1 GLY 1 N -0.0004 0.0048 -0.0088 2 GLY 1 CA 0.0068 0.0065 -0.0026 3 GLY 1 C 0.0071 0.0017 0.0051 4 GLY 1 O 0.0030 -0.0019 0.0053 5 ARG 2 N 0.0149 0.0276 0.0210 6 ARG 2 CA 0.0170 0.0222 0.0327 7 ARG 2 C 0.0265 0.0299 0.0380 8 ARG 2 O 0.0323 0.0372 0.0377 9 ARG 2 CB 0.0158 0.0161 0.0395 10 ARG 2 CG 0.0160 0.0083 0.0511 11 ARG 2 CD 0.0151 0.0024 0.0583 12 ARG 2 NE 0.0058 -0.0052 0.0529 13 ARG 2 CZ 0.0017 -0.0139 0.0584 14 ARG 2 NH1 0.0055 -0.0169 0.0695 15 ARG 2 NH2 -0.0067 -0.0198 0.0524 16 ILE 3 N -0.0183 -0.0134 -0.0100 17 ILE 3 CA -0.0330 -0.0235 -0.0213 18 ILE 3 C -0.0411 -0.0329 -0.0572 19 ILE 3 O -0.0240 -0.0253 -0.0769 20 ILE 3 CB -0.0143 -0.0120 -0.0179 21 ILE 3 CG1 -0.0118 -0.0057 0.0198 22 ILE 3 CG2 -0.0270 -0.0219 -0.0361 23 ILE 3 CD1 0.0100 0.0080 0.0265 24 ALA 4 N 0.0137 0.0370 0.0241 25 ALA 4 CA 0.0138 0.0407 0.0272 26 ALA 4 C 0.0182 0.0272 0.0353 27 ALA 4 O 0.0223 0.0220 0.0488 28 ALA 4 CB 0.0130 0.0572 0.0373 29 SER 5 N 0.0147 0.0117 0.0366 30 SER 5 CA 0.0213 0.0014 0.0346 31 SER 5 C 0.0254 -0.0084 0.0321 32 SER 5 O 0.0332 -0.0167 0.0312 33 SER 5 CB 0.0130 -0.0043 0.0303 34 SER 5 OG 0.0016 -0.0075 0.0260 35 ILE 6 N 0.0005 0.0137 0.0137 36 ILE 6 CA -0.0003 0.0135 0.0120 37 ILE 6 C -0.0015 0.0127 0.0112 38 ILE 6 O -0.0024 0.0118 0.0122 39 ILE 6 CB -0.0008 0.0131 0.0124 40 ILE 6 CG1 0.0006 0.0140 0.0130 41 ILE 6 CG2 -0.0017 0.0127 0.0106 42 ILE 6 CD1 0.0002 0.0135 0.0139 43 PRO 7 N -0.0062 0.0139 0.0086 44 PRO 7 CA -0.0092 0.0111 0.0055 45 PRO 7 C -0.0071 0.0072 0.0067 46 PRO 7 O -0.0049 0.0091 0.0089 47 PRO 7 CB -0.0121 0.0159 0.0037 48 PRO 7 CG -0.0122 0.0205 0.0044 49 PRO 7 CD -0.0077 0.0198 0.0082 50 GLY 8 N -0.0053 0.0030 -0.0009 51 GLY 8 CA -0.0030 0.0009 -0.0005 52 GLY 8 C -0.0051 0.0025 -0.0005 53 GLY 8 O -0.0031 0.0016 -0.0011 54 GLU 9 N -0.0121 0.0185 0.0030 55 GLU 9 CA -0.0091 0.0166 0.0025 56 GLU 9 C -0.0094 0.0131 0.0013 57 GLU 9 O -0.0073 0.0118 0.0010 58 GLU 9 CB -0.0085 0.0169 0.0026 59 GLU 9 CG -0.0053 0.0153 0.0023 60 GLU 9 CD -0.0049 0.0158 0.0025 61 GLU 9 OE1 -0.0072 0.0173 0.0028 62 GLU 9 OE2 -0.0024 0.0146 0.0022 63 ALA 10 N -0.0067 0.0191 -0.0054 64 ALA 10 CA -0.0027 0.0285 -0.0075 65 ALA 10 C 0.0033 0.0193 -0.0125 66 ALA 10 O 0.0008 0.0216 -0.0106 67 ALA 10 CB 0.0064 0.0416 -0.0129 68 GLU 11 N -0.0022 0.0127 -0.0224 69 GLU 11 CA 0.0030 0.0108 -0.0231 70 GLU 11 C 0.0042 0.0086 -0.0217 71 GLU 11 O 0.0078 0.0088 -0.0236 72 GLU 11 CB 0.0048 0.0077 -0.0211 73 GLU 11 CG 0.0104 0.0057 -0.0220 74 GLU 11 CD 0.0116 0.0022 -0.0193 75 GLU 11 OE1 0.0081 0.0015 -0.0171 76 GLU 11 OE2 0.0160 0.0000 -0.0194 77 TYR 12 N -0.0079 -0.0070 -0.0076 78 TYR 12 CA -0.0072 -0.0057 -0.0083 79 TYR 12 C -0.0115 -0.0027 -0.0131 80 TYR 12 O -0.0125 -0.0024 -0.0140 81 TYR 12 CB -0.0082 -0.0109 -0.0046 82 TYR 12 CG -0.0029 -0.0131 0.0002 83 TYR 12 CD1 0.0027 -0.0108 0.0013 84 TYR 12 CD2 -0.0034 -0.0175 0.0035 85 TYR 12 CE1 0.0078 -0.0126 0.0056 86 TYR 12 CE2 0.0017 -0.0192 0.0077 87 TYR 12 CZ 0.0073 -0.0167 0.0087 88 TYR 12 OH 0.0124 -0.0183 0.0128 89 LEU 13 N -0.0091 0.0142 -0.0281 90 LEU 13 CA -0.0145 0.0184 -0.0245 91 LEU 13 C -0.0174 0.0193 -0.0231 92 LEU 13 O -0.0139 0.0210 -0.0236 93 LEU 13 CB -0.0118 0.0251 -0.0226 94 LEU 13 CG -0.0173 0.0295 -0.0189 95 LEU 13 CD1 -0.0222 0.0263 -0.0186 96 LEU 13 CD2 -0.0141 0.0363 -0.0173 97 GLY 14 N -0.0249 0.0108 -0.0281 98 GLY 14 CA -0.0312 0.0180 -0.0268 99 GLY 14 C -0.0307 0.0128 -0.0290 100 GLY 14 O -0.0353 0.0181 -0.0279 101 ARG 15 N -0.0111 -0.0102 -0.0291 102 ARG 15 CA -0.0075 -0.0083 -0.0236 103 ARG 15 C -0.0091 -0.0090 -0.0191 104 ARG 15 O -0.0091 -0.0088 -0.0132 105 ARG 15 CB -0.0082 -0.0086 -0.0200 106 ARG 15 CG -0.0060 -0.0075 -0.0236 107 ARG 15 CD -0.0053 -0.0071 -0.0192 108 ARG 15 NE -0.0111 -0.0100 -0.0169 109 ARG 15 CZ -0.0121 -0.0104 -0.0114 110 ARG 15 NH1 -0.0081 -0.0082 -0.0072 111 ARG 15 NH2 -0.0175 -0.0130 -0.0099 112 GLY 16 N -0.0154 -0.0026 -0.0242 113 GLY 16 CA -0.0151 -0.0023 -0.0244 114 GLY 16 C -0.0141 -0.0006 -0.0235 115 GLY 16 O -0.0141 -0.0004 -0.0226 116 VAL 17 N -0.0109 0.0041 -0.0182 117 VAL 17 CA -0.0149 0.0054 -0.0184 118 VAL 17 C -0.0163 0.0074 -0.0207 119 VAL 17 O -0.0144 0.0088 -0.0234 120 VAL 17 CB -0.0157 0.0064 -0.0195 121 VAL 17 CG1 -0.0200 0.0078 -0.0199 122 VAL 17 CG2 -0.0146 0.0043 -0.0170 123 SER 18 N -0.0131 0.0059 -0.0246 124 SER 18 CA -0.0107 0.0034 -0.0214 125 SER 18 C -0.0062 0.0049 -0.0204 126 SER 18 O -0.0046 0.0083 -0.0222 127 SER 18 CB -0.0109 0.0024 -0.0208 128 SER 18 OG -0.0086 -0.0002 -0.0176 129 TYR 19 N 0.0038 0.0146 -0.0120 130 TYR 19 CA 0.0049 0.0164 -0.0103 131 TYR 19 C 0.0034 0.0158 -0.0075 132 TYR 19 O 0.0040 0.0173 -0.0054 133 TYR 19 CB 0.0065 0.0187 -0.0095 134 TYR 19 CG 0.0080 0.0194 -0.0122 135 TYR 19 CD1 0.0094 0.0204 -0.0140 136 TYR 19 CD2 0.0079 0.0191 -0.0127 137 TYR 19 CE1 0.0107 0.0210 -0.0165 138 TYR 19 CE2 0.0093 0.0198 -0.0151 139 TYR 19 CZ 0.0107 0.0207 -0.0170 140 TYR 19 OH 0.0120 0.0214 -0.0195 141 CYS 20 N 0.0021 -0.0061 -0.0070 142 CYS 20 CA 0.0000 -0.0073 -0.0029 143 CYS 20 C -0.0027 -0.0111 -0.0036 144 CYS 20 O -0.0046 -0.0139 -0.0044 145 CYS 20 CB -0.0008 -0.0073 -0.0001 146 CYS 20 SG -0.0029 -0.0079 0.0055 147 ALA 21 N -0.0086 -0.0143 -0.0000 148 ALA 21 CA -0.0088 -0.0152 0.0002 149 ALA 21 C -0.0097 -0.0128 -0.0012 150 ALA 21 O -0.0088 -0.0124 -0.0009 151 ALA 21 CB -0.0109 -0.0182 0.0003 152 THR 22 N -0.0120 -0.0129 -0.0052 153 THR 22 CA -0.0133 -0.0099 -0.0068 154 THR 22 C -0.0115 -0.0067 -0.0057 155 THR 22 O -0.0120 -0.0043 -0.0065 156 THR 22 CB -0.0156 -0.0093 -0.0088 157 THR 22 OG1 -0.0148 -0.0092 -0.0082 158 THR 22 CG2 -0.0177 -0.0122 -0.0103 159 CYS 23 N -0.0304 -0.0048 -0.0070 160 CYS 23 CA -0.0210 0.0044 -0.0055 161 CYS 23 C -0.0127 -0.0136 -0.0129 162 CYS 23 O -0.0193 -0.0153 -0.0124 163 CYS 23 CB -0.0014 0.0216 -0.0029 164 CYS 23 SG 0.0036 0.0416 0.0029 165 ASP 24 N -0.0108 -0.0089 -0.0090 166 ASP 24 CA -0.0112 -0.0092 -0.0097 167 ASP 24 C -0.0104 -0.0086 -0.0081 168 ASP 24 O -0.0105 -0.0089 -0.0085 169 ASP 24 CB -0.0129 -0.0078 -0.0110 170 ASP 24 CG -0.0138 -0.0083 -0.0128 171 ASP 24 OD1 -0.0132 -0.0098 -0.0131 172 ASP 24 OD2 -0.0152 -0.0072 -0.0139 173 GLY 25 N -0.0087 -0.0068 -0.0030 174 GLY 25 CA -0.0072 -0.0044 0.0007 175 GLY 25 C -0.0019 0.0001 0.0020 176 GLY 25 O -0.0011 0.0025 0.0070 177 ALA 26 N -0.0020 0.0036 0.0044 178 ALA 26 CA -0.0034 0.0072 0.0037 179 ALA 26 C -0.0007 0.0082 0.0072 180 ALA 26 O -0.0015 0.0092 0.0066 181 ALA 26 CB -0.0052 0.0126 0.0030 182 PHE 27 N -0.0103 0.0076 -0.0015 183 PHE 27 CA -0.0063 0.0062 -0.0023 184 PHE 27 C -0.0063 0.0037 0.0009 185 PHE 27 O -0.0029 0.0018 0.0013 186 PHE 27 CB -0.0054 0.0088 -0.0063 187 PHE 27 CG -0.0054 0.0112 -0.0095 188 PHE 27 CD1 -0.0093 0.0139 -0.0105 189 PHE 27 CD2 -0.0016 0.0110 -0.0116 190 PHE 27 CE1 -0.0094 0.0162 -0.0134 191 PHE 27 CE2 -0.0016 0.0133 -0.0146 192 PHE 27 CZ -0.0056 0.0159 -0.0155 193 TYR 28 N 0.0004 -0.0023 -0.0032 194 TYR 28 CA -0.0006 0.0018 -0.0026 195 TYR 28 C 0.0020 0.0011 0.0026 196 TYR 28 O 0.0018 0.0050 0.0048 197 TYR 28 CB -0.0023 0.0082 -0.0023 198 TYR 28 CG -0.0051 0.0091 -0.0077 199 TYR 28 CD1 -0.0074 0.0098 -0.0124 200 TYR 28 CD2 -0.0053 0.0088 -0.0083 201 TYR 28 CE1 -0.0099 0.0100 -0.0176 202 TYR 28 CE2 -0.0077 0.0090 -0.0135 203 TYR 28 CZ -0.0100 0.0096 -0.0182 204 TYR 28 OH -0.0124 0.0096 -0.0234 205 ARG 29 N 0.0122 0.0095 0.0187 206 ARG 29 CA 0.0067 0.0063 0.0157 207 ARG 29 C 0.0131 -0.0010 0.0210 208 ARG 29 O 0.0218 0.0033 0.0258 209 ARG 29 CB 0.0030 0.0178 0.0115 210 ARG 29 CG -0.0050 0.0143 0.0069 211 ARG 29 CD -0.0085 0.0253 0.0030 212 ARG 29 NE -0.0122 0.0346 -0.0008 213 ARG 29 CZ -0.0218 0.0339 -0.0069 214 ARG 29 NH1 -0.0291 0.0247 -0.0101 215 ARG 29 NH2 -0.0241 0.0426 -0.0097 216 ASN 30 N 0.0176 0.0111 0.0131 217 ASN 30 CA 0.0120 0.0210 0.0082 218 ASN 30 C 0.0061 0.0189 0.0152 219 ASN 30 O -0.0033 0.0264 0.0157 220 ASN 30 CB 0.0033 0.0320 0.0048 221 ASN 30 CG 0.0107 0.0360 -0.0052 222 ASN 30 OD1 0.0110 0.0350 -0.0045 223 ASN 30 ND2 0.0172 0.0407 -0.0152 224 ARG 31 N -0.0135 -0.0026 0.0056 225 ARG 31 CA -0.0047 0.0120 -0.0206 226 ARG 31 C 0.0022 0.0389 -0.0177 227 ARG 31 O 0.0008 0.0493 0.0059 228 ARG 31 CB -0.0015 0.0189 -0.0274 229 ARG 31 CG -0.0079 -0.0077 -0.0327 230 ARG 31 CD -0.0041 -0.0017 -0.0444 231 ARG 31 NE -0.0115 -0.0283 -0.0445 232 ARG 31 CZ -0.0135 -0.0491 -0.0648 233 ARG 31 NH1 -0.0090 -0.0477 -0.0876 234 ARG 31 NH2 -0.0205 -0.0725 -0.0618 235 GLU 32 N 0.0074 0.0196 -0.0087 236 GLU 32 CA 0.0009 0.0155 -0.0068 237 GLU 32 C -0.0027 0.0164 -0.0111 238 GLU 32 O 0.0005 0.0185 -0.0121 239 GLU 32 CB 0.0022 0.0117 0.0005 240 GLU 32 CG 0.0057 0.0103 0.0054 241 GLU 32 CD 0.0006 0.0063 0.0081 242 GLU 32 OE1 0.0006 0.0069 0.0072 243 GLU 32 OE2 -0.0034 0.0027 0.0112 244 VAL 33 N -0.0037 0.0065 -0.0098 245 VAL 33 CA -0.0041 0.0055 -0.0101 246 VAL 33 C -0.0045 0.0050 -0.0099 247 VAL 33 O -0.0044 0.0052 -0.0099 248 VAL 33 CB -0.0037 0.0052 -0.0110 249 VAL 33 CG1 -0.0033 0.0057 -0.0111 250 VAL 33 CG2 -0.0033 0.0051 -0.0116 251 VAL 34 N -0.0022 0.0025 -0.0128 252 VAL 34 CA -0.0026 0.0015 -0.0127 253 VAL 34 C -0.0030 0.0012 -0.0135 254 VAL 34 O -0.0029 0.0016 -0.0137 255 VAL 34 CB -0.0026 0.0011 -0.0117 256 VAL 34 CG1 -0.0030 0.0000 -0.0117 257 VAL 34 CG2 -0.0022 0.0014 -0.0109 258 VAL 35 N -0.0070 -0.0080 -0.0095 259 VAL 35 CA -0.0054 -0.0076 -0.0078 260 VAL 35 C -0.0049 -0.0048 -0.0088 261 VAL 35 O -0.0046 -0.0025 -0.0096 262 VAL 35 CB -0.0034 -0.0078 -0.0052 263 VAL 35 CG1 -0.0017 -0.0072 -0.0034 264 VAL 35 CG2 -0.0039 -0.0108 -0.0041 265 VAL 36 N -0.0009 0.0038 -0.0111 266 VAL 36 CA 0.0010 0.0047 -0.0118 267 VAL 36 C 0.0033 0.0047 -0.0101 268 VAL 36 O 0.0033 0.0038 -0.0079 269 VAL 36 CB 0.0002 0.0045 -0.0118 270 VAL 36 CG1 0.0019 0.0057 -0.0133 271 VAL 36 CG2 -0.0025 0.0040 -0.0128 272 GLY 37 N 0.0035 -0.0026 -0.0023 273 GLY 37 CA 0.0047 0.0005 0.0005 274 GLY 37 C 0.0040 0.0004 0.0029 275 GLY 37 O 0.0022 -0.0022 0.0036 276 LEU 38 N 0.0063 -0.0006 -0.0028 277 LEU 38 CA 0.0091 0.0005 -0.0022 278 LEU 38 C 0.0091 -0.0028 -0.0056 279 LEU 38 O 0.0053 -0.0040 -0.0062 280 LEU 38 CB 0.0066 0.0037 0.0013 281 LEU 38 CG 0.0090 0.0051 0.0024 282 LEU 38 CD1 0.0148 0.0065 0.0029 283 LEU 38 CD2 0.0060 0.0082 0.0060 284 ASN 39 N 0.0088 -0.0217 -0.0032 285 ASN 39 CA 0.0062 -0.0145 0.0028 286 ASN 39 C -0.0006 -0.0184 0.0079 287 ASN 39 O -0.0021 -0.0260 0.0058 288 ASN 39 CB 0.0110 -0.0073 0.0014 289 ASN 39 CG 0.0133 -0.0110 -0.0028 290 ASN 39 OD1 0.0094 -0.0149 -0.0007 291 ASN 39 ND2 0.0200 -0.0098 -0.0090 292 PRO 40 N 0.0047 -0.0392 0.0151 293 PRO 40 CA -0.0063 -0.0367 0.0156 294 PRO 40 C -0.0095 -0.0324 0.0191 295 PRO 40 O -0.0174 -0.0339 0.0165 296 PRO 40 CB -0.0088 -0.0319 0.0198 297 PRO 40 CG -0.0010 -0.0354 0.0177 298 PRO 40 CD 0.0087 -0.0374 0.0174 299 GLU 41 N -0.0070 -0.0203 0.0147 300 GLU 41 CA -0.0018 -0.0190 0.0129 301 GLU 41 C 0.0032 -0.0271 0.0125 302 GLU 41 O 0.0031 -0.0299 0.0129 303 GLU 41 CB 0.0041 -0.0118 0.0100 304 GLU 41 CG 0.0090 -0.0083 0.0080 305 GLU 41 CD 0.0153 -0.0017 0.0051 306 GLU 41 OE1 0.0167 -0.0006 0.0045 307 GLU 41 OE2 0.0188 0.0023 0.0034 308 ALA 42 N 0.0000 -0.0196 0.0105 309 ALA 42 CA -0.0021 -0.0199 0.0065 310 ALA 42 C -0.0012 -0.0209 0.0090 311 ALA 42 O -0.0032 -0.0244 0.0075 312 ALA 42 CB -0.0023 -0.0143 0.0024 313 VAL 43 N -0.0093 -0.0254 0.0120 314 VAL 43 CA -0.0092 -0.0259 0.0129 315 VAL 43 C -0.0091 -0.0269 0.0132 316 VAL 43 O -0.0090 -0.0277 0.0134 317 VAL 43 CB -0.0093 -0.0252 0.0138 318 VAL 43 CG1 -0.0092 -0.0257 0.0148 319 VAL 43 CG2 -0.0095 -0.0243 0.0135 320 GLU 44 N -0.0142 -0.0410 0.0151 321 GLU 44 CA -0.0170 -0.0364 0.0145 322 GLU 44 C -0.0107 -0.0347 0.0144 323 GLU 44 O -0.0120 -0.0356 0.0145 324 GLU 44 CB -0.0212 -0.0289 0.0136 325 GLU 44 CG -0.0289 -0.0312 0.0138 326 GLU 44 CD -0.0328 -0.0245 0.0130 327 GLU 44 OE1 -0.0342 -0.0182 0.0122 328 GLU 44 OE2 -0.0346 -0.0258 0.0131 329 GLU 45 N -0.0131 -0.0236 0.0090 330 GLU 45 CA -0.0092 -0.0233 0.0088 331 GLU 45 C -0.0074 -0.0266 0.0105 332 GLU 45 O -0.0052 -0.0267 0.0105 333 GLU 45 CB -0.0068 -0.0218 0.0080 334 GLU 45 CG -0.0078 -0.0180 0.0060 335 GLU 45 CD -0.0063 -0.0158 0.0049 336 GLU 45 OE1 -0.0033 -0.0143 0.0040 337 GLU 45 OE2 -0.0080 -0.0157 0.0048 338 ALA 46 N -0.0014 -0.0245 0.0081 339 ALA 46 CA -0.0009 -0.0229 0.0093 340 ALA 46 C 0.0030 -0.0244 0.0124 341 ALA 46 O 0.0038 -0.0257 0.0125 342 ALA 46 CB -0.0024 -0.0177 0.0103 343 GLN 47 N -0.0002 -0.0093 0.0089 344 GLN 47 CA 0.0052 -0.0094 0.0097 345 GLN 47 C 0.0092 -0.0117 0.0063 346 GLN 47 O 0.0142 -0.0117 0.0071 347 GLN 47 CB 0.0054 -0.0097 0.0091 348 GLN 47 CG 0.0019 -0.0074 0.0125 349 GLN 47 CD 0.0040 -0.0072 0.0131 350 GLN 47 OE1 0.0080 -0.0061 0.0156 351 GLN 47 NE2 0.0014 -0.0084 0.0107 352 VAL 48 N -0.0046 -0.0181 0.0104 353 VAL 48 CA -0.0029 -0.0121 0.0110 354 VAL 48 C 0.0001 -0.0112 0.0146 355 VAL 48 O 0.0003 -0.0075 0.0140 356 VAL 48 CB -0.0017 -0.0096 0.0120 357 VAL 48 CG1 0.0004 -0.0034 0.0132 358 VAL 48 CG2 -0.0051 -0.0097 0.0079 359 LEU 49 N 0.0034 -0.0138 0.0086 360 LEU 49 CA 0.0032 -0.0140 0.0082 361 LEU 49 C 0.0047 -0.0132 0.0107 362 LEU 49 O 0.0055 -0.0141 0.0106 363 LEU 49 CB 0.0003 -0.0124 0.0069 364 LEU 49 CG -0.0012 -0.0134 0.0041 365 LEU 49 CD1 -0.0041 -0.0115 0.0031 366 LEU 49 CD2 -0.0005 -0.0159 0.0021 367 THR 50 N 0.0144 -0.0302 0.0038 368 THR 50 CA 0.0130 -0.0292 -0.0000 369 THR 50 C 0.0096 -0.0279 -0.0001 370 THR 50 O 0.0078 -0.0269 -0.0030 371 THR 50 CB 0.0155 -0.0300 -0.0030 372 THR 50 OG1 0.0167 -0.0306 -0.0018 373 THR 50 CG2 0.0187 -0.0312 -0.0037 374 LYS 51 N 0.0006 -0.0259 0.0087 375 LYS 51 CA -0.0130 -0.0140 0.0076 376 LYS 51 C -0.0011 -0.0069 0.0131 377 LYS 51 O -0.0102 0.0023 0.0126 378 LYS 51 CB -0.0227 0.0059 0.0097 379 LYS 51 CG -0.0355 0.0005 0.0044 380 LYS 51 CD -0.0411 0.0198 0.0076 381 LYS 51 CE -0.0552 0.0146 0.0019 382 LYS 51 NZ -0.0441 0.0149 0.0054 383 PHE 52 N 0.0055 0.0022 0.0053 384 PHE 52 CA 0.0064 0.0040 0.0074 385 PHE 52 C 0.0080 0.0022 0.0081 386 PHE 52 O 0.0077 0.0031 0.0082 387 PHE 52 CB 0.0079 0.0055 0.0099 388 PHE 52 CG 0.0065 0.0074 0.0094 389 PHE 52 CD1 0.0046 0.0101 0.0088 390 PHE 52 CD2 0.0072 0.0064 0.0096 391 PHE 52 CE1 0.0033 0.0119 0.0084 392 PHE 52 CE2 0.0059 0.0081 0.0092 393 PHE 52 CZ 0.0040 0.0109 0.0086 394 ALA 53 N 0.0027 -0.0009 0.0050 395 ALA 53 CA 0.0016 -0.0001 0.0058 396 ALA 53 C 0.0017 0.0020 0.0045 397 ALA 53 O 0.0031 0.0025 0.0028 398 ALA 53 CB 0.0020 -0.0021 0.0064 399 SER 54 N 0.0006 0.0140 0.0009 400 SER 54 CA 0.0011 0.0180 0.0035 401 SER 54 C -0.0010 0.0098 0.0032 402 SER 54 O 0.0002 0.0110 -0.0010 403 SER 54 CB -0.0000 0.0229 0.0145 404 SER 54 OG 0.0023 0.0323 0.0150 405 THR 55 N -0.0011 0.0022 0.0006 406 THR 55 CA -0.0034 -0.0028 0.0010 407 THR 55 C -0.0051 -0.0063 -0.0003 408 THR 55 O -0.0048 -0.0057 0.0016 409 THR 55 CB -0.0042 -0.0041 0.0066 410 THR 55 OG1 -0.0028 -0.0010 0.0082 411 THR 55 CG2 -0.0067 -0.0094 0.0067 412 VAL 56 N -0.0007 -0.0127 -0.0030 413 VAL 56 CA -0.0020 -0.0136 -0.0038 414 VAL 56 C -0.0036 -0.0122 -0.0032 415 VAL 56 O -0.0031 -0.0111 -0.0023 416 VAL 56 CB -0.0007 -0.0145 -0.0042 417 VAL 56 CG1 -0.0022 -0.0153 -0.0051 418 VAL 56 CG2 0.0009 -0.0159 -0.0049 419 HIS 57 N -0.0064 -0.0073 -0.0030 420 HIS 57 CA -0.0074 -0.0084 -0.0020 421 HIS 57 C -0.0090 -0.0083 -0.0031 422 HIS 57 O -0.0087 -0.0075 -0.0042 423 HIS 57 CB -0.0060 -0.0086 -0.0010 424 HIS 57 CG -0.0044 -0.0087 0.0002 425 HIS 57 ND1 -0.0046 -0.0098 0.0017 426 HIS 57 CD2 -0.0025 -0.0079 0.0001 427 HIS 57 CE1 -0.0029 -0.0096 0.0025 428 HIS 57 NE2 -0.0016 -0.0085 0.0016 429 TRP 58 N -0.0062 0.0039 0.0065 430 TRP 58 CA -0.0061 0.0035 0.0064 431 TRP 58 C -0.0075 0.0051 0.0062 432 TRP 58 O -0.0074 0.0070 0.0066 433 TRP 58 CB -0.0039 0.0037 0.0074 434 TRP 58 CG -0.0035 0.0029 0.0074 435 TRP 58 CD1 -0.0046 0.0016 0.0066 436 TRP 58 CD2 -0.0019 0.0034 0.0082 437 TRP 58 NE1 -0.0038 0.0013 0.0069 438 TRP 58 CE2 -0.0021 0.0023 0.0079 439 TRP 58 CE3 -0.0004 0.0047 0.0092 440 TRP 58 CZ2 -0.0008 0.0025 0.0085 441 TRP 58 CZ3 0.0009 0.0049 0.0098 442 TRP 58 CH2 0.0007 0.0038 0.0095 443 ILE 59 N -0.0043 0.0098 0.0122 444 ILE 59 CA -0.0020 0.0122 0.0098 445 ILE 59 C 0.0006 0.0146 0.0122 446 ILE 59 O 0.0010 0.0149 0.0150 447 ILE 59 CB -0.0024 0.0118 0.0079 448 ILE 59 CG1 -0.0050 0.0093 0.0052 449 ILE 59 CG2 0.0001 0.0144 0.0056 450 ILE 59 CD1 -0.0058 0.0085 0.0036 451 THR 60 N 0.0051 0.0186 0.0192 452 THR 60 CA 0.0090 0.0175 0.0198 453 THR 60 C 0.0118 0.0173 0.0185 454 THR 60 O 0.0112 0.0183 0.0157 455 THR 60 CB 0.0104 0.0178 0.0179 456 THR 60 OG1 0.0105 0.0190 0.0139 457 THR 60 CG2 0.0076 0.0181 0.0190 458 PRO 61 N 0.0252 0.0135 0.0180 459 PRO 61 CA 0.0268 0.0086 0.0203 460 PRO 61 C 0.0255 0.0043 0.0170 461 PRO 61 O 0.0266 -0.0000 0.0184 462 PRO 61 CB 0.0277 0.0079 0.0218 463 PRO 61 CG 0.0256 0.0107 0.0184 464 PRO 61 CD 0.0247 0.0153 0.0174 465 LYS 62 N 0.0436 0.0126 0.0237 466 LYS 62 CA 0.0252 0.0019 0.0321 467 LYS 62 C 0.0345 0.0064 0.0299 468 LYS 62 O 0.0529 0.0177 0.0201 469 LYS 62 CB -0.0011 -0.0015 0.0176 470 LYS 62 CG -0.0037 0.0093 -0.0087 471 LYS 62 CD -0.0290 0.0066 -0.0238 472 LYS 62 CE -0.0315 0.0104 -0.0344 473 LYS 62 NZ -0.0556 0.0083 -0.0501 474 ASP 63 N 0.0346 0.0037 0.0237 475 ASP 63 CA 0.0209 0.0158 0.0031 476 ASP 63 C 0.0157 0.0210 0.0084 477 ASP 63 O 0.0292 0.0085 0.0156 478 ASP 63 CB 0.0303 0.0057 -0.0255 479 ASP 63 CG 0.0205 0.0140 -0.0496 480 ASP 63 OD1 0.0243 0.0104 -0.0500 481 ASP 63 OD2 0.0097 0.0237 -0.0670 482 PRO 64 N 0.0001 0.0109 0.0099 483 PRO 64 CA -0.0010 0.0138 0.0079 484 PRO 64 C -0.0031 0.0126 0.0034 485 PRO 64 O -0.0041 0.0144 0.0015 486 PRO 64 CB -0.0009 0.0187 0.0083 487 PRO 64 CG 0.0006 0.0184 0.0114 488 PRO 64 CD 0.0005 0.0135 0.0109 489 HIS 65 N -0.0145 0.0086 0.0027 490 HIS 65 CA -0.0189 0.0077 0.0007 491 HIS 65 C -0.0190 0.0080 0.0007 492 HIS 65 O -0.0224 0.0084 -0.0007 493 HIS 65 CB -0.0206 0.0030 -0.0004 494 HIS 65 CG -0.0211 0.0028 -0.0006 495 HIS 65 ND1 -0.0181 0.0002 0.0005 496 HIS 65 CD2 -0.0242 0.0048 -0.0018 497 HIS 65 CE1 -0.0194 0.0006 -0.0000 498 HIS 65 NE2 -0.0231 0.0034 -0.0014 499 THR 66 N -0.0007 0.0011 -0.0127 500 THR 66 CA 0.0029 0.0001 -0.0094 501 THR 66 C 0.0007 0.0035 -0.0066 502 THR 66 O 0.0029 0.0024 -0.0054 503 THR 66 CB 0.0071 -0.0008 -0.0049 504 THR 66 OG1 0.0053 0.0028 -0.0014 505 THR 66 CG2 0.0103 -0.0048 -0.0073 506 LEU 67 N -0.0075 -0.0127 -0.0002 507 LEU 67 CA -0.0086 -0.0136 0.0050 508 LEU 67 C -0.0098 -0.0147 0.0087 509 LEU 67 O -0.0116 -0.0165 0.0126 510 LEU 67 CB -0.0115 -0.0171 0.0047 511 LEU 67 CG -0.0106 -0.0161 0.0029 512 LEU 67 CD1 -0.0137 -0.0198 0.0037 513 LEU 67 CD2 -0.0078 -0.0125 0.0059 514 ASP 68 N -0.0529 -0.0150 0.0166 515 ASP 68 CA -0.0221 -0.0089 0.0079 516 ASP 68 C 0.0163 -0.0044 -0.0050 517 ASP 68 O 0.0365 -0.0242 -0.0262 518 ASP 68 CB -0.0291 -0.0343 -0.0058 519 ASP 68 CG -0.0070 -0.0208 -0.0061 520 ASP 68 OD1 0.0197 -0.0331 -0.0251 521 ASP 68 OD2 -0.0169 0.0023 0.0131 522 GLY 69 N -0.0277 -0.0044 -0.0026 523 GLY 69 CA -0.0227 -0.0035 -0.0035 524 GLY 69 C -0.0246 -0.0085 -0.0037 525 GLY 69 O -0.0219 -0.0071 -0.0040 526 HIS 70 N -0.0178 -0.0268 0.0036 527 HIS 70 CA -0.0182 -0.0278 0.0035 528 HIS 70 C -0.0211 -0.0079 0.0177 529 HIS 70 O -0.0147 0.0008 0.0149 530 HIS 70 CB -0.0314 -0.0501 0.0067 531 HIS 70 CG -0.0288 -0.0587 -0.0010 532 HIS 70 ND1 -0.0347 -0.0519 0.0095 533 HIS 70 CD2 -0.0212 -0.0731 -0.0175 534 HIS 70 CE1 -0.0303 -0.0621 -0.0010 535 HIS 70 NE2 -0.0222 -0.0752 -0.0175 536 ALA 71 N -0.0106 0.0053 0.0050 537 ALA 71 CA -0.0126 0.0092 0.0076 538 ALA 71 C -0.0094 0.0151 0.0083 539 ALA 71 O -0.0107 0.0187 0.0104 540 ALA 71 CB -0.0183 0.0095 0.0107 541 ASP 72 N -0.0138 0.0282 0.0053 542 ASP 72 CA -0.0135 0.0262 0.0077 543 ASP 72 C -0.0067 0.0355 0.0066 544 ASP 72 O -0.0018 0.0352 0.0131 545 ASP 72 CB -0.0229 0.0213 0.0010 546 ASP 72 CG -0.0295 0.0106 0.0037 547 ASP 72 OD1 -0.0273 0.0072 0.0099 548 ASP 72 OD2 -0.0370 0.0058 -0.0007 549 GLU 73 N -0.0143 0.0256 0.0136 550 GLU 73 CA -0.0067 0.0207 0.0125 551 GLU 73 C 0.0143 0.0160 0.0053 552 GLU 73 O 0.0226 0.0020 0.0079 553 GLU 73 CB -0.0133 0.0366 0.0082 554 GLU 73 CG -0.0086 0.0321 0.0081 555 GLU 73 CD -0.0150 0.0483 0.0036 556 GLU 73 OE1 -0.0236 0.0631 0.0007 557 GLU 73 OE2 -0.0114 0.0455 0.0033 558 LEU 74 N 0.0272 0.0093 0.0062 559 LEU 74 CA 0.0214 0.0083 0.0027 560 LEU 74 C 0.0193 0.0137 -0.0003 561 LEU 74 O 0.0159 0.0127 -0.0023 562 LEU 74 CB 0.0191 0.0074 0.0014 563 LEU 74 CG 0.0129 0.0065 -0.0024 564 LEU 74 CD1 0.0103 0.0007 -0.0025 565 LEU 74 CD2 0.0112 0.0061 -0.0035 566 LEU 75 N 0.0199 0.0073 -0.0056 567 LEU 75 CA 0.0197 0.0076 -0.0027 568 LEU 75 C 0.0222 0.0064 0.0010 569 LEU 75 O 0.0229 0.0061 0.0032 570 LEU 75 CB 0.0158 0.0097 -0.0012 571 LEU 75 CG 0.0132 0.0109 -0.0044 572 LEU 75 CD1 0.0093 0.0130 -0.0031 573 LEU 75 CD2 0.0138 0.0105 -0.0052 574 ALA 76 N 0.0396 -0.0051 -0.0143 575 ALA 76 CA 0.0076 -0.0307 -0.0208 576 ALA 76 C -0.0134 -0.0447 -0.0214 577 ALA 76 O -0.0385 -0.0685 -0.0309 578 ALA 76 CB -0.0151 -0.0239 0.0055 579 HIS 77 N 0.0449 -0.0163 -0.0168 580 HIS 77 CA 0.0400 -0.0217 -0.0176 581 HIS 77 C 0.0413 -0.0278 -0.0280 582 HIS 77 O 0.0485 -0.0250 -0.0340 583 HIS 77 CB 0.0420 -0.0165 -0.0130 584 HIS 77 CG 0.0352 -0.0213 -0.0105 585 HIS 77 ND1 0.0346 -0.0271 -0.0177 586 HIS 77 CD2 0.0288 -0.0215 -0.0020 587 HIS 77 CE1 0.0278 -0.0307 -0.0136 588 HIS 77 NE2 0.0241 -0.0276 -0.0040 589 PRO 78 N 0.1306 -0.0277 0.0137 590 PRO 78 CA 0.0708 0.0032 -0.0621 591 PRO 78 C 0.0146 -0.0125 -0.0303 592 PRO 78 O -0.0207 0.0123 -0.0902 593 PRO 78 CB -0.0074 0.0152 -0.0957 594 PRO 78 CG 0.0401 0.0030 -0.0640 595 PRO 78 CD 0.0967 -0.0352 0.0283 596 SER 79 N 0.0164 -0.0135 -0.0237 597 SER 79 CA 0.0112 -0.0153 -0.0188 598 SER 79 C 0.0120 -0.0189 -0.0168 599 SER 79 O 0.0078 -0.0200 -0.0130 600 SER 79 CB 0.0097 -0.0190 -0.0151 601 SER 79 OG 0.0086 -0.0158 -0.0166 602 VAL 80 N 0.0220 -0.0208 -0.0118 603 VAL 80 CA 0.0162 -0.0172 -0.0144 604 VAL 80 C 0.0126 -0.0119 -0.0127 605 VAL 80 O 0.0140 -0.0085 -0.0074 606 VAL 80 CB 0.0159 -0.0155 -0.0129 607 VAL 80 CG1 0.0097 -0.0111 -0.0151 608 VAL 80 CG2 0.0185 -0.0211 -0.0161 609 LYS 81 N -0.0233 -0.0140 0.0130 610 LYS 81 CA -0.0224 -0.0185 0.0158 611 LYS 81 C -0.0267 -0.0117 0.0126 612 LYS 81 O -0.0233 -0.0049 0.0066 613 LYS 81 CB -0.0114 -0.0230 0.0147 614 LYS 81 CG -0.0074 -0.0313 0.0191 615 LYS 81 CD 0.0026 -0.0368 0.0191 616 LYS 81 CE 0.0063 -0.0456 0.0239 617 LYS 81 NZ 0.0114 -0.0443 0.0211 618 LEU 82 N -0.0126 0.0091 0.0116 619 LEU 82 CA -0.0101 0.0126 0.0120 620 LEU 82 C -0.0107 0.0156 0.0069 621 LEU 82 O -0.0107 0.0178 0.0041 622 LEU 82 CB -0.0063 0.0157 0.0152 623 LEU 82 CG -0.0035 0.0197 0.0156 624 LEU 82 CD1 -0.0033 0.0179 0.0182 625 LEU 82 CD2 0.0001 0.0229 0.0182 626 TRP 83 N -0.0109 0.0110 0.0155 627 TRP 83 CA -0.0071 0.0125 0.0109 628 TRP 83 C -0.0049 0.0182 0.0122 629 TRP 83 O -0.0028 0.0219 0.0120 630 TRP 83 CB -0.0053 0.0117 0.0076 631 TRP 83 CG -0.0076 0.0060 0.0064 632 TRP 83 CD1 -0.0103 0.0038 0.0088 633 TRP 83 CD2 -0.0072 0.0018 0.0025 634 TRP 83 NE1 -0.0117 -0.0015 0.0066 635 TRP 83 CE2 -0.0099 -0.0029 0.0027 636 TRP 83 CE3 -0.0049 0.0016 -0.0011 637 TRP 83 CZ2 -0.0102 -0.0077 -0.0006 638 TRP 83 CZ3 -0.0053 -0.0033 -0.0045 639 TRP 83 CH2 -0.0079 -0.0079 -0.0042 640 GLU 84 N 0.0091 0.0224 0.0144 641 GLU 84 CA 0.0169 0.0223 0.0159 642 GLU 84 C 0.0149 0.0250 0.0134 643 GLU 84 O 0.0099 0.0300 0.0085 644 GLU 84 CB 0.0260 0.0268 0.0138 645 GLU 84 CG 0.0255 0.0354 0.0068 646 GLU 84 CD 0.0351 0.0399 0.0049 647 GLU 84 OE1 0.0420 0.0364 0.0089 648 GLU 84 OE2 0.0358 0.0466 -0.0004 649 LYS 85 N 0.0340 0.0054 0.0214 650 LYS 85 CA 0.0241 0.0056 0.0228 651 LYS 85 C 0.0133 0.0062 0.0243 652 LYS 85 O 0.0055 0.0117 0.0263 653 LYS 85 CB 0.0244 0.0151 0.0244 654 LYS 85 CG 0.0349 0.0156 0.0230 655 LYS 85 CD 0.0330 0.0223 0.0244 656 LYS 85 CE 0.0430 0.0299 0.0243 657 LYS 85 NZ 0.0425 0.0410 0.0263 658 THR 86 N 0.0085 0.0120 0.0100 659 THR 86 CA 0.0083 0.0116 0.0092 660 THR 86 C 0.0084 0.0117 0.0092 661 THR 86 O 0.0084 0.0117 0.0099 662 THR 86 CB 0.0080 0.0107 0.0089 663 THR 86 OG1 0.0078 0.0100 0.0095 664 THR 86 CG2 0.0080 0.0106 0.0090 665 ARG 87 N 0.0037 0.0119 -0.0035 666 ARG 87 CA 0.0057 0.0147 0.0027 667 ARG 87 C 0.0065 0.0247 0.0092 668 ARG 87 O 0.0083 0.0255 0.0141 669 ARG 87 CB 0.0100 0.0057 0.0094 670 ARG 87 CG 0.0110 0.0056 0.0117 671 ARG 87 CD 0.0158 0.0025 0.0222 672 ARG 87 NE 0.0181 -0.0091 0.0227 673 ARG 87 CZ 0.0194 -0.0167 0.0225 674 ARG 87 NH1 0.0184 -0.0146 0.0208 675 ARG 87 NH2 0.0218 -0.0267 0.0238 676 LEU 88 N 0.0085 0.0159 0.0075 677 LEU 88 CA 0.0074 0.0144 0.0069 678 LEU 88 C 0.0082 0.0153 0.0054 679 LEU 88 O 0.0092 0.0166 0.0063 680 LEU 88 CB 0.0064 0.0135 0.0092 681 LEU 88 CG 0.0053 0.0120 0.0089 682 LEU 88 CD1 0.0042 0.0104 0.0070 683 LEU 88 CD2 0.0043 0.0111 0.0114 684 ILE 89 N 0.0051 0.0138 0.0053 685 ILE 89 CA 0.0060 0.0132 0.0077 686 ILE 89 C 0.0028 0.0137 0.0120 687 ILE 89 O 0.0040 0.0128 0.0157 688 ILE 89 CB 0.0054 0.0138 0.0042 689 ILE 89 CG1 0.0084 0.0134 -0.0005 690 ILE 89 CG2 0.0063 0.0132 0.0067 691 ILE 89 CD1 0.0136 0.0116 0.0004 692 ARG 90 N -0.0006 0.0087 0.0136 693 ARG 90 CA -0.0009 0.0069 0.0125 694 ARG 90 C 0.0043 0.0074 0.0117 695 ARG 90 O 0.0075 0.0105 0.0132 696 ARG 90 CB -0.0047 0.0094 0.0150 697 ARG 90 CG -0.0063 0.0076 0.0141 698 ARG 90 CD -0.0112 0.0095 0.0164 699 ARG 90 NE -0.0155 0.0079 0.0162 700 ARG 90 CZ -0.0180 0.0103 0.0184 701 ARG 90 NH1 -0.0171 0.0145 0.0212 702 ARG 90 NH2 -0.0215 0.0083 0.0177 703 ILE 91 N -0.0020 -0.0072 0.0133 704 ILE 91 CA -0.0004 -0.0068 0.0129 705 ILE 91 C 0.0025 -0.0067 0.0129 706 ILE 91 O 0.0031 -0.0061 0.0121 707 ILE 91 CB -0.0011 -0.0053 0.0107 708 ILE 91 CG1 -0.0041 -0.0054 0.0108 709 ILE 91 CG2 0.0008 -0.0048 0.0102 710 ILE 91 CD1 -0.0053 -0.0038 0.0085 711 LYS 92 N 0.0104 -0.0077 0.0202 712 LYS 92 CA 0.0086 -0.0081 0.0191 713 LYS 92 C 0.0080 -0.0097 0.0196 714 LYS 92 O 0.0090 -0.0101 0.0205 715 LYS 92 CB 0.0082 -0.0064 0.0179 716 LYS 92 CG 0.0086 -0.0046 0.0172 717 LYS 92 CD 0.0083 -0.0030 0.0162 718 LYS 92 CE 0.0072 -0.0019 0.0147 719 LYS 92 NZ 0.0081 -0.0006 0.0147 720 GLY 93 N 0.0060 -0.0104 0.0184 721 GLY 93 CA 0.0023 -0.0099 0.0196 722 GLY 93 C -0.0006 -0.0096 0.0208 723 GLY 93 O -0.0001 -0.0096 0.0200 724 GLU 94 N -0.0085 -0.0140 0.0149 725 GLU 94 CA -0.0148 -0.0114 0.0204 726 GLU 94 C -0.0167 -0.0098 0.0315 727 GLU 94 O -0.0128 -0.0109 0.0345 728 GLU 94 CB -0.0252 -0.0084 0.0143 729 GLU 94 CG -0.0242 -0.0097 0.0026 730 GLU 94 CD -0.0348 -0.0066 -0.0029 731 GLU 94 OE1 -0.0365 -0.0065 -0.0084 732 GLU 94 OE2 -0.0411 -0.0044 -0.0017 733 GLU 95 N -0.0127 -0.0260 0.0328 734 GLU 95 CA -0.0112 -0.0155 0.0236 735 GLU 95 C -0.0195 -0.0140 0.0262 736 GLU 95 O -0.0270 -0.0039 0.0217 737 GLU 95 CB 0.0047 -0.0168 0.0173 738 GLU 95 CG 0.0078 -0.0055 0.0067 739 GLU 95 CD 0.0087 0.0045 -0.0017 740 GLU 95 OE1 0.0185 0.0018 -0.0041 741 GLU 95 OE2 -0.0005 0.0147 -0.0057 742 ALA 96 N -0.0287 -0.0146 0.0203 743 ALA 96 CA -0.0069 -0.0137 0.0099 744 ALA 96 C 0.0137 -0.0233 0.0014 745 ALA 96 O 0.0293 -0.0362 -0.0045 746 ALA 96 CB -0.0036 0.0135 0.0053 747 GLY 97 N 0.0083 -0.0128 0.0090 748 GLY 97 CA 0.0058 -0.0115 0.0099 749 GLY 97 C 0.0021 -0.0062 0.0161 750 GLY 97 O -0.0005 -0.0035 0.0190 751 VAL 98 N 0.0069 -0.0027 0.0086 752 VAL 98 CA 0.0053 -0.0028 0.0110 753 VAL 98 C 0.0078 0.0019 0.0139 754 VAL 98 O 0.0117 0.0049 0.0121 755 VAL 98 CB 0.0053 -0.0055 0.0071 756 VAL 98 CG1 0.0036 -0.0056 0.0095 757 VAL 98 CG2 0.0025 -0.0104 0.0044 758 THR 99 N 0.0116 0.0039 0.0150 759 THR 99 CA 0.0123 0.0117 0.0148 760 THR 99 C 0.0124 0.0050 0.0111 761 THR 99 O 0.0137 0.0103 0.0067 762 THR 99 CB 0.0107 0.0177 0.0266 763 THR 99 OG1 0.0083 0.0093 0.0358 764 THR 99 CG2 0.0108 0.0260 0.0303 765 ALA 100 N 0.0131 -0.0034 0.0136 766 ALA 100 CA 0.0133 -0.0050 0.0126 767 ALA 100 C 0.0132 -0.0092 0.0122 768 ALA 100 O 0.0127 -0.0111 0.0133 769 ALA 100 CB 0.0124 -0.0039 0.0153 770 VAL 101 N 0.0144 -0.0022 0.0040 771 VAL 101 CA 0.0146 -0.0033 0.0040 772 VAL 101 C 0.0146 -0.0039 0.0042 773 VAL 101 O 0.0146 -0.0035 0.0040 774 VAL 101 CB 0.0147 -0.0038 0.0029 775 VAL 101 CG1 0.0146 -0.0034 0.0027 776 VAL 101 CG2 0.0146 -0.0036 0.0019 777 GLU 102 N 0.0101 0.0061 -0.0002 778 GLU 102 CA 0.0086 0.0110 -0.0011 779 GLU 102 C 0.0126 0.0123 -0.0003 780 GLU 102 O 0.0132 0.0092 0.0002 781 GLU 102 CB 0.0032 0.0102 -0.0023 782 GLU 102 CG 0.0007 0.0152 -0.0035 783 GLU 102 CD -0.0044 0.0139 -0.0045 784 GLU 102 OE1 -0.0068 0.0097 -0.0047 785 GLU 102 OE2 -0.0059 0.0170 -0.0053 786 VAL 103 N 0.0094 0.0105 -0.0087 787 VAL 103 CA 0.0106 0.0125 -0.0072 788 VAL 103 C 0.0117 0.0139 -0.0093 789 VAL 103 O 0.0114 0.0129 -0.0117 790 VAL 103 CB 0.0098 0.0117 -0.0047 791 VAL 103 CG1 0.0086 0.0104 -0.0025 792 VAL 103 CG2 0.0088 0.0100 -0.0058 793 ARG 104 N 0.0105 -0.0100 -0.0210 794 ARG 104 CA 0.0098 -0.0089 -0.0205 795 ARG 104 C 0.0116 -0.0097 -0.0215 796 ARG 104 O 0.0124 -0.0120 -0.0221 797 ARG 104 CB 0.0072 -0.0101 -0.0193 798 ARG 104 CG 0.0062 -0.0092 -0.0187 799 ARG 104 CD 0.0040 -0.0110 -0.0177 800 ARG 104 NE 0.0019 -0.0102 -0.0166 801 ARG 104 CZ -0.0003 -0.0115 -0.0156 802 ARG 104 NH1 -0.0007 -0.0138 -0.0156 803 ARG 104 NH2 -0.0022 -0.0105 -0.0146 804 HIS 105 N 0.0011 -0.0118 0.0013 805 HIS 105 CA -0.0014 -0.0075 0.0053 806 HIS 105 C -0.0152 -0.0061 0.0017 807 HIS 105 O -0.0234 -0.0029 0.0023 808 HIS 105 CB 0.0017 0.0017 0.0166 809 HIS 105 CG 0.0074 0.0042 0.0215 810 HIS 105 ND1 0.0203 0.0013 0.0230 811 HIS 105 CD2 0.0022 0.0090 0.0249 812 HIS 105 CE1 0.0226 0.0044 0.0273 813 HIS 105 NE2 0.0119 0.0092 0.0287 814 PRO 106 N -0.0101 -0.0086 0.0212 815 PRO 106 CA -0.0053 -0.0197 0.0281 816 PRO 106 C -0.0022 -0.0335 0.0320 817 PRO 106 O -0.0064 -0.0413 0.0235 818 PRO 106 CB -0.0104 -0.0236 0.0187 819 PRO 106 CG -0.0160 -0.0095 0.0106 820 PRO 106 CD -0.0172 -0.0041 0.0091 821 GLY 107 N -0.0442 -0.0076 0.0163 822 GLY 107 CA -0.0023 -0.0701 0.0046 823 GLY 107 C -0.0218 -0.0504 -0.0052 824 GLY 107 O 0.0171 -0.0921 0.0102 825 GLU 108 N -0.0298 -0.0387 0.0011 826 GLU 108 CA -0.0358 -0.0181 0.0048 827 GLU 108 C -0.0538 -0.0156 0.0179 828 GLU 108 O -0.0619 -0.0029 0.0234 829 GLU 108 CB -0.0266 -0.0065 -0.0024 830 GLU 108 CG -0.0099 0.0004 -0.0150 831 GLU 108 CD -0.0106 0.0172 -0.0151 832 GLU 108 OE1 -0.0238 0.0262 -0.0057 833 GLU 108 OE2 0.0025 0.0212 -0.0249 834 SER 109 N -0.0806 -0.0420 -0.0068 835 SER 109 CA -0.0380 -0.0366 -0.0205 836 SER 109 C -0.0203 -0.0509 -0.0237 837 SER 109 O 0.0077 -0.0331 -0.0349 838 SER 109 CB -0.0125 -0.0530 -0.0257 839 SER 109 OG 0.0255 -0.0360 -0.0398 840 ASP 110 N -0.0101 -0.0358 -0.0300 841 ASP 110 CA -0.0043 -0.0351 -0.0298 842 ASP 110 C 0.0162 -0.0490 -0.0356 843 ASP 110 O 0.0327 -0.0510 -0.0366 844 ASP 110 CB 0.0002 -0.0120 -0.0207 845 ASP 110 CG -0.0224 -0.0002 -0.0157 846 ASP 110 OD1 -0.0366 -0.0067 -0.0181 847 ASP 110 OD2 -0.0257 0.0150 -0.0096 848 SER 111 N -0.0101 0.0390 -0.0347 849 SER 111 CA -0.0078 0.0420 -0.0411 850 SER 111 C -0.0120 0.0706 -0.0555 851 SER 111 O -0.0221 0.0904 -0.0523 852 SER 111 CB -0.0189 0.0365 -0.0170 853 SER 111 OG -0.0159 0.0096 -0.0019 854 GLN 112 N 0.0175 0.0288 -0.0267 855 GLN 112 CA 0.0215 0.0102 -0.0159 856 GLN 112 C 0.0250 -0.0015 -0.0204 857 GLN 112 O 0.0229 0.0063 -0.0201 858 GLN 112 CB 0.0186 0.0131 0.0070 859 GLN 112 CG 0.0220 -0.0036 0.0184 860 GLN 112 CD 0.0204 -0.0051 0.0404 861 GLN 112 OE1 0.0219 -0.0123 0.0453 862 GLN 112 NE2 0.0173 0.0017 0.0541 863 GLU 113 N 0.0258 -0.0054 -0.0082 864 GLU 113 CA 0.0257 -0.0044 -0.0081 865 GLU 113 C 0.0275 -0.0018 -0.0114 866 GLU 113 O 0.0279 0.0014 -0.0123 867 GLU 113 CB 0.0238 -0.0022 -0.0045 868 GLU 113 CG 0.0235 -0.0019 -0.0040 869 GLU 113 CD 0.0214 -0.0013 0.0000 870 GLU 113 OE1 0.0202 -0.0043 0.0022 871 GLU 113 OE2 0.0210 0.0021 0.0009 872 LEU 114 N 0.0278 -0.0048 -0.0067 873 LEU 114 CA 0.0241 -0.0053 -0.0054 874 LEU 114 C 0.0252 -0.0029 -0.0058 875 LEU 114 O 0.0260 0.0013 -0.0061 876 LEU 114 CB 0.0198 -0.0031 -0.0040 877 LEU 114 CG 0.0178 -0.0056 -0.0033 878 LEU 114 CD1 0.0143 -0.0025 -0.0021 879 LEU 114 CD2 0.0157 -0.0103 -0.0026 880 LEU 115 N 0.0264 -0.0006 -0.0133 881 LEU 115 CA 0.0193 0.0108 -0.0052 882 LEU 115 C 0.0179 0.0123 -0.0102 883 LEU 115 O 0.0178 0.0109 -0.0244 884 LEU 115 CB 0.0103 0.0238 -0.0083 885 LEU 115 CG 0.0110 0.0233 -0.0036 886 LEU 115 CD1 0.0034 0.0335 -0.0129 887 LEU 115 CD2 0.0107 0.0257 0.0145 888 ALA 116 N 0.0107 0.0081 -0.0093 889 ALA 116 CA 0.0104 0.0085 -0.0122 890 ALA 116 C 0.0111 0.0101 -0.0119 891 ALA 116 O 0.0113 0.0100 -0.0096 892 ALA 116 CB 0.0091 0.0056 -0.0135 893 GLU 117 N 0.0055 0.0193 -0.0360 894 GLU 117 CA -0.0003 0.0154 -0.0266 895 GLU 117 C 0.0068 0.0095 -0.0192 896 GLU 117 O 0.0040 0.0054 -0.0107 897 GLU 117 CB -0.0086 0.0175 -0.0268 898 GLU 117 CG -0.0179 0.0228 -0.0321 899 GLU 117 CD -0.0239 0.0263 -0.0357 900 GLU 117 OE1 -0.0197 0.0292 -0.0428 901 GLU 117 OE2 -0.0326 0.0259 -0.0313 902 GLY 118 N -0.0023 0.0089 -0.0172 903 GLY 118 CA -0.0031 0.0056 -0.0208 904 GLY 118 C -0.0060 0.0033 -0.0201 905 GLY 118 O -0.0060 0.0043 -0.0188 906 VAL 119 N -0.0031 0.0026 -0.0164 907 VAL 119 CA -0.0059 0.0023 -0.0159 908 VAL 119 C -0.0073 0.0028 -0.0182 909 VAL 119 O -0.0070 0.0034 -0.0203 910 VAL 119 CB -0.0066 0.0021 -0.0154 911 VAL 119 CG1 -0.0095 0.0017 -0.0147 912 VAL 119 CG2 -0.0050 0.0016 -0.0132 913 PHE 120 N -0.0069 -0.0013 -0.0178 914 PHE 120 CA -0.0051 -0.0024 -0.0161 915 PHE 120 C -0.0034 -0.0009 -0.0162 916 PHE 120 O -0.0023 0.0010 -0.0169 917 PHE 120 CB -0.0037 -0.0028 -0.0151 918 PHE 120 CG -0.0053 -0.0044 -0.0148 919 PHE 120 CD1 -0.0068 -0.0038 -0.0161 920 PHE 120 CD2 -0.0051 -0.0066 -0.0132 921 PHE 120 CE1 -0.0081 -0.0053 -0.0157 922 PHE 120 CE2 -0.0065 -0.0082 -0.0129 923 PHE 120 CZ -0.0080 -0.0075 -0.0142 924 VAL 121 N 0.0019 0.0096 -0.0110 925 VAL 121 CA 0.0023 0.0097 -0.0111 926 VAL 121 C 0.0048 0.0079 -0.0106 927 VAL 121 O 0.0048 0.0054 -0.0098 928 VAL 121 CB -0.0004 0.0089 -0.0107 929 VAL 121 CG1 0.0001 0.0093 -0.0108 930 VAL 121 CG2 -0.0030 0.0107 -0.0111 931 TYR 122 N 0.0106 -0.0026 -0.0123 932 TYR 122 CA 0.0098 0.0002 -0.0093 933 TYR 122 C 0.0118 0.0029 -0.0100 934 TYR 122 O 0.0112 0.0027 -0.0094 935 TYR 122 CB 0.0068 -0.0015 -0.0066 936 TYR 122 CG 0.0049 -0.0041 -0.0060 937 TYR 122 CD1 0.0043 -0.0028 -0.0043 938 TYR 122 CD2 0.0038 -0.0079 -0.0072 939 TYR 122 CE1 0.0027 -0.0053 -0.0039 940 TYR 122 CE2 0.0021 -0.0104 -0.0067 941 TYR 122 CZ 0.0016 -0.0091 -0.0051 942 TYR 122 OH 0.0000 -0.0116 -0.0048 943 LEU 123 N 0.0112 0.0163 -0.0027 944 LEU 123 CA 0.0118 0.0126 -0.0020 945 LEU 123 C 0.0116 0.0129 -0.0023 946 LEU 123 O 0.0124 0.0156 -0.0011 947 LEU 123 CB 0.0144 0.0112 0.0014 948 LEU 123 CG 0.0149 0.0108 0.0021 949 LEU 123 CD1 0.0176 0.0100 0.0056 950 LEU 123 CD2 0.0135 0.0075 0.0001 951 GLN 124 N -0.0156 0.0008 -0.0299 952 GLN 124 CA -0.0111 -0.0052 -0.0262 953 GLN 124 C -0.0164 -0.0062 -0.0273 954 GLN 124 O -0.0208 0.0001 -0.0310 955 GLN 124 CB -0.0004 -0.0015 -0.0246 956 GLN 124 CG 0.0052 -0.0019 -0.0229 957 GLN 124 CD 0.0154 0.0032 -0.0220 958 GLN 124 OE1 0.0169 0.0112 -0.0247 959 GLN 124 NE2 0.0226 -0.0015 -0.0181 960 GLY 125 N 0.0208 0.0109 0.0541 961 GLY 125 CA 0.0060 0.0208 0.0285 962 GLY 125 C 0.0099 0.0161 0.0353 963 GLY 125 O 0.0248 0.0083 0.0610 964 SER 126 N -0.0525 -0.0738 0.0141 965 SER 126 CA -0.0456 0.0106 0.0319 966 SER 126 C -0.0415 -0.0084 0.0059 967 SER 126 O -0.0267 0.0596 -0.0155 968 SER 126 CB -0.0180 0.0980 -0.0293 969 SER 126 OG 0.0054 0.0762 -0.1315 970 LYS 127 N 0.0356 -0.0189 -0.0697 971 LYS 127 CA -0.0059 -0.0201 -0.0050 972 LYS 127 C -0.0339 -0.0072 0.0009 973 LYS 127 O -0.0201 0.0033 -0.0483 974 LYS 127 CB -0.0626 0.0077 0.0024 975 LYS 127 CG -0.0416 -0.0004 -0.0064 976 LYS 127 CD -0.0198 -0.0357 0.0580 977 LYS 127 CE 0.0327 -0.0575 0.0402 978 LYS 127 NZ 0.0950 -0.0958 0.0534 979 LYS 127 OXT -0.0739 -0.0048 0.0532