1 GLY 1 N -0.0093 0.0163 -0.0411 2 GLY 1 CA 0.0043 0.0237 -0.0254 3 GLY 1 C 0.0120 0.0067 -0.0069 4 GLY 1 O 0.0104 -0.0071 -0.0031 5 ARG 2 N 0.0037 0.0026 0.0014 6 ARG 2 CA 0.0107 -0.0028 0.0047 7 ARG 2 C 0.0096 0.0045 0.0131 8 ARG 2 O 0.0024 0.0111 0.0111 9 ARG 2 CB 0.0101 -0.0092 -0.0050 10 ARG 2 CG 0.0183 -0.0167 -0.0026 11 ARG 2 CD 0.0179 -0.0229 -0.0119 12 ARG 2 NE 0.0187 -0.0300 -0.0204 13 ARG 2 CZ 0.0220 -0.0386 -0.0273 14 ARG 2 NH1 0.0247 -0.0419 -0.0276 15 ARG 2 NH2 0.0223 -0.0441 -0.0343 16 ILE 3 N 0.0125 0.0222 0.0530 17 ILE 3 CA -0.0079 -0.0057 0.0177 18 ILE 3 C -0.0182 -0.0147 -0.0245 19 ILE 3 O -0.0030 0.0150 -0.0408 20 ILE 3 CB 0.0016 0.0149 -0.0025 21 ILE 3 CG1 0.0068 0.0149 0.0408 22 ILE 3 CG2 -0.0181 -0.0097 -0.0473 23 ILE 3 CD1 0.0201 0.0408 0.0270 24 ALA 4 N -0.0279 -0.0016 -0.0135 25 ALA 4 CA -0.0291 0.0005 -0.0144 26 ALA 4 C -0.0369 0.0141 -0.0193 27 ALA 4 O -0.0448 0.0164 -0.0299 28 ALA 4 CB -0.0300 -0.0131 -0.0223 29 SER 5 N -0.0354 -0.0049 -0.0161 30 SER 5 CA -0.0493 0.0251 -0.0148 31 SER 5 C -0.0568 0.0394 -0.0148 32 SER 5 O -0.0726 0.0625 -0.0179 33 SER 5 CB -0.0339 0.0435 0.0057 34 SER 5 OG -0.0110 0.0423 0.0240 35 ILE 6 N -0.0175 0.0104 -0.0111 36 ILE 6 CA -0.0169 0.0081 -0.0115 37 ILE 6 C -0.0171 0.0007 -0.0210 38 ILE 6 O -0.0154 -0.0072 -0.0226 39 ILE 6 CB -0.0134 0.0033 -0.0014 40 ILE 6 CG1 -0.0134 0.0114 0.0080 41 ILE 6 CG2 -0.0126 -0.0004 -0.0022 42 ILE 6 CD1 -0.0097 0.0066 0.0186 43 PRO 7 N -0.0150 -0.0039 -0.0224 44 PRO 7 CA -0.0135 -0.0098 -0.0293 45 PRO 7 C -0.0075 -0.0186 -0.0265 46 PRO 7 O -0.0049 -0.0195 -0.0192 47 PRO 7 CB -0.0165 -0.0053 -0.0304 48 PRO 7 CG -0.0215 0.0041 -0.0285 49 PRO 7 CD -0.0195 0.0045 -0.0210 50 GLY 8 N -0.0069 -0.0100 -0.0144 51 GLY 8 CA -0.0067 -0.0144 -0.0132 52 GLY 8 C -0.0101 -0.0126 -0.0100 53 GLY 8 O -0.0096 -0.0150 -0.0096 54 GLU 9 N -0.0105 -0.0067 -0.0080 55 GLU 9 CA -0.0120 -0.0062 -0.0037 56 GLU 9 C -0.0129 -0.0057 -0.0004 57 GLU 9 O -0.0160 -0.0069 0.0020 58 GLU 9 CB -0.0090 -0.0038 -0.0026 59 GLU 9 CG -0.0101 -0.0030 0.0017 60 GLU 9 CD -0.0070 -0.0006 0.0024 61 GLU 9 OE1 -0.0040 0.0005 -0.0003 62 GLU 9 OE2 -0.0075 0.0002 0.0058 63 ALA 10 N -0.0228 0.0007 -0.0016 64 ALA 10 CA -0.0231 0.0011 -0.0003 65 ALA 10 C -0.0246 -0.0011 -0.0016 66 ALA 10 O -0.0261 -0.0019 0.0001 67 ALA 10 CB -0.0206 0.0035 -0.0008 68 GLU 11 N -0.0181 -0.0060 0.0013 69 GLU 11 CA -0.0173 -0.0071 0.0007 70 GLU 11 C -0.0201 -0.0082 0.0010 71 GLU 11 O -0.0202 -0.0076 0.0012 72 GLU 11 CB -0.0152 -0.0097 -0.0010 73 GLU 11 CG -0.0135 -0.0109 -0.0019 74 GLU 11 CD -0.0120 -0.0138 -0.0035 75 GLU 11 OE1 -0.0120 -0.0148 -0.0039 76 GLU 11 OE2 -0.0110 -0.0152 -0.0043 77 TYR 12 N -0.0049 -0.0050 0.0040 78 TYR 12 CA -0.0056 -0.0062 0.0047 79 TYR 12 C -0.0086 -0.0043 0.0045 80 TYR 12 O -0.0100 -0.0054 0.0052 81 TYR 12 CB -0.0064 -0.0098 0.0062 82 TYR 12 CG -0.0032 -0.0118 0.0064 83 TYR 12 CD1 -0.0008 -0.0125 0.0062 84 TYR 12 CD2 -0.0025 -0.0129 0.0067 85 TYR 12 CE1 0.0023 -0.0142 0.0062 86 TYR 12 CE2 0.0006 -0.0145 0.0067 87 TYR 12 CZ 0.0030 -0.0151 0.0065 88 TYR 12 OH 0.0062 -0.0166 0.0064 89 LEU 13 N -0.0216 -0.0098 0.0186 90 LEU 13 CA -0.0221 -0.0096 0.0218 91 LEU 13 C -0.0271 -0.0092 0.0242 92 LEU 13 O -0.0287 -0.0090 0.0263 93 LEU 13 CB -0.0181 -0.0096 0.0256 94 LEU 13 CG -0.0177 -0.0095 0.0286 95 LEU 13 CD1 -0.0164 -0.0097 0.0254 96 LEU 13 CD2 -0.0138 -0.0095 0.0326 97 GLY 14 N -0.0243 -0.0089 0.0416 98 GLY 14 CA -0.0360 0.0040 0.0441 99 GLY 14 C -0.0423 0.0089 0.0409 100 GLY 14 O -0.0519 0.0196 0.0432 101 ARG 15 N -0.0107 -0.0040 0.0184 102 ARG 15 CA -0.0092 -0.0080 0.0175 103 ARG 15 C -0.0105 -0.0103 0.0189 104 ARG 15 O -0.0090 -0.0127 0.0178 105 ARG 15 CB -0.0057 -0.0079 0.0146 106 ARG 15 CG -0.0038 -0.0061 0.0129 107 ARG 15 CD -0.0004 -0.0071 0.0102 108 ARG 15 NE 0.0007 -0.0051 0.0091 109 ARG 15 CZ 0.0031 -0.0064 0.0072 110 ARG 15 NH1 0.0047 -0.0098 0.0063 111 ARG 15 NH2 0.0039 -0.0043 0.0064 112 GLY 16 N -0.0107 0.0005 0.0135 113 GLY 16 CA -0.0077 0.0048 0.0118 114 GLY 16 C -0.0036 0.0041 0.0120 115 GLY 16 O 0.0006 0.0060 0.0112 116 VAL 17 N -0.0118 -0.0019 0.0094 117 VAL 17 CA -0.0086 -0.0018 0.0101 118 VAL 17 C -0.0082 -0.0025 0.0130 119 VAL 17 O -0.0096 -0.0032 0.0153 120 VAL 17 CB -0.0068 -0.0016 0.0103 121 VAL 17 CG1 -0.0034 -0.0015 0.0112 122 VAL 17 CG2 -0.0070 -0.0009 0.0072 123 SER 18 N -0.0019 0.0037 0.0154 124 SER 18 CA -0.0016 0.0034 0.0157 125 SER 18 C -0.0001 0.0027 0.0152 126 SER 18 O 0.0006 0.0027 0.0144 127 SER 18 CB -0.0023 0.0041 0.0151 128 SER 18 OG -0.0021 0.0038 0.0154 129 TYR 19 N -0.0069 0.0018 0.0103 130 TYR 19 CA -0.0029 -0.0010 0.0085 131 TYR 19 C -0.0007 -0.0007 0.0061 132 TYR 19 O 0.0024 -0.0035 0.0052 133 TYR 19 CB -0.0022 -0.0057 0.0113 134 TYR 19 CG -0.0045 -0.0062 0.0140 135 TYR 19 CD1 -0.0035 -0.0060 0.0129 136 TYR 19 CD2 -0.0076 -0.0072 0.0178 137 TYR 19 CE1 -0.0057 -0.0066 0.0155 138 TYR 19 CE2 -0.0097 -0.0078 0.0203 139 TYR 19 CZ -0.0088 -0.0074 0.0192 140 TYR 19 OH -0.0110 -0.0080 0.0217 141 CYS 20 N -0.0070 0.0052 0.0025 142 CYS 20 CA -0.0020 0.0043 0.0006 143 CYS 20 C 0.0015 0.0080 0.0019 144 CYS 20 O 0.0023 0.0084 0.0019 145 CYS 20 CB -0.0014 0.0002 -0.0022 146 CYS 20 SG 0.0045 -0.0016 -0.0050 147 ALA 21 N 0.0052 0.0092 -0.0009 148 ALA 21 CA 0.0068 0.0091 0.0006 149 ALA 21 C 0.0087 0.0079 0.0004 150 ALA 21 O 0.0101 0.0072 0.0009 151 ALA 21 CB 0.0065 0.0105 0.0026 152 THR 22 N 0.0069 0.0004 -0.0069 153 THR 22 CA 0.0148 0.0029 -0.0152 154 THR 22 C 0.0134 0.0048 -0.0124 155 THR 22 O 0.0197 0.0112 -0.0164 156 THR 22 CB 0.0188 -0.0067 -0.0257 157 THR 22 OG1 0.0124 -0.0186 -0.0247 158 THR 22 CG2 0.0223 -0.0066 -0.0299 159 CYS 23 N 0.0247 -0.0017 0.0008 160 CYS 23 CA 0.0183 -0.0101 -0.0023 161 CYS 23 C 0.0128 0.0062 0.0066 162 CYS 23 O 0.0217 0.0076 0.0059 163 CYS 23 CB -0.0015 -0.0257 -0.0069 164 CYS 23 SG -0.0037 -0.0440 -0.0156 165 ASP 24 N 0.0100 0.0065 0.0111 166 ASP 24 CA 0.0091 0.0087 0.0131 167 ASP 24 C 0.0114 0.0122 0.0159 168 ASP 24 O 0.0112 0.0142 0.0177 169 ASP 24 CB 0.0041 0.0091 0.0141 170 ASP 24 CG 0.0014 0.0058 0.0115 171 ASP 24 OD1 0.0033 0.0032 0.0090 172 ASP 24 OD2 -0.0027 0.0059 0.0122 173 GLY 25 N 0.0164 0.0087 0.0140 174 GLY 25 CA 0.0157 0.0064 0.0144 175 GLY 25 C 0.0149 0.0026 0.0143 176 GLY 25 O 0.0151 0.0004 0.0131 177 ALA 26 N 0.0161 0.0024 0.0193 178 ALA 26 CA 0.0165 0.0026 0.0193 179 ALA 26 C 0.0132 0.0037 0.0189 180 ALA 26 O 0.0133 0.0054 0.0189 181 ALA 26 CB 0.0179 -0.0010 0.0195 182 PHE 27 N 0.0122 0.0037 0.0327 183 PHE 27 CA 0.0107 0.0006 0.0248 184 PHE 27 C 0.0092 0.0057 0.0248 185 PHE 27 O 0.0086 0.0027 0.0199 186 PHE 27 CB 0.0075 0.0018 0.0156 187 PHE 27 CG 0.0089 -0.0031 0.0154 188 PHE 27 CD1 0.0086 0.0017 0.0190 189 PHE 27 CD2 0.0105 -0.0124 0.0117 190 PHE 27 CE1 0.0098 -0.0025 0.0189 191 PHE 27 CE2 0.0117 -0.0167 0.0115 192 PHE 27 CZ 0.0114 -0.0118 0.0152 193 TYR 28 N 0.0022 0.0025 0.0172 194 TYR 28 CA 0.0027 0.0050 0.0142 195 TYR 28 C 0.0026 0.0044 0.0150 196 TYR 28 O 0.0037 0.0068 0.0136 197 TYR 28 CB 0.0055 0.0090 0.0140 198 TYR 28 CG 0.0053 0.0096 0.0126 199 TYR 28 CD1 0.0038 0.0100 0.0084 200 TYR 28 CD2 0.0065 0.0095 0.0154 201 TYR 28 CE1 0.0034 0.0102 0.0072 202 TYR 28 CE2 0.0061 0.0097 0.0142 203 TYR 28 CZ 0.0046 0.0100 0.0101 204 TYR 28 OH 0.0041 0.0101 0.0089 205 ARG 29 N 0.0074 0.0006 0.0159 206 ARG 29 CA 0.0054 0.0022 0.0118 207 ARG 29 C 0.0044 0.0030 0.0106 208 ARG 29 O 0.0030 0.0047 0.0132 209 ARG 29 CB 0.0024 0.0051 0.0120 210 ARG 29 CG 0.0007 0.0064 0.0074 211 ARG 29 CD -0.0025 0.0094 0.0073 212 ARG 29 NE -0.0018 0.0090 0.0097 213 ARG 29 CZ -0.0005 0.0075 0.0078 214 ARG 29 NH1 0.0003 0.0064 0.0036 215 ARG 29 NH2 0.0001 0.0072 0.0103 216 ASN 30 N 0.0023 -0.0032 0.0064 217 ASN 30 CA 0.0017 -0.0015 0.0071 218 ASN 30 C -0.0040 0.0025 -0.0023 219 ASN 30 O -0.0041 0.0002 -0.0058 220 ASN 30 CB 0.0075 -0.0107 0.0094 221 ASN 30 CG 0.0124 -0.0121 0.0206 222 ASN 30 OD1 0.0168 -0.0188 0.0228 223 ASN 30 ND2 0.0117 -0.0054 0.0282 224 ARG 31 N -0.0069 0.0035 0.0002 225 ARG 31 CA -0.0035 0.0055 -0.0039 226 ARG 31 C 0.0017 0.0094 -0.0050 227 ARG 31 O 0.0030 0.0109 -0.0014 228 ARG 31 CB -0.0028 0.0065 -0.0007 229 ARG 31 CG -0.0079 0.0027 0.0001 230 ARG 31 CD -0.0072 0.0035 0.0022 231 ARG 31 NE -0.0124 -0.0003 0.0038 232 ARG 31 CZ -0.0155 -0.0033 -0.0006 233 ARG 31 NH1 -0.0141 -0.0030 -0.0069 234 ARG 31 NH2 -0.0201 -0.0066 0.0014 235 GLU 32 N -0.0046 0.0059 -0.0049 236 GLU 32 CA -0.0048 0.0053 -0.0049 237 GLU 32 C -0.0031 0.0110 -0.0049 238 GLU 32 O 0.0010 0.0138 -0.0057 239 GLU 32 CB -0.0009 0.0006 -0.0064 240 GLU 32 CG -0.0022 -0.0055 -0.0066 241 GLU 32 CD -0.0058 -0.0092 -0.0059 242 GLU 32 OE1 -0.0104 -0.0110 -0.0048 243 GLU 32 OE2 -0.0041 -0.0102 -0.0065 244 VAL 33 N -0.0058 0.0075 -0.0030 245 VAL 33 CA -0.0054 0.0088 -0.0028 246 VAL 33 C -0.0050 0.0096 -0.0029 247 VAL 33 O -0.0053 0.0092 -0.0027 248 VAL 33 CB -0.0060 0.0094 -0.0017 249 VAL 33 CG1 -0.0064 0.0086 -0.0016 250 VAL 33 CG2 -0.0067 0.0094 -0.0007 251 VAL 34 N -0.0049 0.0102 -0.0030 252 VAL 34 CA -0.0028 0.0100 -0.0035 253 VAL 34 C -0.0017 0.0100 -0.0019 254 VAL 34 O -0.0020 0.0101 -0.0000 255 VAL 34 CB -0.0018 0.0099 -0.0036 256 VAL 34 CG1 0.0005 0.0097 -0.0041 257 VAL 34 CG2 -0.0029 0.0100 -0.0052 258 VAL 35 N -0.0068 -0.0011 -0.0000 259 VAL 35 CA -0.0059 -0.0028 -0.0003 260 VAL 35 C -0.0045 -0.0054 0.0001 261 VAL 35 O -0.0041 -0.0063 -0.0011 262 VAL 35 CB -0.0061 -0.0026 -0.0033 263 VAL 35 CG1 -0.0051 -0.0046 -0.0036 264 VAL 35 CG2 -0.0075 0.0001 -0.0035 265 VAL 36 N 0.0018 -0.0006 0.0036 266 VAL 36 CA 0.0023 -0.0023 0.0041 267 VAL 36 C 0.0028 -0.0036 0.0033 268 VAL 36 O 0.0028 -0.0036 0.0036 269 VAL 36 CB 0.0022 -0.0026 0.0061 270 VAL 36 CG1 0.0026 -0.0041 0.0066 271 VAL 36 CG2 0.0016 -0.0010 0.0071 272 GLY 37 N -0.0001 -0.0165 0.0005 273 GLY 37 CA 0.0004 -0.0188 -0.0008 274 GLY 37 C 0.0015 -0.0186 -0.0032 275 GLY 37 O 0.0021 -0.0166 -0.0042 276 LEU 38 N 0.0076 -0.0272 -0.0054 277 LEU 38 CA 0.0103 -0.0265 -0.0061 278 LEU 38 C 0.0116 -0.0292 -0.0068 279 LEU 38 O 0.0109 -0.0304 -0.0067 280 LEU 38 CB 0.0100 -0.0245 -0.0058 281 LEU 38 CG 0.0126 -0.0235 -0.0065 282 LEU 38 CD1 0.0147 -0.0222 -0.0070 283 LEU 38 CD2 0.0119 -0.0215 -0.0061 284 ASN 39 N 0.0029 -0.0171 -0.0092 285 ASN 39 CA 0.0010 -0.0146 -0.0097 286 ASN 39 C -0.0052 -0.0093 -0.0128 287 ASN 39 O -0.0068 -0.0075 -0.0134 288 ASN 39 CB 0.0050 -0.0112 -0.0038 289 ASN 39 CG 0.0067 -0.0061 0.0007 290 ASN 39 OD1 0.0030 -0.0007 0.0002 291 ASN 39 ND2 0.0124 -0.0081 0.0053 292 PRO 40 N -0.0094 -0.0008 -0.0076 293 PRO 40 CA -0.0201 0.0069 -0.0117 294 PRO 40 C -0.0257 0.0170 -0.0044 295 PRO 40 O -0.0342 0.0219 -0.0095 296 PRO 40 CB -0.0203 0.0070 -0.0119 297 PRO 40 CG -0.0108 -0.0037 -0.0143 298 PRO 40 CD -0.0032 -0.0066 -0.0073 299 GLU 41 N -0.0190 0.0282 -0.0032 300 GLU 41 CA -0.0191 0.0313 -0.0013 301 GLU 41 C -0.0186 0.0287 -0.0027 302 GLU 41 O -0.0216 0.0298 -0.0031 303 GLU 41 CB -0.0147 0.0341 0.0019 304 GLU 41 CG -0.0148 0.0382 0.0044 305 GLU 41 CD -0.0101 0.0405 0.0075 306 GLU 41 OE1 -0.0063 0.0386 0.0075 307 GLU 41 OE2 -0.0101 0.0442 0.0098 308 ALA 42 N -0.0092 0.0115 -0.0056 309 ALA 42 CA -0.0054 0.0055 -0.0048 310 ALA 42 C -0.0121 0.0011 -0.0072 311 ALA 42 O -0.0110 0.0007 -0.0069 312 ALA 42 CB 0.0002 -0.0019 -0.0036 313 VAL 43 N -0.0130 0.0014 -0.0090 314 VAL 43 CA -0.0162 -0.0002 -0.0101 315 VAL 43 C -0.0201 0.0001 -0.0081 316 VAL 43 O -0.0228 -0.0015 -0.0094 317 VAL 43 CB -0.0157 -0.0001 -0.0101 318 VAL 43 CG1 -0.0193 -0.0015 -0.0108 319 VAL 43 CG2 -0.0123 -0.0009 -0.0127 320 GLU 44 N -0.0267 -0.0085 -0.0090 321 GLU 44 CA -0.0480 0.0118 -0.0050 322 GLU 44 C -0.0197 0.0154 -0.0087 323 GLU 44 O -0.0334 0.0048 -0.0074 324 GLU 44 CB -0.0671 0.0553 0.0000 325 GLU 44 CG -0.1042 0.0470 0.0046 326 GLU 44 CD -0.1205 0.0876 0.0091 327 GLU 44 OE1 -0.1317 0.1191 0.0124 328 GLU 44 OE2 -0.1234 0.0865 0.0094 329 GLU 45 N -0.0136 0.0133 -0.0048 330 GLU 45 CA -0.0099 0.0119 -0.0068 331 GLU 45 C -0.0086 0.0061 -0.0073 332 GLU 45 O -0.0077 0.0038 -0.0077 333 GLU 45 CB -0.0055 0.0152 -0.0091 334 GLU 45 CG -0.0062 0.0211 -0.0089 335 GLU 45 CD -0.0063 0.0220 -0.0089 336 GLU 45 OE1 -0.0026 0.0235 -0.0109 337 GLU 45 OE2 -0.0099 0.0210 -0.0070 338 ALA 46 N -0.0100 -0.0001 -0.0091 339 ALA 46 CA -0.0080 -0.0058 -0.0060 340 ALA 46 C -0.0094 -0.0090 -0.0026 341 ALA 46 O -0.0059 -0.0133 -0.0017 342 ALA 46 CB -0.0103 -0.0069 -0.0035 343 GLN 47 N -0.0141 0.0098 -0.0037 344 GLN 47 CA -0.0105 0.0058 0.0019 345 GLN 47 C -0.0047 0.0012 -0.0030 346 GLN 47 O -0.0002 -0.0033 0.0010 347 GLN 47 CB -0.0151 0.0093 0.0065 348 GLN 47 CG -0.0211 0.0139 0.0124 349 GLN 47 CD -0.0234 0.0151 0.0192 350 GLN 47 OE1 -0.0202 0.0113 0.0256 351 GLN 47 NE2 -0.0288 0.0201 0.0177 352 VAL 48 N -0.0056 -0.0152 -0.0049 353 VAL 48 CA -0.0016 -0.0146 -0.0074 354 VAL 48 C 0.0036 -0.0186 -0.0069 355 VAL 48 O 0.0059 -0.0208 -0.0063 356 VAL 48 CB -0.0007 -0.0097 -0.0116 357 VAL 48 CG1 0.0038 -0.0093 -0.0142 358 VAL 48 CG2 -0.0060 -0.0060 -0.0118 359 LEU 49 N -0.0037 -0.0052 -0.0003 360 LEU 49 CA -0.0003 -0.0072 0.0003 361 LEU 49 C -0.0010 -0.0108 0.0014 362 LEU 49 O 0.0013 -0.0120 0.0017 363 LEU 49 CB 0.0023 -0.0080 0.0005 364 LEU 49 CG 0.0040 -0.0044 -0.0006 365 LEU 49 CD1 0.0058 -0.0052 -0.0003 366 LEU 49 CD2 0.0069 -0.0025 -0.0012 367 THR 50 N 0.0055 -0.0231 -0.0033 368 THR 50 CA 0.0063 -0.0231 -0.0018 369 THR 50 C 0.0079 -0.0234 -0.0019 370 THR 50 O 0.0088 -0.0234 -0.0007 371 THR 50 CB 0.0054 -0.0228 -0.0007 372 THR 50 OG1 0.0051 -0.0228 -0.0015 373 THR 50 CG2 0.0038 -0.0224 -0.0002 374 LYS 51 N 0.0174 -0.0107 -0.0042 375 LYS 51 CA 0.0205 -0.0114 -0.0048 376 LYS 51 C 0.0145 -0.0110 -0.0036 377 LYS 51 O 0.0161 -0.0110 -0.0039 378 LYS 51 CB 0.0242 -0.0191 -0.0054 379 LYS 51 CG 0.0304 -0.0201 -0.0067 380 LYS 51 CD 0.0331 -0.0282 -0.0071 381 LYS 51 CE 0.0396 -0.0291 -0.0084 382 LYS 51 NZ 0.0376 -0.0330 -0.0079 383 PHE 52 N 0.0094 -0.0078 0.0005 384 PHE 52 CA 0.0083 -0.0057 0.0032 385 PHE 52 C 0.0079 -0.0054 0.0047 386 PHE 52 O 0.0071 -0.0028 0.0053 387 PHE 52 CB 0.0082 -0.0070 0.0057 388 PHE 52 CG 0.0086 -0.0076 0.0044 389 PHE 52 CD1 0.0081 -0.0051 0.0034 390 PHE 52 CD2 0.0094 -0.0106 0.0043 391 PHE 52 CE1 0.0085 -0.0056 0.0023 392 PHE 52 CE2 0.0098 -0.0111 0.0032 393 PHE 52 CZ 0.0093 -0.0086 0.0021 394 ALA 53 N -0.0035 -0.0056 0.0048 395 ALA 53 CA -0.0040 -0.0050 0.0047 396 ALA 53 C -0.0037 -0.0046 0.0052 397 ALA 53 O -0.0033 -0.0043 0.0058 398 ALA 53 CB -0.0046 -0.0045 0.0045 399 SER 54 N -0.0082 0.0019 0.0038 400 SER 54 CA -0.0083 -0.0021 0.0036 401 SER 54 C -0.0089 -0.0063 0.0032 402 SER 54 O -0.0113 -0.0091 0.0020 403 SER 54 CB -0.0042 -0.0029 0.0054 404 SER 54 OG -0.0038 0.0003 0.0057 405 THR 55 N -0.0203 -0.0084 -0.0014 406 THR 55 CA -0.0210 -0.0090 -0.0012 407 THR 55 C -0.0211 -0.0071 -0.0017 408 THR 55 O -0.0196 -0.0059 -0.0021 409 THR 55 CB -0.0196 -0.0106 -0.0010 410 THR 55 OG1 -0.0195 -0.0125 -0.0005 411 THR 55 CG2 -0.0205 -0.0112 -0.0008 412 VAL 56 N -0.0170 -0.0103 -0.0055 413 VAL 56 CA -0.0175 -0.0103 -0.0059 414 VAL 56 C -0.0181 -0.0094 -0.0057 415 VAL 56 O -0.0179 -0.0089 -0.0052 416 VAL 56 CB -0.0171 -0.0105 -0.0056 417 VAL 56 CG1 -0.0176 -0.0104 -0.0060 418 VAL 56 CG2 -0.0164 -0.0114 -0.0058 419 HIS 57 N -0.0235 -0.0063 -0.0096 420 HIS 57 CA -0.0231 -0.0078 -0.0092 421 HIS 57 C -0.0224 -0.0100 -0.0091 422 HIS 57 O -0.0225 -0.0106 -0.0078 423 HIS 57 CB -0.0238 -0.0075 -0.0071 424 HIS 57 CG -0.0246 -0.0054 -0.0069 425 HIS 57 ND1 -0.0244 -0.0050 -0.0080 426 HIS 57 CD2 -0.0254 -0.0038 -0.0059 427 HIS 57 CE1 -0.0252 -0.0030 -0.0075 428 HIS 57 NE2 -0.0258 -0.0023 -0.0063 429 TRP 58 N -0.0201 -0.0164 -0.0067 430 TRP 58 CA -0.0171 -0.0184 -0.0052 431 TRP 58 C -0.0177 -0.0157 -0.0065 432 TRP 58 O -0.0165 -0.0113 -0.0082 433 TRP 58 CB -0.0112 -0.0183 -0.0042 434 TRP 58 CG -0.0078 -0.0212 -0.0023 435 TRP 58 CD1 -0.0094 -0.0249 -0.0010 436 TRP 58 CD2 -0.0023 -0.0205 -0.0016 437 TRP 58 NE1 -0.0051 -0.0265 0.0005 438 TRP 58 CE2 -0.0007 -0.0239 0.0002 439 TRP 58 CE3 0.0014 -0.0173 -0.0023 440 TRP 58 CZ2 0.0045 -0.0242 0.0013 441 TRP 58 CZ3 0.0066 -0.0176 -0.0012 442 TRP 58 CH2 0.0082 -0.0210 0.0006 443 ILE 59 N -0.0148 -0.0065 -0.0026 444 ILE 59 CA -0.0136 -0.0086 -0.0015 445 ILE 59 C -0.0117 -0.0112 -0.0019 446 ILE 59 O -0.0114 -0.0119 -0.0004 447 ILE 59 CB -0.0143 -0.0084 0.0019 448 ILE 59 CG1 -0.0162 -0.0058 0.0022 449 ILE 59 CG2 -0.0128 -0.0108 0.0031 450 ILE 59 CD1 -0.0171 -0.0053 0.0056 451 THR 60 N -0.0079 -0.0263 -0.0032 452 THR 60 CA -0.0048 -0.0269 -0.0026 453 THR 60 C -0.0072 -0.0236 -0.0033 454 THR 60 O -0.0091 -0.0191 -0.0039 455 THR 60 CB 0.0012 -0.0253 -0.0017 456 THR 60 OG1 0.0021 -0.0197 -0.0019 457 THR 60 CG2 0.0037 -0.0285 -0.0010 458 PRO 61 N -0.0077 -0.0220 -0.0053 459 PRO 61 CA -0.0129 -0.0181 -0.0051 460 PRO 61 C -0.0101 -0.0127 -0.0026 461 PRO 61 O -0.0139 -0.0089 -0.0021 462 PRO 61 CB -0.0160 -0.0230 -0.0075 463 PRO 61 CG -0.0102 -0.0281 -0.0080 464 PRO 61 CD -0.0066 -0.0285 -0.0073 465 LYS 62 N -0.0001 -0.0110 -0.0057 466 LYS 62 CA 0.0006 -0.0056 0.0012 467 LYS 62 C 0.0046 -0.0109 0.0078 468 LYS 62 O 0.0064 -0.0182 0.0067 469 LYS 62 CB -0.0004 0.0006 0.0034 470 LYS 62 CG 0.0018 -0.0033 0.0064 471 LYS 62 CD 0.0006 0.0026 0.0080 472 LYS 62 CE -0.0024 0.0040 0.0006 473 LYS 62 NZ -0.0032 0.0092 0.0029 474 ASP 63 N 0.0114 0.0045 0.0038 475 ASP 63 CA 0.0275 -0.0082 0.0260 476 ASP 63 C 0.0352 -0.0178 0.0238 477 ASP 63 O 0.0239 -0.0061 0.0180 478 ASP 63 CB 0.0213 0.0068 0.0545 479 ASP 63 CG 0.0347 -0.0017 0.0806 480 ASP 63 OD1 0.0341 -0.0002 0.0836 481 ASP 63 OD2 0.0452 -0.0094 0.0971 482 PRO 64 N 0.0391 -0.0139 0.0154 483 PRO 64 CA 0.0386 -0.0137 0.0169 484 PRO 64 C 0.0369 -0.0125 0.0215 485 PRO 64 O 0.0363 -0.0117 0.0228 486 PRO 64 CB 0.0398 -0.0184 0.0163 487 PRO 64 CG 0.0411 -0.0207 0.0137 488 PRO 64 CD 0.0403 -0.0185 0.0148 489 HIS 65 N 0.0378 -0.0048 0.0417 490 HIS 65 CA 0.0269 -0.0041 0.0453 491 HIS 65 C 0.0192 0.0035 0.0421 492 HIS 65 O 0.0102 0.0066 0.0430 493 HIS 65 CB 0.0232 -0.0129 0.0539 494 HIS 65 CG 0.0299 -0.0202 0.0573 495 HIS 65 ND1 0.0374 -0.0269 0.0598 496 HIS 65 CD2 0.0297 -0.0217 0.0586 497 HIS 65 CE1 0.0417 -0.0323 0.0626 498 HIS 65 NE2 0.0373 -0.0295 0.0620 499 THR 66 N 0.0214 0.0000 0.0500 500 THR 66 CA 0.0080 0.0074 0.0375 501 THR 66 C 0.0108 0.0082 0.0235 502 THR 66 O -0.0012 0.0141 0.0169 503 THR 66 CB 0.0045 0.0103 0.0271 504 THR 66 OG1 0.0192 0.0054 0.0177 505 THR 66 CG2 -0.0026 0.0116 0.0395 506 LEU 67 N 0.0085 0.0100 0.0023 507 LEU 67 CA 0.0112 0.0080 -0.0025 508 LEU 67 C 0.0151 0.0087 -0.0023 509 LEU 67 O 0.0187 0.0076 -0.0056 510 LEU 67 CB 0.0144 0.0074 -0.0045 511 LEU 67 CG 0.0111 0.0058 -0.0067 512 LEU 67 CD1 0.0150 0.0051 -0.0093 513 LEU 67 CD2 0.0072 0.0033 -0.0104 514 ASP 68 N -0.0157 0.0208 0.0081 515 ASP 68 CA 0.0070 0.0259 0.0092 516 ASP 68 C 0.0395 0.0235 0.0027 517 ASP 68 O 0.0548 0.0086 -0.0117 518 ASP 68 CB -0.0021 0.0131 -0.0001 519 ASP 68 CG 0.0132 0.0252 0.0078 520 ASP 68 OD1 0.0335 0.0156 -0.0030 521 ASP 68 OD2 0.0046 0.0445 0.0249 522 GLY 69 N 0.0084 0.0252 0.0014 523 GLY 69 CA 0.0099 0.0317 -0.0026 524 GLY 69 C 0.0125 0.0383 -0.0026 525 GLY 69 O 0.0145 0.0442 -0.0043 526 HIS 70 N -0.0033 0.0371 -0.0017 527 HIS 70 CA -0.0006 0.0311 -0.0086 528 HIS 70 C 0.0020 0.0316 -0.0070 529 HIS 70 O 0.0083 0.0277 -0.0098 530 HIS 70 CB -0.0088 0.0280 -0.0157 531 HIS 70 CG -0.0060 0.0210 -0.0237 532 HIS 70 ND1 -0.0054 0.0180 -0.0275 533 HIS 70 CD2 -0.0037 0.0169 -0.0284 534 HIS 70 CE1 -0.0027 0.0121 -0.0343 535 HIS 70 NE2 -0.0016 0.0111 -0.0351 536 ALA 71 N 0.0206 0.0144 0.0013 537 ALA 71 CA 0.0260 0.0118 0.0021 538 ALA 71 C 0.0232 0.0058 0.0020 539 ALA 71 O 0.0273 0.0034 0.0026 540 ALA 71 CB 0.0328 0.0085 0.0031 541 ASP 72 N 0.0160 0.0112 -0.0010 542 ASP 72 CA 0.0102 0.0014 -0.0032 543 ASP 72 C 0.0016 -0.0093 -0.0019 544 ASP 72 O -0.0007 -0.0187 -0.0093 545 ASP 72 CB 0.0070 0.0043 0.0053 546 ASP 72 CG 0.0150 0.0126 0.0022 547 ASP 72 OD1 0.0232 0.0172 -0.0055 548 ASP 72 OD2 0.0127 0.0145 0.0080 549 GLU 73 N -0.0454 -0.0030 -0.0135 550 GLU 73 CA -0.0274 0.0075 -0.0169 551 GLU 73 C 0.0096 0.0082 -0.0107 552 GLU 73 O 0.0273 -0.0014 -0.0013 553 GLU 73 CB -0.0371 0.0370 -0.0377 554 GLU 73 CG -0.0236 0.0490 -0.0430 555 GLU 73 CD -0.0332 0.0785 -0.0637 556 GLU 73 OE1 -0.0512 0.0900 -0.0744 557 GLU 73 OE2 -0.0228 0.0894 -0.0688 558 LEU 74 N 0.0124 -0.0049 -0.0038 559 LEU 74 CA 0.0095 -0.0051 -0.0047 560 LEU 74 C 0.0083 -0.0020 -0.0046 561 LEU 74 O 0.0073 -0.0017 -0.0048 562 LEU 74 CB 0.0072 -0.0064 -0.0055 563 LEU 74 CG 0.0040 -0.0066 -0.0065 564 LEU 74 CD1 0.0039 -0.0088 -0.0069 565 LEU 74 CD2 0.0020 -0.0077 -0.0073 566 LEU 75 N 0.0284 -0.0186 0.0087 567 LEU 75 CA 0.0294 -0.0205 0.0045 568 LEU 75 C 0.0250 -0.0201 -0.0005 569 LEU 75 O 0.0245 -0.0210 -0.0037 570 LEU 75 CB 0.0348 -0.0238 0.0024 571 LEU 75 CG 0.0397 -0.0247 0.0068 572 LEU 75 CD1 0.0447 -0.0278 0.0050 573 LEU 75 CD2 0.0404 -0.0248 0.0077 574 ALA 76 N 0.0029 -0.0479 -0.0043 575 ALA 76 CA 0.0029 -0.0483 -0.0040 576 ALA 76 C 0.0879 0.0297 0.0058 577 ALA 76 O 0.1050 0.0303 0.0183 578 ALA 76 CB -0.0876 -0.0329 -0.0831 579 HIS 77 N 0.0300 -0.0119 -0.0078 580 HIS 77 CA 0.0257 -0.0145 -0.0077 581 HIS 77 C 0.0224 -0.0133 -0.0116 582 HIS 77 O 0.0223 -0.0117 -0.0136 583 HIS 77 CB 0.0246 -0.0173 -0.0050 584 HIS 77 CG 0.0211 -0.0204 -0.0037 585 HIS 77 ND1 0.0171 -0.0208 -0.0062 586 HIS 77 CD2 0.0211 -0.0231 -0.0004 587 HIS 77 CE1 0.0147 -0.0236 -0.0044 588 HIS 77 NE2 0.0170 -0.0251 -0.0009 589 PRO 78 N 0.0471 -0.0091 -0.0075 590 PRO 78 CA 0.0235 0.0062 -0.0309 591 PRO 78 C 0.0010 0.0010 -0.0091 592 PRO 78 O -0.0131 0.0117 -0.0264 593 PRO 78 CB -0.0069 0.0199 -0.0478 594 PRO 78 CG 0.0122 0.0149 -0.0451 595 PRO 78 CD 0.0343 -0.0058 -0.0091 596 SER 79 N -0.0021 -0.0100 -0.0059 597 SER 79 CA -0.0070 -0.0120 -0.0055 598 SER 79 C -0.0116 -0.0134 -0.0050 599 SER 79 O -0.0163 -0.0144 -0.0042 600 SER 79 CB -0.0062 -0.0170 -0.0076 601 SER 79 OG -0.0020 -0.0160 -0.0082 602 VAL 80 N -0.0079 -0.0160 -0.0070 603 VAL 80 CA -0.0107 -0.0165 -0.0072 604 VAL 80 C -0.0139 -0.0102 -0.0077 605 VAL 80 O -0.0112 -0.0049 -0.0076 606 VAL 80 CB -0.0057 -0.0188 -0.0067 607 VAL 80 CG1 -0.0083 -0.0186 -0.0070 608 VAL 80 CG2 -0.0038 -0.0258 -0.0063 609 LYS 81 N -0.0271 -0.0126 -0.0069 610 LYS 81 CA -0.0289 -0.0111 -0.0060 611 LYS 81 C -0.0302 -0.0127 -0.0063 612 LYS 81 O -0.0315 -0.0147 -0.0066 613 LYS 81 CB -0.0309 -0.0100 -0.0052 614 LYS 81 CG -0.0297 -0.0079 -0.0047 615 LYS 81 CD -0.0318 -0.0064 -0.0038 616 LYS 81 CE -0.0307 -0.0041 -0.0033 617 LYS 81 NZ -0.0297 -0.0049 -0.0037 618 LEU 82 N -0.0266 -0.0136 -0.0073 619 LEU 82 CA -0.0211 -0.0150 -0.0054 620 LEU 82 C -0.0249 -0.0107 -0.0095 621 LEU 82 O -0.0250 -0.0038 -0.0153 622 LEU 82 CB -0.0102 -0.0125 -0.0059 623 LEU 82 CG -0.0038 -0.0133 -0.0042 624 LEU 82 CD1 -0.0037 -0.0217 0.0027 625 LEU 82 CD2 0.0065 -0.0097 -0.0057 626 TRP 83 N -0.0250 -0.0057 -0.0065 627 TRP 83 CA -0.0264 -0.0039 -0.0084 628 TRP 83 C -0.0206 -0.0050 -0.0068 629 TRP 83 O -0.0209 -0.0083 -0.0034 630 TRP 83 CB -0.0332 -0.0061 -0.0067 631 TRP 83 CG -0.0391 -0.0051 -0.0082 632 TRP 83 CD1 -0.0419 -0.0079 -0.0056 633 TRP 83 CD2 -0.0425 -0.0008 -0.0130 634 TRP 83 NE1 -0.0469 -0.0056 -0.0084 635 TRP 83 CE2 -0.0475 -0.0012 -0.0129 636 TRP 83 CE3 -0.0419 0.0034 -0.0171 637 TRP 83 CZ2 -0.0516 0.0024 -0.0170 638 TRP 83 CZ3 -0.0461 0.0071 -0.0213 639 TRP 83 CH2 -0.0510 0.0066 -0.0212 640 GLU 84 N -0.0212 -0.0046 -0.0072 641 GLU 84 CA -0.0128 -0.0070 -0.0061 642 GLU 84 C -0.0135 -0.0062 -0.0068 643 GLU 84 O -0.0181 -0.0015 -0.0109 644 GLU 84 CB -0.0045 -0.0038 -0.0108 645 GLU 84 CG -0.0048 0.0035 -0.0183 646 GLU 84 CD 0.0045 0.0059 -0.0225 647 GLU 84 OE1 0.0108 0.0025 -0.0199 648 GLU 84 OE2 0.0056 0.0110 -0.0280 649 LYS 85 N -0.0132 -0.0035 -0.0031 650 LYS 85 CA -0.0188 -0.0097 0.0040 651 LYS 85 C -0.0293 -0.0056 0.0141 652 LYS 85 O -0.0346 -0.0040 0.0193 653 LYS 85 CB -0.0162 -0.0074 0.0008 654 LYS 85 CG -0.0057 -0.0111 -0.0094 655 LYS 85 CD -0.0039 -0.0130 -0.0107 656 LYS 85 CE 0.0046 -0.0071 -0.0209 657 LYS 85 NZ 0.0020 0.0071 -0.0214 658 THR 86 N -0.0140 -0.0055 0.0012 659 THR 86 CA -0.0141 -0.0051 0.0022 660 THR 86 C -0.0140 -0.0050 0.0031 661 THR 86 O -0.0141 -0.0050 0.0029 662 THR 86 CB -0.0146 -0.0042 0.0021 663 THR 86 OG1 -0.0150 -0.0034 0.0021 664 THR 86 CG2 -0.0147 -0.0042 0.0012 665 ARG 87 N -0.0040 -0.0087 -0.0151 666 ARG 87 CA 0.0013 -0.0015 0.0044 667 ARG 87 C -0.0079 0.0090 0.0137 668 ARG 87 O -0.0079 0.0070 0.0098 669 ARG 87 CB 0.0217 -0.0099 0.0117 670 ARG 87 CG 0.0289 -0.0050 0.0288 671 ARG 87 CD 0.0443 -0.0066 0.0432 672 ARG 87 NE 0.0605 -0.0204 0.0356 673 ARG 87 CZ 0.0741 -0.0260 0.0406 674 ARG 87 NH1 0.0738 -0.0197 0.0520 675 ARG 87 NH2 0.0885 -0.0381 0.0341 676 LEU 88 N -0.0027 0.0023 0.0014 677 LEU 88 CA -0.0017 0.0027 0.0013 678 LEU 88 C -0.0042 0.0017 0.0018 679 LEU 88 O -0.0058 -0.0001 0.0003 680 LEU 88 CB 0.0004 0.0021 -0.0013 681 LEU 88 CG 0.0015 0.0024 -0.0019 682 LEU 88 CD1 0.0026 0.0044 0.0003 683 LEU 88 CD2 0.0038 0.0019 -0.0045 684 ILE 89 N -0.0037 -0.0085 -0.0053 685 ILE 89 CA -0.0067 -0.0092 -0.0049 686 ILE 89 C -0.0084 -0.0113 -0.0045 687 ILE 89 O -0.0101 -0.0133 -0.0041 688 ILE 89 CB -0.0086 -0.0063 -0.0050 689 ILE 89 CG1 -0.0070 -0.0039 -0.0054 690 ILE 89 CG2 -0.0118 -0.0070 -0.0045 691 ILE 89 CD1 -0.0062 -0.0050 -0.0054 692 ARG 90 N -0.0092 -0.0102 -0.0137 693 ARG 90 CA -0.0063 -0.0098 -0.0156 694 ARG 90 C 0.0021 -0.0069 -0.0179 695 ARG 90 O 0.0060 -0.0037 -0.0152 696 ARG 90 CB -0.0084 -0.0074 -0.0087 697 ARG 90 CG -0.0071 -0.0073 -0.0096 698 ARG 90 CD -0.0117 -0.0062 -0.0030 699 ARG 90 NE -0.0198 -0.0103 -0.0033 700 ARG 90 CZ -0.0248 -0.0102 0.0018 701 ARG 90 NH1 -0.0232 -0.0064 0.0080 702 ARG 90 NH2 -0.0316 -0.0142 0.0004 703 ILE 91 N 0.0066 -0.0018 -0.0130 704 ILE 91 CA 0.0059 -0.0031 -0.0124 705 ILE 91 C 0.0058 -0.0040 -0.0137 706 ILE 91 O 0.0063 -0.0034 -0.0145 707 ILE 91 CB 0.0056 -0.0028 -0.0110 708 ILE 91 CG1 0.0056 -0.0019 -0.0098 709 ILE 91 CG2 0.0048 -0.0042 -0.0105 710 ILE 91 CD1 0.0056 -0.0013 -0.0085 711 LYS 92 N 0.0145 0.0014 -0.0146 712 LYS 92 CA 0.0103 0.0049 -0.0111 713 LYS 92 C 0.0136 0.0066 -0.0124 714 LYS 92 O 0.0195 0.0077 -0.0154 715 LYS 92 CB 0.0089 0.0120 -0.0081 716 LYS 92 CG 0.0051 0.0115 -0.0060 717 LYS 92 CD 0.0047 0.0191 -0.0034 718 LYS 92 CE -0.0020 0.0206 0.0009 719 LYS 92 NZ -0.0040 0.0169 0.0008 720 GLY 93 N 0.0127 0.0006 -0.0023 721 GLY 93 CA 0.0174 0.0045 -0.0043 722 GLY 93 C 0.0191 0.0066 -0.0010 723 GLY 93 O 0.0171 0.0058 0.0037 724 GLU 94 N 0.0299 -0.0087 -0.0056 725 GLU 94 CA 0.0192 -0.0031 0.0053 726 GLU 94 C 0.0167 -0.0026 0.0207 727 GLU 94 O 0.0237 -0.0070 0.0224 728 GLU 94 CB 0.0048 0.0063 -0.0035 729 GLU 94 CG 0.0061 0.0067 -0.0199 730 GLU 94 CD -0.0085 0.0162 -0.0283 731 GLU 94 OE1 -0.0122 0.0188 -0.0338 732 GLU 94 OE2 -0.0159 0.0207 -0.0291 733 GLU 95 N 0.0156 0.0087 0.0862 734 GLU 95 CA 0.0256 0.0012 0.0465 735 GLU 95 C 0.0500 0.0035 0.0197 736 GLU 95 O 0.0430 -0.0092 -0.0141 737 GLU 95 CB 0.0473 0.0108 0.0485 738 GLU 95 CG 0.0556 0.0025 0.0084 739 GLU 95 CD 0.0217 -0.0144 -0.0016 740 GLU 95 OE1 0.0111 -0.0122 0.0212 741 GLU 95 OE2 0.0060 -0.0297 -0.0315 742 ALA 96 N 0.0192 -0.0194 0.0108 743 ALA 96 CA 0.0117 -0.0207 0.0170 744 ALA 96 C 0.0015 -0.0149 0.0223 745 ALA 96 O -0.0045 -0.0100 0.0248 746 ALA 96 CB 0.0123 -0.0332 0.0217 747 GLY 97 N 0.0036 -0.0123 0.0126 748 GLY 97 CA 0.0054 -0.0050 0.0185 749 GLY 97 C 0.0072 -0.0013 0.0157 750 GLY 97 O 0.0079 -0.0027 0.0080 751 VAL 98 N 0.0078 0.0010 0.0007 752 VAL 98 CA 0.0092 0.0029 -0.0006 753 VAL 98 C 0.0086 0.0059 -0.0020 754 VAL 98 O 0.0089 0.0064 -0.0023 755 VAL 98 CB 0.0125 0.0021 -0.0011 756 VAL 98 CG1 0.0140 0.0042 -0.0025 757 VAL 98 CG2 0.0131 -0.0007 0.0002 758 THR 99 N 0.0301 0.0135 -0.0229 759 THR 99 CA 0.0280 0.0160 -0.0277 760 THR 99 C 0.0324 0.0176 -0.0316 761 THR 99 O 0.0320 0.0195 -0.0353 762 THR 99 CB 0.0236 0.0171 -0.0294 763 THR 99 OG1 0.0252 0.0170 -0.0294 764 THR 99 CG2 0.0186 0.0157 -0.0259 765 ALA 100 N 0.0287 0.0227 -0.0289 766 ALA 100 CA 0.0298 0.0246 -0.0292 767 ALA 100 C 0.0297 0.0208 -0.0296 768 ALA 100 O 0.0280 0.0167 -0.0293 769 ALA 100 CB 0.0266 0.0286 -0.0274 770 VAL 101 N 0.0161 0.0152 -0.0211 771 VAL 101 CA 0.0140 0.0151 -0.0214 772 VAL 101 C 0.0125 0.0164 -0.0197 773 VAL 101 O 0.0133 0.0175 -0.0180 774 VAL 101 CB 0.0144 0.0148 -0.0218 775 VAL 101 CG1 0.0156 0.0134 -0.0238 776 VAL 101 CG2 0.0159 0.0158 -0.0201 777 GLU 102 N 0.0072 0.0073 -0.0128 778 GLU 102 CA 0.0048 0.0074 -0.0098 779 GLU 102 C 0.0047 0.0043 -0.0121 780 GLU 102 O 0.0037 0.0003 -0.0139 781 GLU 102 CB 0.0010 0.0057 -0.0066 782 GLU 102 CG -0.0019 0.0059 -0.0030 783 GLU 102 CD -0.0056 0.0038 -0.0002 784 GLU 102 OE1 -0.0058 0.0034 -0.0003 785 GLU 102 OE2 -0.0083 0.0024 0.0020 786 VAL 103 N 0.0018 0.0070 -0.0064 787 VAL 103 CA -0.0005 0.0056 -0.0072 788 VAL 103 C 0.0002 0.0022 -0.0066 789 VAL 103 O 0.0017 0.0005 -0.0058 790 VAL 103 CB -0.0037 0.0057 -0.0086 791 VAL 103 CG1 -0.0044 0.0092 -0.0092 792 VAL 103 CG2 -0.0040 0.0034 -0.0085 793 ARG 104 N 0.0064 -0.0025 -0.0025 794 ARG 104 CA 0.0064 -0.0008 -0.0031 795 ARG 104 C 0.0078 0.0000 -0.0024 796 ARG 104 O 0.0085 -0.0007 -0.0018 797 ARG 104 CB 0.0051 -0.0006 -0.0038 798 ARG 104 CG 0.0049 0.0011 -0.0044 799 ARG 104 CD 0.0040 0.0012 -0.0050 800 ARG 104 NE 0.0024 0.0006 -0.0058 801 ARG 104 CZ 0.0013 0.0003 -0.0064 802 ARG 104 NH1 0.0015 0.0004 -0.0063 803 ARG 104 NH2 -0.0001 -0.0000 -0.0071 804 HIS 105 N 0.0102 -0.0042 0.0064 805 HIS 105 CA -0.0067 0.0028 0.0157 806 HIS 105 C -0.0099 0.0167 0.0077 807 HIS 105 O -0.0000 0.0135 0.0016 808 HIS 105 CB -0.0108 -0.0118 0.0307 809 HIS 105 CG -0.0278 -0.0105 0.0444 810 HIS 105 ND1 -0.0306 -0.0172 0.0520 811 HIS 105 CD2 -0.0419 -0.0033 0.0511 812 HIS 105 CE1 -0.0463 -0.0140 0.0633 813 HIS 105 NE2 -0.0539 -0.0056 0.0633 814 PRO 106 N 0.0139 0.0063 0.0155 815 PRO 106 CA 0.0152 0.0045 0.0167 816 PRO 106 C 0.0152 0.0148 0.0097 817 PRO 106 O 0.0232 0.0220 0.0050 818 PRO 106 CB 0.0280 -0.0017 0.0211 819 PRO 106 CG 0.0295 -0.0076 0.0251 820 PRO 106 CD 0.0239 0.0006 0.0195 821 GLY 107 N 0.0236 0.0324 0.0148 822 GLY 107 CA 0.0184 0.0458 0.0110 823 GLY 107 C 0.0252 0.0283 0.0071 824 GLY 107 O 0.0218 0.0373 -0.0042 825 GLU 108 N 0.0071 0.0123 0.0115 826 GLU 108 CA 0.0054 0.0044 0.0054 827 GLU 108 C 0.0126 0.0041 0.0030 828 GLU 108 O 0.0165 -0.0021 -0.0032 829 GLU 108 CB -0.0060 0.0022 0.0068 830 GLU 108 CG -0.0136 -0.0017 0.0058 831 GLU 108 CD -0.0124 -0.0105 -0.0019 832 GLU 108 OE1 -0.0069 -0.0145 -0.0068 833 GLU 108 OE2 -0.0172 -0.0134 -0.0029 834 SER 109 N -0.0286 0.0241 0.0284 835 SER 109 CA -0.0055 0.0263 0.0161 836 SER 109 C -0.0187 0.0091 0.0112 837 SER 109 O -0.0083 0.0179 0.0115 838 SER 109 CB 0.0246 0.0207 -0.0064 839 SER 109 OG 0.0482 0.0312 -0.0127 840 ASP 110 N -0.0163 0.0131 0.0139 841 ASP 110 CA 0.0099 0.0095 0.0138 842 ASP 110 C 0.0200 0.0106 0.0005 843 ASP 110 O 0.0096 0.0119 0.0013 844 ASP 110 CB 0.0187 0.0033 0.0399 845 ASP 110 CG 0.0156 0.0018 0.0500 846 ASP 110 OD1 0.0280 0.0020 0.0400 847 ASP 110 OD2 0.0012 0.0006 0.0676 848 SER 111 N 0.0029 0.0057 0.0057 849 SER 111 CA 0.0055 0.0046 0.0034 850 SER 111 C 0.0090 0.0057 0.0044 851 SER 111 O 0.0095 0.0070 0.0065 852 SER 111 CB 0.0053 0.0031 0.0008 853 SER 111 OG 0.0021 0.0019 -0.0005 854 GLN 112 N 0.0110 0.0056 -0.0079 855 GLN 112 CA 0.0043 0.0078 -0.0112 856 GLN 112 C 0.0033 0.0229 -0.0102 857 GLN 112 O 0.0008 0.0308 -0.0107 858 GLN 112 CB -0.0086 0.0025 -0.0182 859 GLN 112 CG -0.0141 -0.0016 -0.0214 860 GLN 112 CD -0.0279 -0.0008 -0.0283 861 GLN 112 OE1 -0.0336 0.0100 -0.0302 862 GLN 112 NE2 -0.0334 -0.0126 -0.0322 863 GLU 113 N 0.0060 0.0281 -0.0131 864 GLU 113 CA 0.0091 0.0281 -0.0168 865 GLU 113 C 0.0132 0.0289 -0.0177 866 GLU 113 O 0.0156 0.0302 -0.0145 867 GLU 113 CB 0.0108 0.0287 -0.0158 868 GLU 113 CG 0.0135 0.0285 -0.0200 869 GLU 113 CD 0.0137 0.0286 -0.0198 870 GLU 113 OE1 0.0099 0.0275 -0.0201 871 GLU 113 OE2 0.0176 0.0297 -0.0195 872 LEU 114 N 0.0130 0.0106 -0.0216 873 LEU 114 CA 0.0094 0.0112 -0.0217 874 LEU 114 C 0.0174 0.0185 -0.0278 875 LEU 114 O 0.0174 0.0272 -0.0343 876 LEU 114 CB -0.0042 0.0147 -0.0234 877 LEU 114 CG -0.0137 0.0073 -0.0172 878 LEU 114 CD1 -0.0266 0.0123 -0.0202 879 LEU 114 CD2 -0.0140 -0.0016 -0.0106 880 LEU 115 N 0.0187 0.0082 -0.0237 881 LEU 115 CA 0.0296 0.0077 -0.0335 882 LEU 115 C 0.0222 0.0140 -0.0346 883 LEU 115 O 0.0131 0.0122 -0.0234 884 LEU 115 CB 0.0431 -0.0063 -0.0282 885 LEU 115 CG 0.0514 -0.0135 -0.0266 886 LEU 115 CD1 0.0597 -0.0281 -0.0156 887 LEU 115 CD2 0.0626 -0.0102 -0.0418 888 ALA 116 N 0.0176 0.0105 -0.0243 889 ALA 116 CA 0.0148 0.0133 -0.0212 890 ALA 116 C 0.0157 0.0155 -0.0207 891 ALA 116 O 0.0191 0.0164 -0.0227 892 ALA 116 CB 0.0152 0.0168 -0.0198 893 GLU 117 N 0.0105 0.0156 -0.0105 894 GLU 117 CA 0.0076 0.0142 -0.0054 895 GLU 117 C 0.0112 0.0146 0.0009 896 GLU 117 O 0.0104 0.0139 0.0052 897 GLU 117 CB 0.0011 0.0122 -0.0044 898 GLU 117 CG -0.0034 0.0114 -0.0099 899 GLU 117 CD -0.0089 0.0098 -0.0105 900 GLU 117 OE1 -0.0081 0.0103 -0.0128 901 GLU 117 OE2 -0.0140 0.0081 -0.0084 902 GLY 118 N 0.0050 0.0172 0.0034 903 GLY 118 CA 0.0047 0.0164 0.0024 904 GLY 118 C 0.0044 0.0146 0.0024 905 GLY 118 O 0.0042 0.0141 0.0021 906 VAL 119 N 0.0010 0.0074 0.0036 907 VAL 119 CA 0.0040 0.0084 0.0032 908 VAL 119 C 0.0044 0.0106 0.0065 909 VAL 119 O 0.0048 0.0120 0.0087 910 VAL 119 CB 0.0074 0.0089 0.0015 911 VAL 119 CG1 0.0103 0.0098 0.0009 912 VAL 119 CG2 0.0069 0.0067 -0.0018 913 PHE 120 N 0.0021 0.0107 0.0086 914 PHE 120 CA 0.0020 0.0106 0.0084 915 PHE 120 C 0.0019 0.0103 0.0084 916 PHE 120 O 0.0019 0.0102 0.0083 917 PHE 120 CB 0.0020 0.0108 0.0081 918 PHE 120 CG 0.0021 0.0110 0.0081 919 PHE 120 CD1 0.0022 0.0112 0.0082 920 PHE 120 CD2 0.0021 0.0111 0.0079 921 PHE 120 CE1 0.0023 0.0115 0.0082 922 PHE 120 CE2 0.0022 0.0114 0.0079 923 PHE 120 CZ 0.0023 0.0116 0.0080 924 VAL 121 N 0.0033 0.0082 0.0085 925 VAL 121 CA 0.0046 0.0074 0.0085 926 VAL 121 C 0.0052 0.0072 0.0088 927 VAL 121 O 0.0051 0.0075 0.0099 928 VAL 121 CB 0.0053 0.0073 0.0096 929 VAL 121 CG1 0.0067 0.0065 0.0096 930 VAL 121 CG2 0.0047 0.0076 0.0094 931 TYR 122 N 0.0117 0.0033 0.0059 932 TYR 122 CA 0.0104 0.0032 0.0047 933 TYR 122 C 0.0128 -0.0006 0.0046 934 TYR 122 O 0.0120 -0.0037 0.0019 935 TYR 122 CB 0.0066 0.0034 0.0011 936 TYR 122 CG 0.0042 0.0071 0.0013 937 TYR 122 CD1 0.0035 0.0110 0.0031 938 TYR 122 CD2 0.0029 0.0068 -0.0001 939 TYR 122 CE1 0.0016 0.0146 0.0034 940 TYR 122 CE2 0.0009 0.0104 0.0002 941 TYR 122 CZ 0.0003 0.0143 0.0020 942 TYR 122 OH -0.0016 0.0178 0.0025 943 LEU 123 N 0.0078 -0.0117 0.0050 944 LEU 123 CA 0.0081 -0.0122 0.0051 945 LEU 123 C 0.0092 -0.0164 0.0060 946 LEU 123 O 0.0076 -0.0190 0.0073 947 LEU 123 CB 0.0044 -0.0109 0.0060 948 LEU 123 CG 0.0028 -0.0068 0.0052 949 LEU 123 CD1 -0.0012 -0.0060 0.0063 950 LEU 123 CD2 0.0054 -0.0039 0.0035 951 GLN 124 N -0.0446 -0.0563 -0.0328 952 GLN 124 CA -0.0316 -0.0580 -0.0159 953 GLN 124 C -0.0325 -0.0517 -0.0243 954 GLN 124 O -0.0357 -0.0386 -0.0431 955 GLN 124 CB -0.0096 -0.0458 -0.0048 956 GLN 124 CG -0.0086 -0.0546 0.0065 957 GLN 124 CD 0.0120 -0.0408 0.0143 958 GLN 124 OE1 0.0198 -0.0226 0.0022 959 GLN 124 NE2 0.0208 -0.0499 0.0350 960 GLY 125 N -0.0171 -0.0335 -0.0178 961 GLY 125 CA 0.0190 -0.0102 -0.0272 962 GLY 125 C 0.0352 0.0177 0.0239 963 GLY 125 O 0.0217 0.0213 0.0664 964 SER 126 N 0.0020 0.0098 0.0028 965 SER 126 CA -0.0102 -0.0009 -0.0143 966 SER 126 C -0.0023 0.0049 -0.0261 967 SER 126 O -0.0126 -0.0038 -0.0339 968 SER 126 CB -0.0288 -0.0152 -0.0013 969 SER 126 OG -0.0262 -0.0122 0.0171 970 LYS 127 N 0.0220 0.0171 0.0006 971 LYS 127 CA 0.0159 0.0054 0.0000 972 LYS 127 C 0.0149 -0.0074 0.0136 973 LYS 127 O 0.0192 -0.0067 0.0232 974 LYS 127 CB 0.0066 -0.0008 -0.0150 975 LYS 127 CG 0.0066 0.0110 -0.0295 976 LYS 127 CD 0.0070 0.0154 -0.0339 977 LYS 127 CE 0.0120 0.0315 -0.0416 978 LYS 127 NZ 0.0208 0.0403 -0.0311 979 LYS 127 OXT 0.0093 -0.0187 0.0140