1 PRO 1 N -0.0086 0.0069 0.0010 2 PRO 1 CA -0.0120 0.0079 -0.0027 3 PRO 1 C -0.0143 0.0116 -0.0009 4 PRO 1 O -0.0130 0.0133 0.0031 5 PRO 1 CB -0.0103 0.0043 -0.0051 6 PRO 1 CG -0.0066 0.0029 -0.0015 7 PRO 1 CD -0.0051 0.0036 0.0016 8 GLN 2 N -0.0297 0.0253 -0.0033 9 GLN 2 CA -0.0234 0.0247 -0.0028 10 GLN 2 C -0.0221 0.0173 0.0013 11 GLN 2 O -0.0273 0.0136 0.0031 12 GLN 2 CB -0.0252 0.0278 -0.0045 13 GLN 2 CG -0.0194 0.0262 -0.0034 14 GLN 2 CD -0.0200 0.0306 -0.0059 15 GLN 2 OE1 -0.0226 0.0284 -0.0048 16 GLN 2 NE2 -0.0176 0.0368 -0.0092 17 ILE 3 N -0.0123 0.0127 0.0025 18 ILE 3 CA -0.0115 0.0088 0.0034 19 ILE 3 C -0.0092 0.0035 0.0029 20 ILE 3 O -0.0064 0.0028 -0.0009 21 ILE 3 CB -0.0099 0.0104 0.0002 22 ILE 3 CG1 -0.0122 0.0157 0.0009 23 ILE 3 CG2 -0.0090 0.0062 0.0011 24 ILE 3 CD1 -0.0108 0.0179 -0.0022 25 THR 4 N -0.0052 -0.0025 0.0191 26 THR 4 CA 0.0031 -0.0207 0.0184 27 THR 4 C 0.0037 -0.0216 0.0126 28 THR 4 O -0.0021 -0.0088 0.0141 29 THR 4 CB 0.0067 -0.0303 0.0376 30 THR 4 OG1 0.0022 -0.0216 0.0522 31 THR 4 CG2 0.0069 -0.0311 0.0428 32 LEU 5 N -0.0003 -0.0304 0.0069 33 LEU 5 CA 0.0017 -0.0325 -0.0012 34 LEU 5 C 0.0019 -0.0409 0.0025 35 LEU 5 O 0.0039 -0.0461 -0.0041 36 LEU 5 CB 0.0044 -0.0360 -0.0118 37 LEU 5 CG 0.0044 -0.0269 -0.0169 38 LEU 5 CD1 0.0069 -0.0312 -0.0260 39 LEU 5 CD2 0.0042 -0.0173 -0.0210 40 TRP 6 N 0.0071 -0.0430 0.0183 41 TRP 6 CA 0.0110 -0.0518 0.0318 42 TRP 6 C 0.0056 -0.0328 0.0269 43 TRP 6 O 0.0074 -0.0409 0.0249 44 TRP 6 CB 0.0155 -0.0545 0.0620 45 TRP 6 CG 0.0205 -0.0715 0.0683 46 TRP 6 CD1 0.0191 -0.0635 0.0733 47 TRP 6 CD2 0.0277 -0.0996 0.0703 48 TRP 6 NE1 0.0250 -0.0848 0.0782 49 TRP 6 CE2 0.0304 -0.1070 0.0765 50 TRP 6 CE3 0.0321 -0.1189 0.0671 51 TRP 6 CZ2 0.0373 -0.1334 0.0797 52 TRP 6 CZ3 0.0391 -0.1452 0.0707 53 TRP 6 CH2 0.0416 -0.1521 0.0767 54 GLN 7 N 0.0061 -0.0200 0.0229 55 GLN 7 CA 0.0023 -0.0050 0.0165 56 GLN 7 C -0.0032 0.0009 -0.0010 57 GLN 7 O -0.0039 -0.0047 -0.0063 58 GLN 7 CB 0.0037 0.0110 0.0299 59 GLN 7 CG 0.0095 0.0058 0.0489 60 GLN 7 CD 0.0113 -0.0043 0.0503 61 GLN 7 OE1 0.0084 0.0001 0.0417 62 GLN 7 NE2 0.0161 -0.0181 0.0611 63 ARG 8 N -0.0096 0.0155 -0.0133 64 ARG 8 CA -0.0148 0.0171 -0.0196 65 ARG 8 C -0.0093 0.0192 -0.0144 66 ARG 8 O -0.0020 0.0261 -0.0093 67 ARG 8 CB -0.0184 0.0277 -0.0278 68 ARG 8 CG -0.0248 0.0259 -0.0340 69 ARG 8 CD -0.0279 0.0367 -0.0418 70 ARG 8 NE -0.0344 0.0346 -0.0479 71 ARG 8 CZ -0.0375 0.0428 -0.0547 72 ARG 8 NH1 -0.0348 0.0539 -0.0563 73 ARG 8 NH2 -0.0434 0.0400 -0.0599 74 PRO 9 N -0.0126 0.0157 -0.0168 75 PRO 9 CA -0.0103 0.0163 -0.0145 76 PRO 9 C -0.0091 0.0196 -0.0161 77 PRO 9 O -0.0096 0.0197 -0.0168 78 PRO 9 CB -0.0120 0.0133 -0.0137 79 PRO 9 CG -0.0151 0.0124 -0.0168 80 PRO 9 CD -0.0155 0.0131 -0.0179 81 VAL 10 N -0.0063 0.0217 -0.0169 82 VAL 10 CA -0.0038 0.0209 -0.0175 83 VAL 10 C -0.0005 0.0188 -0.0169 84 VAL 10 O 0.0008 0.0189 -0.0180 85 VAL 10 CB -0.0033 0.0228 -0.0210 86 VAL 10 CG1 -0.0006 0.0219 -0.0217 87 VAL 10 CG2 -0.0067 0.0248 -0.0215 88 VAL 11 N -0.0007 0.0152 -0.0172 89 VAL 11 CA 0.0018 0.0134 -0.0166 90 VAL 11 C 0.0038 0.0127 -0.0171 91 VAL 11 O 0.0031 0.0132 -0.0174 92 VAL 11 CB 0.0013 0.0119 -0.0138 93 VAL 11 CG1 -0.0005 0.0126 -0.0132 94 VAL 11 CG2 0.0000 0.0115 -0.0119 95 THR 12 N 0.0064 0.0106 -0.0183 96 THR 12 CA 0.0083 0.0093 -0.0185 97 THR 12 C 0.0083 0.0072 -0.0157 98 THR 12 O 0.0085 0.0059 -0.0142 99 THR 12 CB 0.0112 0.0086 -0.0205 100 THR 12 OG1 0.0112 0.0106 -0.0232 101 THR 12 CG2 0.0131 0.0071 -0.0204 102 ILE 13 N 0.0082 0.0067 -0.0151 103 ILE 13 CA 0.0084 0.0046 -0.0127 104 ILE 13 C 0.0107 0.0033 -0.0133 105 ILE 13 O 0.0117 0.0042 -0.0154 106 ILE 13 CB 0.0059 0.0051 -0.0108 107 ILE 13 CG1 0.0055 0.0064 -0.0120 108 ILE 13 CG2 0.0035 0.0065 -0.0102 109 ILE 13 CD1 0.0032 0.0067 -0.0101 110 LYS 14 N 0.0117 0.0017 -0.0117 111 LYS 14 CA 0.0140 0.0001 -0.0120 112 LYS 14 C 0.0129 -0.0013 -0.0093 113 LYS 14 O 0.0121 -0.0026 -0.0069 114 LYS 14 CB 0.0167 -0.0019 -0.0123 115 LYS 14 CG 0.0195 -0.0032 -0.0136 116 LYS 14 CD 0.0221 -0.0044 -0.0148 117 LYS 14 CE 0.0247 -0.0051 -0.0166 118 LYS 14 NZ 0.0274 -0.0067 -0.0174 119 ILE 15 N 0.0126 -0.0009 -0.0096 120 ILE 15 CA 0.0116 -0.0019 -0.0074 121 ILE 15 C 0.0127 -0.0021 -0.0083 122 ILE 15 O 0.0129 -0.0005 -0.0103 123 ILE 15 CB 0.0086 -0.0004 -0.0062 124 ILE 15 CG1 0.0075 -0.0017 -0.0037 125 ILE 15 CG2 0.0076 0.0021 -0.0081 126 ILE 15 CD1 0.0046 -0.0004 -0.0022 127 GLY 16 N 0.0131 -0.0034 -0.0066 128 GLY 16 CA 0.0140 -0.0040 -0.0070 129 GLY 16 C 0.0170 -0.0040 -0.0099 130 GLY 16 O 0.0175 -0.0029 -0.0113 131 GLY 17 N 0.0191 -0.0061 -0.0105 132 GLY 17 CA 0.0218 -0.0059 -0.0129 133 GLY 17 C 0.0212 -0.0033 -0.0155 134 GLY 17 O 0.0232 -0.0028 -0.0177 135 GLN 18 N 0.0183 -0.0017 -0.0149 136 GLN 18 CA 0.0177 0.0012 -0.0171 137 GLN 18 C 0.0169 0.0025 -0.0175 138 GLN 18 O 0.0155 0.0018 -0.0154 139 GLN 18 CB 0.0153 0.0029 -0.0163 140 GLN 18 CG 0.0159 0.0024 -0.0165 141 GLN 18 CD 0.0133 0.0035 -0.0149 142 GLN 18 OE1 0.0125 0.0018 -0.0126 143 GLN 18 NE2 0.0120 0.0062 -0.0162 144 LEU 19 N 0.0176 0.0036 -0.0199 145 LEU 19 CA 0.0164 0.0050 -0.0203 146 LEU 19 C 0.0139 0.0075 -0.0207 147 LEU 19 O 0.0140 0.0088 -0.0223 148 LEU 19 CB 0.0184 0.0054 -0.0227 149 LEU 19 CG 0.0206 0.0031 -0.0222 150 LEU 19 CD1 0.0225 0.0037 -0.0247 151 LEU 19 CD2 0.0193 0.0021 -0.0198 152 LYS 20 N 0.0112 0.0070 -0.0191 153 LYS 20 CA 0.0089 0.0095 -0.0192 154 LYS 20 C 0.0077 0.0110 -0.0194 155 LYS 20 O 0.0084 0.0099 -0.0191 156 LYS 20 CB 0.0070 0.0092 -0.0168 157 LYS 20 CG 0.0079 0.0080 -0.0165 158 LYS 20 CD 0.0057 0.0087 -0.0148 159 LYS 20 CE 0.0066 0.0075 -0.0145 160 LYS 20 NZ 0.0070 0.0049 -0.0121 161 GLU 21 N 0.0056 0.0127 -0.0203 162 GLU 21 CA 0.0038 0.0141 -0.0202 163 GLU 21 C 0.0011 0.0145 -0.0179 164 GLU 21 O 0.0001 0.0150 -0.0175 165 GLU 21 CB 0.0035 0.0165 -0.0230 166 GLU 21 CG 0.0062 0.0162 -0.0254 167 GLU 21 CD 0.0073 0.0155 -0.0255 168 GLU 21 OE1 0.0060 0.0171 -0.0262 169 GLU 21 OE2 0.0093 0.0134 -0.0249 170 ALA 22 N -0.0004 0.0142 -0.0169 171 ALA 22 CA -0.0029 0.0147 -0.0148 172 ALA 22 C -0.0046 0.0158 -0.0145 173 ALA 22 O -0.0036 0.0155 -0.0150 174 ALA 22 CB -0.0027 0.0126 -0.0122 175 LEU 23 N -0.0064 0.0167 -0.0147 176 LEU 23 CA -0.0086 0.0176 -0.0141 177 LEU 23 C -0.0095 0.0164 -0.0110 178 LEU 23 O -0.0100 0.0158 -0.0092 179 LEU 23 CB -0.0111 0.0194 -0.0151 180 LEU 23 CG -0.0138 0.0205 -0.0146 181 LEU 23 CD1 -0.0136 0.0214 -0.0166 182 LEU 23 CD2 -0.0163 0.0220 -0.0149 183 LEU 24 N -0.0087 0.0157 -0.0117 184 LEU 24 CA -0.0096 0.0146 -0.0097 185 LEU 24 C -0.0121 0.0153 -0.0093 186 LEU 24 O -0.0130 0.0160 -0.0099 187 LEU 24 CB -0.0086 0.0138 -0.0091 188 LEU 24 CG -0.0061 0.0128 -0.0091 189 LEU 24 CD1 -0.0054 0.0121 -0.0085 190 LEU 24 CD2 -0.0056 0.0116 -0.0077 191 ASN 25 N -0.0124 0.0166 -0.0061 192 ASN 25 CA -0.0148 0.0188 -0.0050 193 ASN 25 C -0.0162 0.0180 -0.0022 194 ASN 25 O -0.0166 0.0166 -0.0002 195 ASN 25 CB -0.0154 0.0194 -0.0047 196 ASN 25 CG -0.0178 0.0219 -0.0040 197 ASN 25 OD1 -0.0192 0.0228 -0.0030 198 ASN 25 ND2 -0.0183 0.0230 -0.0046 199 THR 26 N -0.0135 0.0212 -0.0000 200 THR 26 CA -0.0156 0.0179 0.0007 201 THR 26 C -0.0199 0.0196 0.0025 202 THR 26 O -0.0224 0.0170 0.0034 203 THR 26 CB -0.0126 0.0167 -0.0006 204 THR 26 OG1 -0.0116 0.0208 -0.0008 205 THR 26 CG2 -0.0085 0.0145 -0.0024 206 GLY 27 N -0.0204 0.0222 0.0014 207 GLY 27 CA -0.0237 0.0237 0.0025 208 GLY 27 C -0.0240 0.0225 0.0038 209 GLY 27 O -0.0268 0.0234 0.0050 210 ALA 28 N -0.0222 0.0194 0.0027 211 ALA 28 CA -0.0221 0.0179 0.0039 212 ALA 28 C -0.0217 0.0150 0.0060 213 ALA 28 O -0.0200 0.0135 0.0055 214 ALA 28 CB -0.0201 0.0177 0.0019 215 ASP 29 N -0.0240 0.0147 0.0077 216 ASP 29 CA -0.0236 0.0117 0.0101 217 ASP 29 C -0.0206 0.0098 0.0097 218 ASP 29 O -0.0189 0.0074 0.0106 219 ASP 29 CB -0.0263 0.0114 0.0125 220 ASP 29 CG -0.0295 0.0133 0.0130 221 ASP 29 OD1 -0.0318 0.0142 0.0139 222 ASP 29 OD2 -0.0297 0.0139 0.0127 223 ASP 30 N -0.0181 0.0089 0.0075 224 ASP 30 CA -0.0161 0.0077 0.0073 225 ASP 30 C -0.0147 0.0082 0.0050 226 ASP 30 O -0.0154 0.0096 0.0034 227 ASP 30 CB -0.0164 0.0075 0.0080 228 ASP 30 CG -0.0177 0.0070 0.0103 229 ASP 30 OD1 -0.0192 0.0078 0.0107 230 ASP 30 OD2 -0.0173 0.0059 0.0118 231 THR 31 N -0.0124 0.0070 0.0047 232 THR 31 CA -0.0107 0.0071 0.0023 233 THR 31 C -0.0104 0.0073 0.0017 234 THR 31 O -0.0100 0.0061 0.0030 235 THR 31 CB -0.0087 0.0053 0.0022 236 THR 31 OG1 -0.0090 0.0055 0.0025 237 THR 31 CG2 -0.0068 0.0052 -0.0001 238 VAL 32 N -0.0099 0.0079 0.0009 239 VAL 32 CA -0.0098 0.0083 0.0003 240 VAL 32 C -0.0084 0.0084 -0.0017 241 VAL 32 O -0.0083 0.0094 -0.0030 242 VAL 32 CB -0.0114 0.0100 0.0004 243 VAL 32 CG1 -0.0113 0.0102 -0.0001 244 VAL 32 CG2 -0.0129 0.0099 0.0024 245 LEU 33 N -0.0065 0.0091 -0.0026 246 LEU 33 CA -0.0050 0.0089 -0.0047 247 LEU 33 C -0.0050 0.0092 -0.0051 248 LEU 33 O -0.0056 0.0087 -0.0035 249 LEU 33 CB -0.0033 0.0067 -0.0047 250 LEU 33 CG -0.0029 0.0062 -0.0046 251 LEU 33 CD1 -0.0010 0.0041 -0.0049 252 LEU 33 CD2 -0.0032 0.0079 -0.0063 253 GLU 34 N -0.0044 0.0100 -0.0069 254 GLU 34 CA -0.0043 0.0103 -0.0075 255 GLU 34 C -0.0030 0.0078 -0.0065 256 GLU 34 O -0.0019 0.0060 -0.0060 257 GLU 34 CB -0.0033 0.0113 -0.0104 258 GLU 34 CG -0.0043 0.0137 -0.0116 259 GLU 34 CD -0.0032 0.0145 -0.0145 260 GLU 34 OE1 -0.0025 0.0142 -0.0153 261 GLU 34 OE2 -0.0031 0.0154 -0.0159 262 GLU 35 N -0.0034 0.0097 -0.0056 263 GLU 35 CA -0.0029 0.0084 -0.0050 264 GLU 35 C -0.0013 0.0072 -0.0057 265 GLU 35 O -0.0004 0.0077 -0.0071 266 GLU 35 CB -0.0033 0.0090 -0.0051 267 GLU 35 CG -0.0030 0.0076 -0.0044 268 GLU 35 CD -0.0037 0.0065 -0.0027 269 GLU 35 OE1 -0.0051 0.0071 -0.0019 270 GLU 35 OE2 -0.0030 0.0050 -0.0023 271 VAL 36 N -0.0004 0.0068 -0.0052 272 VAL 36 CA 0.0015 0.0054 -0.0056 273 VAL 36 C 0.0014 0.0037 -0.0043 274 VAL 36 O -0.0000 0.0032 -0.0029 275 VAL 36 CB 0.0024 0.0048 -0.0059 276 VAL 36 CG1 0.0011 0.0043 -0.0045 277 VAL 36 CG2 0.0042 0.0032 -0.0061 278 ASN 37 N 0.0028 0.0029 -0.0046 279 ASN 37 CA 0.0029 0.0019 -0.0037 280 ASN 37 C 0.0035 0.0003 -0.0025 281 ASN 37 O 0.0049 -0.0006 -0.0025 282 ASN 37 CB 0.0042 0.0021 -0.0046 283 ASN 37 CG 0.0040 0.0014 -0.0039 284 ASN 37 OD1 0.0028 0.0009 -0.0027 285 ASN 37 ND2 0.0052 0.0013 -0.0045 286 LEU 38 N 0.0029 0.0010 -0.0013 287 LEU 38 CA 0.0032 -0.0006 -0.0003 288 LEU 38 C 0.0030 -0.0014 0.0004 289 LEU 38 O 0.0019 -0.0009 0.0005 290 LEU 38 CB 0.0020 -0.0010 0.0005 291 LEU 38 CG 0.0022 -0.0004 -0.0001 292 LEU 38 CD1 0.0010 -0.0009 0.0008 293 LEU 38 CD2 0.0040 -0.0008 -0.0004 294 PRO 39 N 0.0047 -0.0023 0.0011 295 PRO 39 CA 0.0049 -0.0033 0.0019 296 PRO 39 C 0.0038 -0.0039 0.0033 297 PRO 39 O 0.0031 -0.0040 0.0039 298 PRO 39 CB 0.0065 -0.0043 0.0018 299 PRO 39 CG 0.0067 -0.0043 0.0017 300 PRO 39 CD 0.0059 -0.0029 0.0009 301 GLY 40 N 0.0040 -0.0034 0.0037 302 GLY 40 CA 0.0029 -0.0046 0.0053 303 GLY 40 C 0.0005 -0.0040 0.0055 304 GLY 40 O -0.0004 -0.0025 0.0044 305 ARG 41 N 0.0002 -0.0044 0.0069 306 ARG 41 CA -0.0029 -0.0043 0.0071 307 ARG 41 C -0.0039 -0.0036 0.0068 308 ARG 41 O -0.0023 -0.0042 0.0070 309 ARG 41 CB -0.0041 -0.0067 0.0087 310 ARG 41 CG -0.0074 -0.0067 0.0090 311 ARG 41 CD -0.0084 -0.0090 0.0104 312 ARG 41 NE -0.0069 -0.0113 0.0116 313 ARG 41 CZ -0.0053 -0.0128 0.0123 314 ARG 41 NH1 -0.0052 -0.0122 0.0119 315 ARG 41 NH2 -0.0040 -0.0148 0.0133 316 TRP 42 N -0.0067 -0.0019 0.0060 317 TRP 42 CA -0.0078 -0.0013 0.0058 318 TRP 42 C -0.0100 -0.0012 0.0061 319 TRP 42 O -0.0105 -0.0012 0.0063 320 TRP 42 CB -0.0072 0.0004 0.0045 321 TRP 42 CG -0.0074 0.0016 0.0036 322 TRP 42 CD1 -0.0060 0.0020 0.0031 323 TRP 42 CD2 -0.0092 0.0026 0.0032 324 TRP 42 NE1 -0.0068 0.0032 0.0023 325 TRP 42 CE2 -0.0088 0.0036 0.0024 326 TRP 42 CE3 -0.0112 0.0028 0.0034 327 TRP 42 CZ2 -0.0102 0.0048 0.0018 328 TRP 42 CZ3 -0.0126 0.0040 0.0028 329 TRP 42 CH2 -0.0121 0.0049 0.0021 330 LYS 43 N -0.0103 -0.0006 0.0055 331 LYS 43 CA -0.0124 -0.0004 0.0056 332 LYS 43 C -0.0133 0.0010 0.0048 333 LYS 43 O -0.0124 0.0013 0.0045 334 LYS 43 CB -0.0134 -0.0021 0.0068 335 LYS 43 CG -0.0134 -0.0027 0.0073 336 LYS 43 CD -0.0136 -0.0046 0.0086 337 LYS 43 CE -0.0151 -0.0052 0.0091 338 LYS 43 NZ -0.0151 -0.0070 0.0103 339 PRO 44 N -0.0153 0.0016 0.0011 340 PRO 44 CA -0.0155 0.0032 0.0009 341 PRO 44 C -0.0154 0.0025 0.0010 342 PRO 44 O -0.0161 0.0008 0.0013 343 PRO 44 CB -0.0175 0.0041 0.0010 344 PRO 44 CG -0.0185 0.0024 0.0014 345 PRO 44 CD -0.0171 0.0013 0.0014 346 LYS 45 N -0.0123 0.0061 0.0008 347 LYS 45 CA -0.0131 0.0053 0.0012 348 LYS 45 C -0.0138 0.0058 0.0005 349 LYS 45 O -0.0132 0.0066 -0.0001 350 LYS 45 CB -0.0124 0.0049 0.0021 351 LYS 45 CG -0.0131 0.0040 0.0026 352 LYS 45 CD -0.0124 0.0035 0.0036 353 LYS 45 CE -0.0132 0.0027 0.0040 354 LYS 45 NZ -0.0142 0.0020 0.0043 355 LEU 46 N -0.0120 0.0045 -0.0106 356 LEU 46 CA -0.0092 0.0001 -0.0080 357 LEU 46 C -0.0063 -0.0043 -0.0043 358 LEU 46 O -0.0052 -0.0063 -0.0070 359 LEU 46 CB -0.0076 -0.0028 -0.0137 360 LEU 46 CG -0.0101 0.0010 -0.0176 361 LEU 46 CD1 -0.0084 -0.0020 -0.0239 362 LEU 46 CD2 -0.0110 0.0027 -0.0132 363 ILE 47 N -0.0067 0.0000 0.0019 364 ILE 47 CA -0.0054 -0.0024 0.0040 365 ILE 47 C -0.0030 -0.0059 0.0056 366 ILE 47 O -0.0027 -0.0062 0.0056 367 ILE 47 CB -0.0075 -0.0011 0.0079 368 ILE 47 CG1 -0.0089 -0.0003 0.0110 369 ILE 47 CG2 -0.0097 0.0021 0.0065 370 ILE 47 CD1 -0.0105 0.0001 0.0155 371 GLY 48 N 0.0031 -0.0234 0.0162 372 GLY 48 CA 0.0155 -0.0377 0.0243 373 GLY 48 C 0.0271 -0.0447 0.0078 374 GLY 48 O 0.0321 -0.0459 -0.0062 375 GLY 49 N 0.0281 -0.0491 0.0097 376 GLY 49 CA 0.0408 -0.0583 -0.0125 377 GLY 49 C 0.0548 -0.0812 -0.0066 378 GLY 49 O 0.0636 -0.0878 -0.0210 379 ILE 50 N 0.0793 -0.1067 0.0237 380 ILE 50 CA 0.0966 -0.1343 0.0306 381 ILE 50 C 0.0876 -0.1106 0.0446 382 ILE 50 O 0.0867 -0.0897 0.0805 383 ILE 50 CB 0.1222 -0.1631 0.0631 384 ILE 50 CG1 0.1311 -0.1883 0.0461 385 ILE 50 CG2 0.1392 -0.1904 0.0695 386 ILE 50 CD1 0.1559 -0.2169 0.0765 387 GLY 51 N 0.0830 -0.1168 0.0276 388 GLY 51 CA 0.0771 -0.1081 0.0369 389 GLY 51 C 0.0562 -0.0767 0.0237 390 GLY 51 O 0.0485 -0.0652 0.0284 391 GLY 52 N 0.0399 -0.0578 0.0042 392 GLY 52 CA 0.0247 -0.0378 -0.0043 393 GLY 52 C 0.0189 -0.0281 0.0030 394 GLY 52 O 0.0259 -0.0350 0.0187 395 PHE 53 N 0.0144 -0.0270 -0.0023 396 PHE 53 CA 0.0090 -0.0180 0.0025 397 PHE 53 C 0.0010 -0.0044 0.0151 398 PHE 53 O -0.0017 -0.0000 0.0172 399 PHE 53 CB 0.0045 -0.0123 -0.0149 400 PHE 53 CG 0.0120 -0.0251 -0.0265 401 PHE 53 CD1 0.0141 -0.0282 -0.0253 402 PHE 53 CD2 0.0173 -0.0343 -0.0381 403 PHE 53 CE1 0.0212 -0.0402 -0.0359 404 PHE 53 CE2 0.0244 -0.0463 -0.0487 405 PHE 53 CZ 0.0263 -0.0492 -0.0475 406 VAL 54 N -0.0023 0.0006 0.0104 407 VAL 54 CA -0.0058 0.0049 0.0143 408 VAL 54 C -0.0107 0.0053 0.0098 409 VAL 54 O -0.0092 0.0021 0.0056 410 VAL 54 CB -0.0014 0.0052 0.0193 411 VAL 54 CG1 -0.0051 0.0090 0.0222 412 VAL 54 CG2 0.0026 0.0057 0.0246 413 LYS 55 N -0.0129 0.0080 0.0063 414 LYS 55 CA -0.0145 0.0088 0.0049 415 LYS 55 C -0.0131 0.0105 0.0076 416 LYS 55 O -0.0124 0.0131 0.0101 417 LYS 55 CB -0.0176 0.0115 0.0029 418 LYS 55 CG -0.0195 0.0123 0.0012 419 LYS 55 CD -0.0226 0.0149 -0.0008 420 LYS 55 CE -0.0235 0.0138 -0.0027 421 LYS 55 NZ -0.0267 0.0158 -0.0052 422 VAL 56 N -0.0130 0.0076 0.0043 423 VAL 56 CA -0.0124 0.0080 0.0049 424 VAL 56 C -0.0131 0.0078 0.0042 425 VAL 56 O -0.0140 0.0074 0.0034 426 VAL 56 CB -0.0111 0.0071 0.0053 427 VAL 56 CG1 -0.0103 0.0074 0.0061 428 VAL 56 CG2 -0.0110 0.0057 0.0045 429 ARG 57 N -0.0106 0.0059 0.0028 430 ARG 57 CA -0.0100 0.0044 0.0036 431 ARG 57 C -0.0095 0.0035 0.0039 432 ARG 57 O -0.0085 0.0038 0.0031 433 ARG 57 CB -0.0086 0.0042 0.0029 434 ARG 57 CG -0.0091 0.0050 0.0026 435 ARG 57 CD -0.0080 0.0044 0.0023 436 ARG 57 NE -0.0064 0.0041 0.0015 437 ARG 57 CZ -0.0058 0.0052 0.0003 438 ARG 57 NH1 -0.0043 0.0049 -0.0003 439 ARG 57 NH2 -0.0067 0.0066 -0.0001 440 GLN 58 N -0.0101 0.0022 0.0043 441 GLN 58 CA -0.0096 0.0010 0.0051 442 GLN 58 C -0.0081 0.0001 0.0055 443 GLN 58 O -0.0082 -0.0004 0.0060 444 GLN 58 CB -0.0111 0.0002 0.0062 445 GLN 58 CG -0.0106 -0.0012 0.0072 446 GLN 58 CD -0.0122 -0.0019 0.0082 447 GLN 58 OE1 -0.0137 -0.0013 0.0080 448 GLN 58 NE2 -0.0118 -0.0033 0.0092 449 TYR 59 N -0.0068 -0.0009 0.0064 450 TYR 59 CA -0.0050 -0.0021 0.0068 451 TYR 59 C -0.0049 -0.0033 0.0079 452 TYR 59 O -0.0052 -0.0029 0.0076 453 TYR 59 CB -0.0032 -0.0015 0.0055 454 TYR 59 CG -0.0030 -0.0005 0.0046 455 TYR 59 CD1 -0.0038 0.0010 0.0034 456 TYR 59 CD2 -0.0020 -0.0012 0.0048 457 TYR 59 CE1 -0.0036 0.0019 0.0025 458 TYR 59 CE2 -0.0018 -0.0003 0.0039 459 TYR 59 CZ -0.0026 0.0012 0.0027 460 TYR 59 OH -0.0024 0.0021 0.0018 461 ASP 60 N -0.0040 -0.0055 0.0097 462 ASP 60 CA -0.0039 -0.0069 0.0110 463 ASP 60 C -0.0014 -0.0081 0.0110 464 ASP 60 O 0.0003 -0.0081 0.0103 465 ASP 60 CB -0.0053 -0.0083 0.0129 466 ASP 60 CG -0.0080 -0.0073 0.0131 467 ASP 60 OD1 -0.0089 -0.0061 0.0124 468 ASP 60 OD2 -0.0090 -0.0077 0.0140 469 GLN 61 N -0.0008 -0.0097 0.0133 470 GLN 61 CA 0.0019 -0.0112 0.0135 471 GLN 61 C 0.0043 -0.0106 0.0107 472 GLN 61 O 0.0070 -0.0119 0.0106 473 GLN 61 CB 0.0031 -0.0134 0.0159 474 GLN 61 CG 0.0009 -0.0142 0.0188 475 GLN 61 CD 0.0013 -0.0159 0.0212 476 GLN 61 OE1 0.0032 -0.0166 0.0207 477 GLN 61 NE2 -0.0005 -0.0166 0.0237 478 VAL 62 N 0.0027 -0.0088 0.0088 479 VAL 62 CA 0.0045 -0.0078 0.0066 480 VAL 62 C 0.0060 -0.0081 0.0059 481 VAL 62 O 0.0050 -0.0077 0.0061 482 VAL 62 CB 0.0031 -0.0055 0.0050 483 VAL 62 CG1 0.0050 -0.0045 0.0026 484 VAL 62 CG2 0.0014 -0.0052 0.0057 485 PRO 63 N 0.0088 -0.0095 0.0049 486 PRO 63 CA 0.0102 -0.0096 0.0037 487 PRO 63 C 0.0100 -0.0074 0.0014 488 PRO 63 O 0.0104 -0.0064 0.0000 489 PRO 63 CB 0.0129 -0.0112 0.0033 490 PRO 63 CG 0.0129 -0.0114 0.0035 491 PRO 63 CD 0.0103 -0.0109 0.0051 492 ILE 64 N 0.0093 -0.0065 0.0012 493 ILE 64 CA 0.0089 -0.0044 -0.0010 494 ILE 64 C 0.0096 -0.0045 -0.0016 495 ILE 64 O 0.0093 -0.0055 0.0000 496 ILE 64 CB 0.0061 -0.0026 -0.0008 497 ILE 64 CG1 0.0057 -0.0005 -0.0031 498 ILE 64 CG2 0.0042 -0.0031 0.0014 499 ILE 64 CD1 0.0035 0.0014 -0.0035 500 GLU 65 N 0.0110 -0.0034 -0.0040 501 GLU 65 CA 0.0117 -0.0033 -0.0049 502 GLU 65 C 0.0099 -0.0009 -0.0064 503 GLU 65 O 0.0096 0.0007 -0.0082 504 GLU 65 CB 0.0147 -0.0041 -0.0067 505 GLU 65 CG 0.0160 -0.0047 -0.0070 506 GLU 65 CD 0.0190 -0.0057 -0.0086 507 GLU 65 OE1 0.0199 -0.0051 -0.0102 508 GLU 65 OE2 0.0206 -0.0070 -0.0083 509 ILE 66 N 0.0085 -0.0005 -0.0058 510 ILE 66 CA 0.0066 0.0016 -0.0071 511 ILE 66 C 0.0073 0.0017 -0.0079 512 ILE 66 O 0.0074 0.0005 -0.0063 513 ILE 66 CB 0.0038 0.0022 -0.0051 514 ILE 66 CG1 0.0030 0.0021 -0.0042 515 ILE 66 CG2 0.0018 0.0044 -0.0064 516 ILE 66 CD1 0.0005 0.0024 -0.0020 517 CYS 67 N 0.0078 0.0031 -0.0099 518 CYS 67 CA 0.0087 0.0032 -0.0107 519 CYS 67 C 0.0109 0.0012 -0.0096 520 CYS 67 O 0.0110 0.0007 -0.0088 521 CYS 67 CB 0.0064 0.0039 -0.0100 522 CYS 67 SG 0.0048 0.0063 -0.0125 523 GLY 68 N 0.0130 -0.0002 -0.0103 524 GLY 68 CA 0.0153 -0.0026 -0.0095 525 GLY 68 C 0.0145 -0.0040 -0.0064 526 GLY 68 O 0.0162 -0.0058 -0.0056 527 HIS 69 N 0.0113 -0.0031 -0.0046 528 HIS 69 CA 0.0110 -0.0037 -0.0014 529 HIS 69 C 0.0122 -0.0043 -0.0008 530 HIS 69 O 0.0109 -0.0036 -0.0016 531 HIS 69 CB 0.0077 -0.0029 -0.0002 532 HIS 69 CG 0.0066 -0.0026 0.0004 533 HIS 69 ND1 0.0066 -0.0020 -0.0018 534 HIS 69 CD2 0.0053 -0.0027 0.0030 535 HIS 69 CE1 0.0054 -0.0019 -0.0007 536 HIS 69 NE2 0.0046 -0.0023 0.0022 537 LYS 70 N 0.0135 -0.0077 0.0000 538 LYS 70 CA 0.0134 -0.0086 0.0013 539 LYS 70 C 0.0111 -0.0093 0.0042 540 LYS 70 O 0.0111 -0.0108 0.0060 541 LYS 70 CB 0.0164 -0.0109 0.0015 542 LYS 70 CG 0.0187 -0.0103 -0.0012 543 LYS 70 CD 0.0215 -0.0125 -0.0009 544 LYS 70 CE 0.0234 -0.0140 -0.0008 545 LYS 70 NZ 0.0261 -0.0163 -0.0003 546 VAL 71 N 0.0091 -0.0085 0.0031 547 VAL 71 CA 0.0071 -0.0090 0.0056 548 VAL 71 C 0.0067 -0.0093 0.0063 549 VAL 71 O 0.0080 -0.0091 0.0049 550 VAL 71 CB 0.0046 -0.0072 0.0057 551 VAL 71 CG1 0.0047 -0.0072 0.0055 552 VAL 71 CG2 0.0038 -0.0050 0.0036 553 ILE 72 N 0.0049 -0.0100 0.0088 554 ILE 72 CA 0.0044 -0.0104 0.0097 555 ILE 72 C 0.0014 -0.0091 0.0105 556 ILE 72 O -0.0001 -0.0091 0.0118 557 ILE 72 CB 0.0052 -0.0128 0.0120 558 ILE 72 CG1 0.0082 -0.0142 0.0113 559 ILE 72 CG2 0.0043 -0.0130 0.0132 560 ILE 72 CD1 0.0098 -0.0137 0.0095 561 GLY 73 N 0.0005 -0.0079 0.0099 562 GLY 73 CA -0.0022 -0.0067 0.0105 563 GLY 73 C -0.0031 -0.0055 0.0098 564 GLY 73 O -0.0015 -0.0055 0.0087 565 THR 74 N -0.0052 -0.0042 0.0103 566 THR 74 CA -0.0063 -0.0031 0.0097 567 THR 74 C -0.0063 -0.0012 0.0076 568 THR 74 O -0.0070 -0.0004 0.0070 569 THR 74 CB -0.0088 -0.0031 0.0112 570 THR 74 OG1 -0.0085 -0.0048 0.0131 571 THR 74 CG2 -0.0101 -0.0017 0.0104 572 VAL 75 N -0.0055 -0.0008 0.0063 573 VAL 75 CA -0.0055 0.0010 0.0044 574 VAL 75 C -0.0067 0.0019 0.0043 575 VAL 75 O -0.0063 0.0010 0.0050 576 VAL 75 CB -0.0033 0.0008 0.0030 577 VAL 75 CG1 -0.0033 0.0026 0.0010 578 VAL 75 CG2 -0.0020 -0.0002 0.0031 579 LEU 76 N -0.0080 0.0033 0.0041 580 LEU 76 CA -0.0088 0.0040 0.0040 581 LEU 76 C -0.0081 0.0048 0.0024 582 LEU 76 O -0.0077 0.0054 0.0015 583 LEU 76 CB -0.0106 0.0049 0.0043 584 LEU 76 CG -0.0114 0.0042 0.0057 585 LEU 76 CD1 -0.0131 0.0051 0.0059 586 LEU 76 CD2 -0.0113 0.0031 0.0069 587 VAL 77 N -0.0074 0.0051 0.0021 588 VAL 77 CA -0.0065 0.0058 0.0007 589 VAL 77 C -0.0075 0.0070 0.0006 590 VAL 77 O -0.0082 0.0066 0.0017 591 VAL 77 CB -0.0050 0.0044 0.0005 592 VAL 77 CG1 -0.0042 0.0051 -0.0011 593 VAL 77 CG2 -0.0039 0.0031 0.0004 594 GLY 78 N -0.0077 0.0074 0.0001 595 GLY 78 CA -0.0080 0.0082 0.0007 596 GLY 78 C -0.0081 0.0099 -0.0003 597 GLY 78 O -0.0079 0.0103 -0.0017 598 PRO 79 N -0.0066 0.0098 0.0017 599 PRO 79 CA -0.0068 0.0108 0.0010 600 PRO 79 C -0.0071 0.0121 0.0006 601 PRO 79 O -0.0071 0.0127 0.0014 602 PRO 79 CB -0.0068 0.0112 0.0021 603 PRO 79 CG -0.0065 0.0100 0.0028 604 PRO 79 CD -0.0064 0.0092 0.0028 605 THR 80 N -0.0094 0.0146 -0.0047 606 THR 80 CA -0.0107 0.0168 -0.0052 607 THR 80 C -0.0108 0.0181 -0.0087 608 THR 80 O -0.0094 0.0165 -0.0108 609 THR 80 CB -0.0103 0.0160 -0.0045 610 THR 80 OG1 -0.0116 0.0183 -0.0053 611 THR 80 CG2 -0.0085 0.0137 -0.0064 612 PRO 81 N -0.0136 0.0229 -0.0100 613 PRO 81 CA -0.0137 0.0245 -0.0135 614 PRO 81 C -0.0121 0.0235 -0.0157 615 PRO 81 O -0.0115 0.0241 -0.0189 616 PRO 81 CB -0.0165 0.0274 -0.0131 617 PRO 81 CG -0.0177 0.0275 -0.0096 618 PRO 81 CD -0.0160 0.0246 -0.0074 619 ALA 82 N -0.0113 0.0216 -0.0140 620 ALA 82 CA -0.0094 0.0200 -0.0156 621 ALA 82 C -0.0089 0.0180 -0.0132 622 ALA 82 O -0.0104 0.0185 -0.0107 623 ALA 82 CB -0.0097 0.0218 -0.0180 624 ASN 83 N -0.0068 0.0168 -0.0134 625 ASN 83 CA -0.0062 0.0147 -0.0115 626 ASN 83 C -0.0074 0.0151 -0.0104 627 ASN 83 O -0.0074 0.0162 -0.0118 628 ASN 83 CB -0.0036 0.0132 -0.0126 629 ASN 83 CG -0.0022 0.0123 -0.0132 630 ASN 83 OD1 -0.0027 0.0117 -0.0119 631 ASN 83 ND2 -0.0003 0.0120 -0.0153 632 VAL 84 N -0.0085 0.0141 -0.0083 633 VAL 84 CA -0.0098 0.0147 -0.0072 634 VAL 84 C -0.0093 0.0126 -0.0053 635 VAL 84 O -0.0094 0.0112 -0.0034 636 VAL 84 CB -0.0123 0.0164 -0.0058 637 VAL 84 CG1 -0.0136 0.0170 -0.0048 638 VAL 84 CG2 -0.0130 0.0186 -0.0076 639 ILE 85 N -0.0089 0.0123 -0.0055 640 ILE 85 CA -0.0085 0.0104 -0.0036 641 ILE 85 C -0.0107 0.0112 -0.0018 642 ILE 85 O -0.0116 0.0126 -0.0026 643 ILE 85 CB -0.0067 0.0096 -0.0046 644 ILE 85 CG1 -0.0044 0.0090 -0.0066 645 ILE 85 CG2 -0.0062 0.0075 -0.0025 646 ILE 85 CD1 -0.0035 0.0077 -0.0059 647 GLY 86 N -0.0118 0.0099 0.0005 648 GLY 86 CA -0.0140 0.0105 0.0023 649 GLY 86 C -0.0137 0.0089 0.0038 650 GLY 86 O -0.0117 0.0074 0.0033 651 ARG 87 N -0.0157 0.0092 0.0055 652 ARG 87 CA -0.0156 0.0076 0.0070 653 ARG 87 C -0.0142 0.0050 0.0085 654 ARG 87 O -0.0130 0.0034 0.0090 655 ARG 87 CB -0.0183 0.0081 0.0087 656 ARG 87 CG -0.0196 0.0105 0.0075 657 ARG 87 CD -0.0222 0.0109 0.0093 658 ARG 87 NE -0.0241 0.0111 0.0106 659 ARG 87 CZ -0.0246 0.0093 0.0128 660 ARG 87 NH1 -0.0264 0.0097 0.0139 661 ARG 87 NH2 -0.0234 0.0071 0.0139 662 ASN 88 N -0.0145 0.0046 0.0092 663 ASN 88 CA -0.0131 0.0023 0.0107 664 ASN 88 C -0.0104 0.0010 0.0095 665 ASN 88 O -0.0093 -0.0009 0.0108 666 ASN 88 CB -0.0133 0.0019 0.0113 667 ASN 88 CG -0.0116 0.0023 0.0091 668 ASN 88 OD1 -0.0120 0.0042 0.0071 669 ASN 88 ND2 -0.0098 0.0005 0.0094 670 LEU 89 N -0.0093 0.0020 0.0071 671 LEU 89 CA -0.0067 0.0009 0.0058 672 LEU 89 C -0.0065 0.0012 0.0050 673 LEU 89 O -0.0046 -0.0002 0.0049 674 LEU 89 CB -0.0054 0.0016 0.0035 675 LEU 89 CG -0.0050 0.0009 0.0040 676 LEU 89 CD1 -0.0030 0.0011 0.0018 677 LEU 89 CD2 -0.0043 -0.0015 0.0062 678 MET 90 N -0.0083 0.0034 0.0047 679 MET 90 CA -0.0079 0.0038 0.0038 680 MET 90 C -0.0079 0.0019 0.0055 681 MET 90 O -0.0066 0.0012 0.0047 682 MET 90 CB -0.0094 0.0066 0.0031 683 MET 90 CG -0.0086 0.0083 0.0007 684 MET 90 SD -0.0101 0.0115 -0.0004 685 MET 90 CE -0.0125 0.0126 0.0012 686 THR 91 N -0.0094 0.0014 0.0084 687 THR 91 CA -0.0093 -0.0006 0.0104 688 THR 91 C -0.0068 -0.0034 0.0102 689 THR 91 O -0.0059 -0.0049 0.0105 690 THR 91 CB -0.0114 -0.0010 0.0136 691 THR 91 OG1 -0.0110 -0.0023 0.0145 692 THR 91 CG2 -0.0140 0.0019 0.0140 693 GLN 92 N -0.0056 -0.0038 0.0098 694 GLN 92 CA -0.0031 -0.0061 0.0096 695 GLN 92 C -0.0010 -0.0061 0.0075 696 GLN 92 O 0.0007 -0.0081 0.0079 697 GLN 92 CB -0.0022 -0.0064 0.0092 698 GLN 92 CG -0.0040 -0.0067 0.0114 699 GLN 92 CD -0.0045 -0.0086 0.0140 700 GLN 92 OE1 -0.0066 -0.0081 0.0157 701 GLN 92 NE2 -0.0024 -0.0109 0.0144 702 ILE 93 N -0.0019 -0.0037 0.0051 703 ILE 93 CA -0.0001 -0.0037 0.0029 704 ILE 93 C -0.0005 -0.0031 0.0029 705 ILE 93 O 0.0008 -0.0031 0.0012 706 ILE 93 CB 0.0004 -0.0019 0.0006 707 ILE 93 CG1 -0.0014 0.0008 0.0004 708 ILE 93 CG2 0.0009 -0.0025 0.0006 709 ILE 93 CD1 -0.0008 0.0027 -0.0019 710 GLY 94 N -0.0015 -0.0040 0.0026 711 GLY 94 CA -0.0022 -0.0023 0.0023 712 GLY 94 C -0.0028 0.0014 -0.0001 713 GLY 94 O -0.0025 0.0025 -0.0020 714 CYS 95 N -0.0070 0.0035 -0.0007 715 CYS 95 CA -0.0068 0.0056 -0.0015 716 CYS 95 C -0.0075 0.0073 -0.0005 717 CYS 95 O -0.0084 0.0074 0.0013 718 CYS 95 CB -0.0070 0.0061 -0.0013 719 CYS 95 SG -0.0069 0.0087 -0.0023 720 THR 96 N -0.0062 0.0094 -0.0045 721 THR 96 CA -0.0038 0.0143 -0.0032 722 THR 96 C -0.0042 0.0152 -0.0040 723 THR 96 O -0.0068 0.0127 -0.0064 724 THR 96 CB -0.0046 0.0189 -0.0057 725 THR 96 OG1 -0.0081 0.0189 -0.0102 726 THR 96 CG2 -0.0038 0.0184 -0.0047 727 LEU 97 N -0.0015 0.0210 -0.0064 728 LEU 97 CA 0.0017 0.0168 -0.0026 729 LEU 97 C 0.0016 0.0221 -0.0077 730 LEU 97 O 0.0055 0.0280 -0.0137 731 LEU 97 CB 0.0122 0.0133 0.0000 732 LEU 97 CG 0.0132 0.0068 0.0062 733 LEU 97 CD1 0.0241 0.0053 0.0068 734 LEU 97 CD2 0.0093 0.0001 0.0130 735 ASN 98 N 0.0006 0.0238 -0.0108 736 ASN 98 CA -0.0015 0.0324 -0.0179 737 ASN 98 C 0.0005 0.0311 -0.0162 738 ASN 98 O -0.0034 0.0229 -0.0115 739 ASN 98 CB -0.0143 0.0340 -0.0235 740 ASN 98 CG -0.0167 0.0364 -0.0262 741 ASN 98 OD1 -0.0155 0.0453 -0.0323 742 ASN 98 ND2 -0.0200 0.0286 -0.0215 743 PHE 99 N 0.0059 0.0453 -0.0242 744 PHE 99 CA 0.0109 0.0397 -0.0193 745 PHE 99 C 0.0208 0.0567 -0.0341 746 PHE 99 O 0.0242 0.0549 -0.0326 747 PHE 99 CB 0.0293 0.0223 -0.0044 748 PHE 99 CG 0.0551 0.0257 -0.0075 749 PHE 99 CD1 0.0585 0.0242 -0.0063 750 PHE 99 CD2 0.0762 0.0297 -0.0110 751 PHE 99 CE1 0.0825 0.0273 -0.0090 752 PHE 99 CE2 0.1001 0.0326 -0.0137 753 PHE 99 CZ 0.1033 0.0314 -0.0127