 -0.0350 1315 ASN 88 CB 0.0056 -0.0155 -0.0346 1316 ASN 88 CG 0.0059 -0.0159 -0.0344 1317 ASN 88 OD1 0.0057 -0.0164 -0.0345 1318 ASN 88 ND2 0.0063 -0.0157 -0.0342 1319 SER 89 N 0.0036 -0.0095 -0.0261 1320 SER 89 CA 0.0023 -0.0067 -0.0270 1321 SER 89 C 0.0024 -0.0072 -0.0274 1322 SER 89 O 0.0033 -0.0079 -0.0251 1323 SER 89 CB 0.0022 -0.0041 -0.0243 1324 SER 89 OG 0.0018 -0.0029 -0.0242 1325 VAL 90 N 0.0102 -0.0063 -0.0139 1326 VAL 90 CA 0.0099 -0.0052 -0.0148 1327 VAL 90 C 0.0089 -0.0026 -0.0159 1328 VAL 90 O 0.0090 -0.0021 -0.0172 1329 VAL 90 CB 0.0112 -0.0065 -0.0169 1330 VAL 90 CG1 0.0121 -0.0090 -0.0157 1331 VAL 90 CG2 0.0120 -0.0068 -0.0192 1332 PRO 91 N 0.0075 0.0045 -0.0025 1333 PRO 91 CA 0.0097 0.0067 -0.0023 1334 PRO 91 C 0.0099 0.0069 -0.0027 1335 PRO 91 O 0.0086 0.0058 -0.0013 1336 PRO 91 CB 0.0101 0.0076 0.0007 1337 PRO 91 CG 0.0080 0.0058 0.0025 1338 PRO 91 CD 0.0066 0.0040 0.0003 1339 ILE 92 N 0.0066 0.0056 -0.0019 1340 ILE 92 CA 0.0067 0.0059 -0.0028 1341 ILE 92 C 0.0066 0.0068 -0.0024 1342 ILE 92 O 0.0066 0.0077 -0.0022 1343 ILE 92 CB 0.0067 0.0063 -0.0038 1344 ILE 92 CG1 0.0067 0.0055 -0.0042 1345 ILE 92 CG2 0.0067 0.0067 -0.0048 1346 ILE 92 CD1 0.0068 0.0060 -0.0049 1347 GLN 93 N 0.0088 0.0019 0.0002 1348 GLN 93 CA 0.0111 -0.0007 0.0021 1349 GLN 93 C 0.0068 -0.0020 -0.0011 1350 GLN 93 O 0.0031 -0.0056 -0.0037 1351 GLN 93 CB 0.0135 -0.0070 0.0044 1352 GLN 93 CG 0.0177 -0.0064 0.0075 1353 GLN 93 CD 0.0230 -0.0064 0.0117 1354 GLN 93 OE1 0.0247 -0.0018 0.0127 1355 GLN 93 NE2 0.0258 -0.0115 0.0141 1356 GLN 94 N 0.0081 -0.0024 0.0043 1357 GLN 94 CA 0.0055 -0.0035 0.0031 1358 GLN 94 C 0.0071 -0.0064 0.0037 1359 GLN 94 O 0.0097 -0.0056 0.0049 1360 GLN 94 CB 0.0042 0.0002 0.0027 1361 GLN 94 CG 0.0022 -0.0001 0.0018 1362 GLN 94 CD -0.0017 -0.0004 0.0001 1363 GLN 94 OE1 -0.0037 0.0022 -0.0007 1364 GLN 94 NE2 -0.0031 -0.0035 -0.0006 1365 GLU 95 N 0.0160 -0.0203 0.0057 1366 GLU 95 CA 0.0131 -0.0227 -0.0004 1367 GLU 95 C 0.0025 -0.0133 -0.0017 1368 GLU 95 O -0.0052 -0.0098 -0.0064 1369 GLU 95 CB 0.0127 -0.0323 -0.0119 1370 GLU 95 CG 0.0230 -0.0426 -0.0119 1371 GLU 95 CD 0.0222 -0.0519 -0.0235 1372 GLU 95 OE1 0.0137 -0.0509 -0.0320 1373 GLU 95 OE2 0.0298 -0.0601 -0.0242 1374 ILE 96 N 0.0072 -0.0139 0.0028 1375 ILE 96 CA 0.0044 -0.0103 0.0029 1376 ILE 96 C 0.0042 -0.0110 0.0019 1377 ILE 96 O 0.0068 -0.0132 0.0030 1378 ILE 96 CB 0.0049 -0.0070 0.0071 1379 ILE 96 CG1 0.0030 -0.0046 0.0071 1380 ILE 96 CG2 0.0044 -0.0044 0.0091 1381 ILE 96 CD1 -0.0003 -0.0005 0.0069 1382 LEU 97 N 0.0011 -0.0062 0.0005 1383 LEU 97 CA -0.0006 -0.0059 -0.0018 1384 LEU 97 C -0.0031 -0.0059 -0.0006 1385 LEU 97 O -0.0041 -0.0061 0.0016 1386 LEU 97 CB -0.0014 -0.0057 -0.0035 1387 LEU 97 CG 0.0009 -0.0057 -0.0048 1388 LEU 97 CD1 -0.0001 -0.0056 -0.0059 1389 LEU 97 CD2 0.0025 -0.0056 -0.0070 1390 VAL 98 N 0.0001 -0.0064 0.0012 1391 VAL 98 CA -0.0024 -0.0050 0.0026 1392 VAL 98 C -0.0042 -0.0054 -0.0009 1393 VAL 98 O -0.0026 -0.0068 -0.0039 1394 VAL 98 CB -0.0003 -0.0050 0.0057 1395 VAL 98 CG1 0.0014 -0.0046 0.0093 1396 VAL 98 CG2 0.0027 -0.0066 0.0041 1397 LEU 99 N -0.0031 -0.0059 -0.0043 1398 LEU 99 CA -0.0037 -0.0059 -0.0053 1399 LEU 99 C -0.0035 -0.0059 -0.0051 1400 LEU 99 O -0.0038 -0.0057 -0.0041 1401 LEU 99 CB -0.0050 -0.0056 -0.0053 1402 LEU 99 CG -0.0054 -0.0055 -0.0053 1403 LEU 99 CD1 -0.0067 -0.0052 -0.0052 1404 LEU 99 CD2 -0.0049 -0.0058 -0.0064 1405 ARG 100 N -0.0033 -0.0051 -0.0076 1406 ARG 100 CA -0.0017 -0.0056 -0.0072 1407 ARG 100 C -0.0039 -0.0058 -0.0091 1408 ARG 100 O -0.0052 -0.0069 -0.0117 1409 ARG 100 CB 0.0014 -0.0077 -0.0085 1410 ARG 100 CG 0.0034 -0.0087 -0.0088 1411 ARG 100 CD 0.0048 -0.0074 -0.0059 1412 ARG 100 NE 0.0069 -0.0070 -0.0038 1413 ARG 100 CZ 0.0075 -0.0053 -0.0008 1414 ARG 100 NH1 0.0066 -0.0040 0.0007 1415 ARG 100 NH2 0.0090 -0.0051 0.0007 1416 ARG 101 N -0.0006 -0.0113 -0.0083 1417 ARG 101 CA -0.0008 -0.0097 -0.0081 1418 ARG 101 C -0.0011 -0.0089 -0.0079 1419 ARG 101 O -0.0019 -0.0094 -0.0074 1420 ARG 101 CB -0.0018 -0.0095 -0.0074 1421 ARG 101 CG -0.0013 -0.0097 -0.0078 1422 ARG 101 CD -0.0020 -0.0088 -0.0073 1423 ARG 101 NE -0.0029 -0.0097 -0.0067 1424 ARG 101 CZ -0.0028 -0.0103 -0.0068 1425 ARG 101 NH1 -0.0018 -0.0101 -0.0075 1426 ARG 101 NH2 -0.0037 -0.0111 -0.0061 1427 GLU 102 N 0.0005 -0.0089 -0.0118 1428 GLU 102 CA 0.0004 -0.0062 -0.0123 1429 GLU 102 C 0.0006 -0.0052 -0.0124 1430 GLU 102 O 0.0025 -0.0054 -0.0117 1431 GLU 102 CB 0.0024 -0.0050 -0.0118 1432 GLU 102 CG 0.0024 -0.0021 -0.0123 1433 GLU 102 CD 0.0037 -0.0010 -0.0121 1434 GLU 102 OE1 0.0029 -0.0014 -0.0123 1435 GLU 102 OE2 0.0056 0.0004 -0.0117 1436 PRO 103 N 0.0047 -0.0051 -0.0076 1437 PRO 103 CA 0.0034 -0.0057 -0.0051 1438 PRO 103 C 0.0026 -0.0065 -0.0034 1439 PRO 103 O 0.0027 -0.0057 -0.0040 1440 PRO 103 CB 0.0024 -0.0032 -0.0046 1441 PRO 103 CG 0.0029 -0.0009 -0.0062 1442 PRO 103 CD 0.0045 -0.0023 -0.0084 1443 PRO 104 N 0.0024 -0.0102 0.0031 1444 PRO 104 CA 0.0005 -0.0114 0.0077 1445 PRO 104 C -0.0025 -0.0065 0.0093 1446 PRO 104 O -0.0042 -0.0025 0.0090 1447 PRO 104 CB -0.0003 -0.0143 0.0120 1448 PRO 104 CG 0.0024 -0.0169 0.0091 1449 PRO 104 CD 0.0030 -0.0128 0.0042 1450 HIS 105 N -0.0024 -0.0118 0.0112 1451 HIS 105 CA -0.0040 -0.0023 0.0135 1452 HIS 105 C -0.0047 0.0056 0.0061 1453 HIS 105 O -0.0059 0.0131 0.0065 1454 HIS 105 CB -0.0051 0.0006 0.0238 1455 HIS 105 CG -0.0045 -0.0063 0.0316 1456 HIS 105 ND1 -0.0038 -0.0130 0.0355 1457 HIS 105 CD2 -0.0046 -0.0076 0.0363 1458 HIS 105 CE1 -0.0034 -0.0179 0.0422 1459 HIS 105 NE2 -0.0040 -0.0149 0.0432 1460 CYS 106 N -0.0004 0.0007 0.0004 1461 CYS 106 CA 0.0023 0.0037 -0.0017 1462 CYS 106 C 0.0046 0.0018 -0.0050 1463 CYS 106 O 0.0052 -0.0009 -0.0066 1464 CYS 106 CB 0.0028 0.0053 -0.0017 1465 CYS 106 SG 0.0063 0.0086 -0.0044 1466 PRO 107 N 0.0135 0.0024 -0.0032 1467 PRO 107 CA 0.0147 0.0002 -0.0097 1468 PRO 107 C 0.0159 -0.0001 -0.0112 1469 PRO 107 O 0.0152 -0.0022 -0.0163 1470 PRO 107 CB 0.0204 0.0008 -0.0118 1471 PRO 107 CG 0.0239 0.0038 -0.0062 1472 PRO 107 CD 0.0185 0.0044 -0.0012 1473 ASN 108 N 0.0175 -0.0014 -0.0089 1474 ASN 108 N 0.0177 -0.0013 -0.0096 1475 ASN 108 CA 0.0175 -0.0014 -0.0088 1476 ASN 108 CA 0.0171 -0.0014 -0.0105 1477 ASN 108 C 0.0142 -0.0018 -0.0071 1478 ASN 108 C 0.0144 -0.0018 -0.0077 1479 ASN 108 O 0.0140 -0.0018 -0.0068 1480 ASN 108 O 0.0146 -0.0018 -0.0067 1481 ASN 108 CB 0.0209 -0.0012 -0.0066 1482 ASN 108 CB 0.0207 -0.0010 -0.0110 1483 ASN 108 CG 0.0210 -0.0014 -0.0028 1484 ASN 108 CG 0.0226 -0.0006 -0.0144 1485 ASN 108 OD1 0.0218 -0.0014 -0.0023 1486 ASN 108 OD1 0.0256 -0.0003 -0.0150 1487 ASN 108 ND2 0.0200 -0.0017 -0.0001 1488 ASN 108 ND2 0.0210 -0.0006 -0.0169 1489 SER 109 N 0.0093 -0.0025 -0.0088 1490 SER 109 CA 0.0071 -0.0035 -0.0075 1491 SER 109 C 0.0046 -0.0045 -0.0085 1492 SER 109 O 0.0043 -0.0046 -0.0082 1493 SER 109 CB 0.0075 -0.0034 -0.0042 1494 SER 109 OG 0.0056 -0.0042 -0.0028 1495 PHE 110 N -0.0016 -0.0023 -0.0083 1496 PHE 110 CA -0.0029 -0.0037 -0.0088 1497 PHE 110 C -0.0035 -0.0039 -0.0085 1498 PHE 110 O -0.0025 -0.0031 -0.0084 1499 PHE 110 CB -0.0023 -0.0049 -0.0106 1500 PHE 110 CG -0.0018 -0.0050 -0.0111 1501 PHE 110 CD1 -0.0002 -0.0039 -0.0113 1502 PHE 110 CD2 -0.0030 -0.0060 -0.0113 1503 PHE 110 CE1 0.0002 -0.0040 -0.0117 1504 PHE 110 CE2 -0.0025 -0.0060 -0.0117 1505 PHE 110 CZ -0.0010 -0.0050 -0.0119 1506 ARG 111 N -0.0053 -0.0064 -0.0132 1507 ARG 111 CA -0.0037 -0.0008 -0.0102 1508 ARG 111 C -0.0028 0.0001 -0.0082 1509 ARG 111 O -0.0040 -0.0018 -0.0110 1510 ARG 111 CB -0.0047 0.0045 -0.0142 1511 ARG 111 CG -0.0032 0.0109 -0.0118 1512 ARG 111 CD -0.0041 0.0151 -0.0154 1513 ARG 111 NE -0.0031 0.0215 -0.0141 1514 ARG 111 CZ -0.0041 0.0260 -0.0178 1515 ARG 111 NH1 -0.0061 0.0248 -0.0228 1516 ARG 111 NH2 -0.0030 0.0317 -0.0165 1517 LEU 112 N -0.0038 0.0023 -0.0078 1518 LEU 112 CA -0.0034 0.0033 -0.0068 1519 LEU 112 C -0.0034 0.0052 -0.0081 1520 LEU 112 O -0.0032 0.0067 -0.0084 1521 LEU 112 CB -0.0029 0.0038 -0.0046 1522 LEU 112 CG -0.0026 0.0039 -0.0030 1523 LEU 112 CD1 -0.0028 0.0019 -0.0027 1524 LEU 112 CD2 -0.0021 0.0046 -0.0009 1525 GLU 113 N -0.0057 0.0001 -0.0084 1526 GLU 113 CA -0.0027 0.0001 -0.0076 1527 GLU 113 C -0.0003 -0.0004 -0.0052 1528 GLU 113 O -0.0012 -0.0008 -0.0037 1529 GLU 113 CB -0.0039 -0.0003 -0.0061 1530 GLU 113 CG -0.0054 0.0002 -0.0087 1531 GLU 113 CD -0.0064 -0.0002 -0.0072 1532 GLU 113 OE1 -0.0073 0.0003 -0.0093 1533 GLU 113 OE2 -0.0066 -0.0009 -0.0041 1534 LYS 114 N 0.0018 -0.0021 -0.0030 1535 LYS 114 CA 0.0063 -0.0071 -0.0020 1536 LYS 114 C 0.0056 -0.0110 0.0038 1537 LYS 114 O 0.0050 -0.0110 0.0045 1538 LYS 114 CB 0.0117 -0.0081 -0.0072 1539 LYS 114 CG 0.0169 -0.0137 -0.0063 1540 LYS 114 CD 0.0220 -0.0151 -0.0105 1541 LYS 114 CE 0.0256 -0.0141 -0.0162 1542 LYS 114 NZ 0.0313 -0.0177 -0.0184 1543 ILE 115 N 0.0110 -0.0159 0.0047 1544 ILE 115 CA 0.0133 -0.0174 0.0100 1545 ILE 115 C 0.0146 -0.0193 0.0099 1546 ILE 115 O 0.0134 -0.0187 0.0060 1547 ILE 115 CB 0.0115 -0.0135 0.0149 1548 ILE 115 CG1 0.0083 -0.0093 0.0144 1549 ILE 115 CG2 0.0106 -0.0120 0.0157 1550 ILE 115 CD1 0.0070 -0.0059 0.0197 1551 LEU 116 N 0.0207 -0.0209 0.0174 1552 LEU 116 CA 0.0200 -0.0215 0.0160 1553 LEU 116 C 0.0216 -0.0121 0.0231 1554 LEU 116 O 0.0270 -0.0113 0.0314 1555 LEU 116 CB 0.0252 -0.0326 0.0182 1556 LEU 116 CG 0.0237 -0.0365 0.0141 1557 LEU 116 CD1 0.0176 -0.0402 0.0033 1558 LEU 116 CD2 0.0300 -0.0457 0.0189 1559 VAL 117 N 0.0157 -0.0001 0.0165 1560 VAL 117 CA 0.0174 0.0064 0.0185 1561 VAL 117 C 0.0153 0.0092 0.0176 1562 VAL 117 O 0.0105 0.0085 0.0146 1563 VAL 117 CB 0.0149 0.0108 0.0176 1564 VAL 117 CG1 0.0161 0.0179 0.0194 1565 VAL 117 CG2 0.0167 0.0084 0.0184 1566 SER 118 N 0.0153 0.0180 0.0160 1567 SER 118 CA 0.0136 0.0205 0.0142 1568 SER 118 CA 0.0136 0.0208 0.0140 1569 SER 118 C 0.0137 0.0232 0.0128 1570 SER 118 O 0.0165 0.0246 0.0129 1571 SER 118 CB 0.0153 0.0215 0.0142 1572 SER 118 CB 0.0154 0.0218 0.0141 1573 SER 118 OG 0.0138 0.0239 0.0125 1574 SER 118 OG 0.0156 0.0192 0.0155 1575 VAL 119 N 0.0076 0.0197 0.0049 1576 VAL 119 CA 0.0069 0.0195 0.0055 1577 VAL 119 C 0.0066 0.0219 0.0053 1578 VAL 119 O 0.0064 0.0220 0.0054 1579 VAL 119 CB 0.0051 0.0183 0.0074 1580 VAL 119 CG1 0.0042 0.0179 0.0083 1581 VAL 119 CG2 0.0054 0.0158 0.0076 1582 GLY 120 N 0.0053 0.0216 -0.0052 1583 GLY 120 CA 0.0051 0.0185 -0.0064 1584 GLY 120 C 0.0040 0.0143 -0.0060 1585 GLY 120 O 0.0036 0.0140 -0.0052 1586 CYS 121 N 0.0017 0.0103 -0.0128 1587 CYS 121 CA 0.0017 0.0088 -0.0126 1588 CYS 121 C 0.0022 0.0078 -0.0138 1589 CYS 121 O 0.0025 0.0081 -0.0145 1590 CYS 121 CB 0.0012 0.0082 -0.0113 1591 CYS 121 SG 0.0005 0.0091 -0.0098 1592 THR 122 N 0.0079 -0.0050 -0.0156 1593 THR 122 CA 0.0076 -0.0044 -0.0149 1594 THR 122 C 0.0070 -0.0032 -0.0156 1595 THR 122 O 0.0069 -0.0029 -0.0163 1596 THR 122 CB 0.0076 -0.0042 -0.0135 1597 THR 122 OG1 0.0074 -0.0039 -0.0127 1598 THR 122 CG2 0.0072 -0.0034 -0.0133 1599 CYS 123 N 0.0072 -0.0080 -0.0228 1600 CYS 123 CA 0.0054 -0.0091 -0.0233 1601 CYS 123 C 0.0046 -0.0091 -0.0229 1602 CYS 123 O 0.0055 -0.0093 -0.0237 1603 CYS 123 CB 0.0055 -0.0102 -0.0253 1604 CYS 123 SG 0.0032 -0.0116 -0.0259 1605 VAL 124 N 0.0112 -0.0137 -0.0323 1606 VAL 124 CA 0.0088 -0.0126 -0.0302 1607 VAL 124 C 0.0045 -0.0128 -0.0319 1608 VAL 124 O 0.0030 -0.0133 -0.0334 1609 VAL 124 CB 0.0085 -0.0109 -0.0260 1610 VAL 124 CG1 0.0126 -0.0105 -0.0239 1611 VAL 124 CG2 0.0065 -0.0104 -0.0254 1612 THR 125 N -0.0027 -0.0220 -0.0305 1613 THR 125 CA -0.0056 -0.0187 -0.0317 1614 THR 125 C -0.0066 -0.0175 -0.0312 1615 THR 125 O -0.0059 -0.0180 -0.0279 1616 THR 125 CB -0.0070 -0.0168 -0.0285 1617 THR 125 OG1 -0.0063 -0.0173 -0.0244 1618 THR 125 CG2 -0.0062 -0.0177 -0.0288 1619 PRO 126 N -0.0117 -0.0244 -0.0378 1620 PRO 126 CA -0.0152 -0.0243 -0.0321 1621 PRO 126 C -0.0216 -0.0236 -0.0249 1622 PRO 126 O -0.0243 -0.0230 -0.0249 1623 PRO 126 CB -0.0196 -0.0224 -0.0385 1624 PRO 126 CG -0.0147 -0.0226 -0.0470 1625 PRO 126 CD -0.0128 -0.0231 -0.0469 1626 ILE 127 N -0.0408 0.0097 -0.0313 1627 ILE 127 CA -0.0503 0.0101 -0.0228 1628 ILE 127 C -0.0646 0.0080 -0.0244 1629 ILE 127 O -0.0741 0.0056 -0.0309 1630 ILE 127 CB -0.0461 0.0135 -0.0072 1631 ILE 127 CG1 -0.0308 0.0157 -0.0056 1632 ILE 127 CG2 -0.0562 0.0138 0.0012 1633 ILE 127 CD1 -0.0262 0.0191 0.0094 1634 L23 1 C1 0.0009 0.0143 0.0242 1635 L23 1 C2 0.0030 0.0128 0.0244 1636 L23 1 N1 0.0051 0.0145 0.0276 1637 L23 1 N2 0.0066 0.0124 0.0268 1638 L23 1 C3 0.0055 0.0093 0.0232 1639 L23 1 C4 0.0069 0.0066 0.0217 1640 L23 1 C5 0.0032 0.0095 0.0216 1641 L23 1 C6 0.0012 0.0070 0.0178 1642 L23 1 C7 0.0031 0.0038 0.0163 1643 L23 1 C8 0.0012 0.0014 0.0125 1644 L23 1 C9 -0.0027 0.0021 0.0102 1645 L23 1 N3 -0.0044 -0.0006 0.0065 1646 L23 1 C10 -0.0081 -0.0005 0.0038 1647 L23 1 O1 -0.0108 0.0023 0.0043 1648 L23 1 C11 -0.0088 -0.0041 -0.0001 1649 L23 1 N4 -0.0104 -0.0050 -0.0021 1650 L23 1 C12 -0.0080 -0.0071 -0.0023 1651 L23 1 O2 -0.0043 -0.0087 -0.0009 1652 L23 1 C13 -0.0103 -0.0076 -0.0044 1653 L23 1 C14 -0.0144 -0.0062 -0.0063 1654 L23 1 C15 -0.0150 -0.0073 -0.0078 1655 L23 1 N5 -0.0115 -0.0093 -0.0069 1656 L23 1 N6 -0.0085 -0.0094 -0.0048 1657 L23 1 C16 -0.0042 -0.0114 -0.0034 1658 L23 1 C17 -0.0026 -0.0156 -0.0059 1659 L23 1 C18 -0.0035 -0.0111 -0.0025 1660 L23 1 C19 -0.0122 -0.0034 -0.0020 1661 L23 1 C20 -0.0130 -0.0069 -0.0059 1662 L23 1 C21 -0.0158 -0.0079 -0.0089 1663 L23 1 C22 -0.0171 -0.0066 -0.0088 1664 L23 1 C23 -0.0112 -0.0018 0.0002 1665 L23 1 C24 -0.0079 -0.0043 0.0004 1666 L23 1 C25 -0.0124 -0.0026 -0.0015 1667 L23 1 C26 -0.0047 0.0054 0.0118 1668 L23 1 C27 -0.0027 0.0078 0.0155