1 MET 1 N -0.0025 -0.0030 -0.0103 2 MET 1 CA -0.0016 -0.0020 -0.0082 3 MET 1 C -0.0004 -0.0009 -0.0073 4 MET 1 O 0.0009 0.0004 -0.0085 5 MET 1 CB -0.0004 -0.0010 -0.0089 6 MET 1 CG 0.0000 -0.0004 -0.0067 7 MET 1 SD -0.0020 -0.0023 -0.0055 8 MET 1 CE -0.0008 -0.0010 -0.0037 9 MET 1 H1 -0.0035 -0.0039 -0.0096 10 MET 1 H2 -0.0017 -0.0023 -0.0115 11 MET 1 H3 -0.0030 -0.0035 -0.0114 12 ALA 2 N -0.0010 -0.0013 -0.0052 13 ALA 2 CA -0.0002 -0.0005 -0.0039 14 ALA 2 C 0.0007 0.0005 -0.0015 15 ALA 2 O -0.0001 -0.0002 0.0005 16 ALA 2 CB -0.0018 -0.0020 -0.0035 17 ALA 2 H -0.0021 -0.0024 -0.0043 18 ASP 3 N 0.0025 0.0023 -0.0017 19 ASP 3 CA 0.0036 0.0034 -0.0039 20 ASP 3 C 0.0044 0.0040 -0.0048 21 ASP 3 O 0.0039 0.0036 -0.0035 22 ASP 3 CB 0.0052 0.0050 -0.0033 23 ASP 3 CG 0.0054 0.0051 -0.0058 24 ASP 3 OD1 0.0046 0.0043 -0.0060 25 ASP 3 OD2 0.0064 0.0061 -0.0075 26 ASP 3 H 0.0032 0.0030 -0.0003 27 LYS 4 N 0.0052 0.0049 -0.0069 28 LYS 4 CA 0.0057 0.0054 -0.0084 29 LYS 4 C 0.0074 0.0071 -0.0076 30 LYS 4 O 0.0088 0.0086 -0.0078 31 LYS 4 CB 0.0059 0.0054 -0.0112 32 LYS 4 CG 0.0043 0.0037 -0.0128 33 LYS 4 CD 0.0046 0.0040 -0.0155 34 LYS 4 CE 0.0051 0.0044 -0.0163 35 LYS 4 NZ 0.0035 0.0028 -0.0160 36 LYS 4 H 0.0056 0.0053 -0.0076 37 LYS 4 HZ1 0.0035 0.0027 -0.0169 38 LYS 4 HZ2 0.0024 0.0017 -0.0166 39 LYS 4 HZ3 0.0033 0.0027 -0.0142 40 ALA 5 N 0.0069 0.0068 -0.0073 41 ALA 5 CA 0.0085 0.0085 -0.0057 42 ALA 5 C 0.0083 0.0084 -0.0066 43 ALA 5 O 0.0067 0.0065 -0.0065 44 ALA 5 CB 0.0084 0.0080 -0.0021 45 ALA 5 H 0.0055 0.0053 -0.0079 46 LYS 6 N 0.0099 0.0104 -0.0079 47 LYS 6 CA 0.0099 0.0104 -0.0089 48 LYS 6 C 0.0117 0.0124 -0.0070 49 LYS 6 O 0.0135 0.0145 -0.0074 50 LYS 6 CB 0.0101 0.0111 -0.0125 51 LYS 6 CG 0.0082 0.0090 -0.0145 52 LYS 6 CD 0.0084 0.0097 -0.0180 53 LYS 6 CE 0.0069 0.0081 -0.0206 54 LYS 6 NZ 0.0067 0.0082 -0.0238 55 LYS 6 H 0.0113 0.0120 -0.0081 56 LYS 6 HZ1 0.0058 0.0073 -0.0253 57 LYS 6 HZ2 0.0080 0.0098 -0.0246 58 LYS 6 HZ3 0.0059 0.0072 -0.0236 59 PRO 7 N 0.0112 0.0109 -0.0045 60 PRO 7 CA 0.0091 0.0089 -0.0037 61 PRO 7 C 0.0083 0.0080 -0.0014 62 PRO 7 O 0.0095 0.0090 0.0002 63 PRO 7 CB 0.0090 0.0088 -0.0029 64 PRO 7 CG 0.0111 0.0106 -0.0016 65 PRO 7 CD 0.0124 0.0120 -0.0034 66 ALA 8 N 0.0064 0.0063 -0.0016 67 ALA 8 CA 0.0054 0.0051 0.0007 68 ALA 8 C 0.0052 0.0048 0.0032 69 ALA 8 O 0.0041 0.0038 0.0031 70 ALA 8 CB 0.0033 0.0032 -0.0001 71 ALA 8 H 0.0057 0.0057 -0.0034 72 LYS 9 N 0.0062 0.0055 0.0050 73 LYS 9 CA 0.0062 0.0054 0.0074 74 LYS 9 C 0.0053 0.0045 0.0094 75 LYS 9 O 0.0058 0.0049 0.0094 76 LYS 9 CB 0.0082 0.0070 0.0084 77 LYS 9 CG 0.0088 0.0075 0.0070 78 LYS 9 CD 0.0076 0.0065 0.0075 79 LYS 9 CE 0.0081 0.0071 0.0057 80 LYS 9 NZ 0.0087 0.0074 0.0072 81 LYS 9 H 0.0069 0.0061 0.0051 82 LYS 9 HZ1 0.0077 0.0065 0.0084 83 LYS 9 HZ2 0.0089 0.0077 0.0060 84 LYS 9 HZ3 0.0099 0.0084 0.0082 85 ALA 10 N 0.0038 0.0031 0.0106 86 ALA 10 CA 0.0027 0.0023 0.0099 87 ALA 10 C 0.0006 0.0006 0.0086 88 ALA 10 O -0.0006 -0.0004 0.0095 89 ALA 10 CB 0.0025 0.0020 0.0122 90 ALA 10 H 0.0033 0.0026 0.0121 91 ALA 11 N 0.0001 0.0001 0.0068 92 ALA 11 CA -0.0014 -0.0008 0.0056 93 ALA 11 C -0.0025 -0.0019 0.0062 94 ALA 11 O -0.0024 -0.0018 0.0059 95 ALA 11 CB -0.0011 -0.0001 0.0036 96 ALA 11 H 0.0010 0.0010 0.0063 97 ASN 12 N -0.0035 -0.0030 0.0072 98 ASN 12 CA -0.0048 -0.0043 0.0079 99 ASN 12 C -0.0062 -0.0051 0.0064 100 ASN 12 O -0.0065 -0.0052 0.0057 101 ASN 12 CB -0.0051 -0.0050 0.0097 102 ASN 12 CG -0.0038 -0.0044 0.0114 103 ASN 12 ND2 -0.0042 -0.0051 0.0128 104 ASN 12 OD1 -0.0025 -0.0033 0.0113 105 ASN 12 H -0.0034 -0.0030 0.0074 106 ASN 12 HD21 -0.0052 -0.0059 0.0127 107 ASN 12 HD22 -0.0035 -0.0048 0.0141 108 ARG 13 N -0.0079 -0.0062 0.0073 109 ARG 13 CA -0.0081 -0.0064 0.0070 110 ARG 13 C -0.0083 -0.0066 0.0070 111 ARG 13 O -0.0084 -0.0067 0.0074 112 ARG 13 CB -0.0082 -0.0065 0.0069 113 ARG 13 CG -0.0083 -0.0066 0.0073 114 ARG 13 CD -0.0083 -0.0067 0.0072 115 ARG 13 NE -0.0081 -0.0064 0.0071 116 ARG 13 CZ -0.0081 -0.0064 0.0068 117 ARG 13 NH1 -0.0083 -0.0066 0.0066 118 ARG 13 NH2 -0.0079 -0.0061 0.0066 119 ARG 13 H -0.0078 -0.0061 0.0074 120 ARG 13 HE -0.0079 -0.0062 0.0073 121 ARG 13 HH11 -0.0085 -0.0068 0.0067 122 ARG 13 HH12 -0.0083 -0.0066 0.0063 123 ARG 13 HH21 -0.0077 -0.0060 0.0068 124 ARG 13 HH22 -0.0079 -0.0061 0.0064 125 THR 14 N -0.0084 -0.0067 0.0068 126 THR 14 CA -0.0086 -0.0070 0.0068 127 THR 14 C -0.0089 -0.0072 0.0066 128 THR 14 O -0.0089 -0.0072 0.0063 129 THR 14 CB -0.0086 -0.0069 0.0066 130 THR 14 CG2 -0.0084 -0.0067 0.0068 131 THR 14 OG1 -0.0086 -0.0069 0.0062 132 THR 14 H -0.0084 -0.0067 0.0065 133 THR 14 HG1 -0.0087 -0.0070 0.0060 134 PRO 15 N -0.0092 -0.0074 0.0073 135 PRO 15 CA -0.0091 -0.0073 0.0074 136 PRO 15 C -0.0091 -0.0073 0.0075 137 PRO 15 O -0.0092 -0.0073 0.0074 138 PRO 15 CB -0.0091 -0.0071 0.0073 139 PRO 15 CG -0.0092 -0.0071 0.0071 140 PRO 15 CD -0.0093 -0.0073 0.0072 141 PRO 16 N -0.0089 -0.0073 0.0077 142 PRO 16 CA -0.0088 -0.0074 0.0078 143 PRO 16 C -0.0088 -0.0072 0.0077 144 PRO 16 O -0.0087 -0.0070 0.0076 145 PRO 16 CB -0.0087 -0.0074 0.0079 146 PRO 16 CG -0.0087 -0.0074 0.0080 147 PRO 16 CD -0.0088 -0.0074 0.0078 148 LYS 17 N -0.0086 -0.0074 0.0085 149 LYS 17 CA -0.0088 -0.0068 0.0081 150 LYS 17 C -0.0091 -0.0064 0.0075 151 LYS 17 O -0.0091 -0.0057 0.0074 152 LYS 17 CB -0.0085 -0.0062 0.0084 153 LYS 17 CG -0.0082 -0.0066 0.0090 154 LYS 17 CD -0.0080 -0.0060 0.0092 155 LYS 17 CE -0.0077 -0.0064 0.0097 156 LYS 17 NZ -0.0075 -0.0068 0.0102 157 LYS 17 H -0.0086 -0.0079 0.0086 158 LYS 17 HZ1 -0.0076 -0.0073 0.0101 159 LYS 17 HZ2 -0.0074 -0.0065 0.0103 160 LYS 17 HZ3 -0.0072 -0.0068 0.0106 161 SER 18 N -0.0094 -0.0069 0.0072 162 SER 18 CA -0.0097 -0.0067 0.0066 163 SER 18 C -0.0101 -0.0072 0.0061 164 SER 18 O -0.0101 -0.0078 0.0062 165 SER 18 CB -0.0095 -0.0066 0.0069 166 SER 18 OG -0.0098 -0.0062 0.0064 167 SER 18 H -0.0095 -0.0074 0.0071 168 SER 18 HG -0.0096 -0.0056 0.0065 169 PRO 19 N -0.0115 -0.0065 0.0065 170 PRO 19 CA -0.0117 -0.0067 0.0061 171 PRO 19 C -0.0117 -0.0062 0.0066 172 PRO 19 O -0.0116 -0.0057 0.0072 173 PRO 19 CB -0.0125 -0.0069 0.0056 174 PRO 19 CG -0.0124 -0.0071 0.0054 175 PRO 19 CD -0.0121 -0.0066 0.0060 176 GLY 20 N -0.0117 -0.0065 0.0063 177 GLY 20 CA -0.0119 -0.0061 0.0067 178 GLY 20 C -0.0111 -0.0061 0.0070 179 GLY 20 O -0.0107 -0.0066 0.0067 180 GLY 20 H -0.0115 -0.0070 0.0059 181 ASP 21 N -0.0107 -0.0070 0.0093 182 ASP 21 CA -0.0100 -0.0068 0.0095 183 ASP 21 C -0.0096 -0.0069 0.0090 184 ASP 21 O -0.0099 -0.0070 0.0088 185 ASP 21 CB -0.0100 -0.0065 0.0102 186 ASP 21 CG -0.0093 -0.0063 0.0105 187 ASP 21 OD1 -0.0092 -0.0061 0.0108 188 ASP 21 OD2 -0.0089 -0.0062 0.0103 189 ASP 21 H -0.0110 -0.0071 0.0093 190 PRO 22 N -0.0090 -0.0068 0.0087 191 PRO 22 CA -0.0087 -0.0066 0.0089 192 PRO 22 C -0.0086 -0.0068 0.0084 193 PRO 22 O -0.0084 -0.0070 0.0079 194 PRO 22 CB -0.0079 -0.0064 0.0091 195 PRO 22 CG -0.0079 -0.0065 0.0088 196 PRO 22 CD -0.0085 -0.0068 0.0085 197 SER 23 N -0.0090 -0.0061 0.0112 198 SER 23 CA -0.0088 -0.0061 0.0105 199 SER 23 C -0.0075 -0.0053 0.0112 200 SER 23 O -0.0076 -0.0051 0.0123 201 SER 23 CB -0.0101 -0.0067 0.0110 202 SER 23 OG -0.0115 -0.0075 0.0103 203 SER 23 H -0.0098 -0.0063 0.0121 204 SER 23 HG -0.0118 -0.0076 0.0107 205 LYS 24 N -0.0062 -0.0047 0.0103 206 LYS 24 CA -0.0048 -0.0039 0.0108 207 LYS 24 C -0.0043 -0.0038 0.0097 208 LYS 24 O -0.0038 -0.0038 0.0083 209 LYS 24 CB -0.0038 -0.0034 0.0108 210 LYS 24 CG -0.0021 -0.0024 0.0111 211 LYS 24 CD -0.0013 -0.0019 0.0114 212 LYS 24 CE -0.0022 -0.0021 0.0128 213 LYS 24 NZ -0.0015 -0.0017 0.0131 214 LYS 24 H -0.0062 -0.0049 0.0092 215 LYS 24 HZ1 -0.0015 -0.0019 0.0121 216 LYS 24 HZ2 -0.0004 -0.0012 0.0133 217 LYS 24 HZ3 -0.0020 -0.0019 0.0140 218 ASP 25 N -0.0047 -0.0033 0.0135 219 ASP 25 CA -0.0036 -0.0024 0.0126 220 ASP 25 C -0.0015 -0.0006 0.0119 221 ASP 25 O -0.0011 -0.0001 0.0096 222 ASP 25 CB -0.0039 -0.0027 0.0149 223 ASP 25 CG -0.0029 -0.0019 0.0145 224 ASP 25 OD1 -0.0013 -0.0006 0.0157 225 ASP 25 OD2 -0.0038 -0.0026 0.0134 226 ASP 25 H -0.0050 -0.0037 0.0154 227 ARG 26 N -0.0000 0.0006 0.0136 228 ARG 26 CA 0.0020 0.0023 0.0129 229 ARG 26 C 0.0023 0.0026 0.0133 230 ARG 26 O 0.0024 0.0026 0.0154 231 ARG 26 CB 0.0036 0.0036 0.0145 232 ARG 26 CG 0.0054 0.0052 0.0131 233 ARG 26 CD 0.0072 0.0066 0.0149 234 ARG 26 NE 0.0072 0.0066 0.0154 235 ARG 26 CZ 0.0070 0.0064 0.0176 236 ARG 26 NH1 0.0066 0.0060 0.0196 237 ARG 26 NH2 0.0066 0.0060 0.0178 238 ARG 26 H -0.0004 0.0002 0.0154 239 ARG 26 HE 0.0074 0.0068 0.0137 240 ARG 26 HH11 0.0063 0.0057 0.0196 241 ARG 26 HH12 0.0062 0.0055 0.0211 242 ARG 26 HH21 0.0067 0.0062 0.0163 243 ARG 26 HH22 0.0063 0.0057 0.0195 244 ALA 27 N 0.0028 0.0027 0.0114 245 ALA 27 CA 0.0037 0.0035 0.0108 246 ALA 27 C 0.0055 0.0051 0.0092 247 ALA 27 O 0.0056 0.0052 0.0076 248 ALA 27 CB 0.0023 0.0024 0.0094 249 ALA 27 H 0.0025 0.0024 0.0098 250 ALA 28 N 0.0069 0.0062 0.0096 251 ALA 28 CA 0.0088 0.0079 0.0085 252 ALA 28 C 0.0089 0.0081 0.0057 253 ALA 28 O 0.0085 0.0078 0.0049 254 ALA 28 CB 0.0102 0.0091 0.0099 255 ALA 28 H 0.0066 0.0060 0.0105 256 LYS 29 N 0.0093 0.0090 0.0043 257 LYS 29 CA 0.0101 0.0097 0.0051 258 LYS 29 C 0.0087 0.0084 0.0043 259 LYS 29 O 0.0084 0.0080 0.0019 260 LYS 29 CB 0.0121 0.0116 0.0039 261 LYS 29 CG 0.0132 0.0126 0.0047 262 LYS 29 CD 0.0152 0.0146 0.0038 263 LYS 29 CE 0.0165 0.0158 0.0056 264 LYS 29 NZ 0.0185 0.0177 0.0044 265 LYS 29 H 0.0095 0.0091 0.0023 266 LYS 29 HZ1 0.0184 0.0176 0.0025 267 LYS 29 HZ2 0.0192 0.0184 0.0054 268 LYS 29 HZ3 0.0190 0.0182 0.0046 269 ARG 30 N 0.0080 0.0078 0.0062 270 ARG 30 CA 0.0066 0.0064 0.0058 271 ARG 30 C 0.0047 0.0046 0.0041 272 ARG 30 O 0.0041 0.0040 0.0023 273 ARG 30 CB 0.0075 0.0072 0.0048 274 ARG 30 CG 0.0089 0.0086 0.0067 275 ARG 30 CD 0.0098 0.0095 0.0057 276 ARG 30 NE 0.0111 0.0107 0.0077 277 ARG 30 CZ 0.0105 0.0101 0.0094 278 ARG 30 NH1 0.0086 0.0083 0.0095 279 ARG 30 NH2 0.0118 0.0114 0.0108 280 ARG 30 H 0.0086 0.0083 0.0081 281 ARG 30 HE 0.0123 0.0119 0.0081 282 ARG 30 HH11 0.0076 0.0074 0.0085 283 ARG 30 HH12 0.0081 0.0079 0.0104 284 ARG 30 HH21 0.0132 0.0128 0.0110 285 ARG 30 HH22 0.0115 0.0112 0.0115 286 LEU 31 N 0.0038 0.0036 0.0047 287 LEU 31 CA 0.0024 0.0022 0.0033 288 LEU 31 C 0.0008 0.0008 0.0048 289 LEU 31 O 0.0008 0.0008 0.0064 290 LEU 31 CB 0.0033 0.0030 0.0022 291 LEU 31 CG 0.0021 0.0018 0.0004 292 LEU 31 CD1 0.0030 0.0027 -0.0019 293 LEU 31 CD2 0.0013 0.0011 0.0018 294 LEU 31 H 0.0044 0.0043 0.0058 295 SER 32 N -0.0006 -0.0006 0.0041 296 SER 32 CA -0.0023 -0.0022 0.0052 297 SER 32 C -0.0035 -0.0034 0.0040 298 SER 32 O -0.0037 -0.0037 0.0018 299 SER 32 CB -0.0032 -0.0031 0.0053 300 SER 32 OG -0.0022 -0.0021 0.0069 301 SER 32 H -0.0005 -0.0006 0.0028 302 SER 32 HG -0.0017 -0.0016 0.0082 303 LEU 33 N -0.0045 -0.0040 0.0062 304 LEU 33 CA -0.0049 -0.0046 0.0056 305 LEU 33 C -0.0063 -0.0059 0.0061 306 LEU 33 O -0.0070 -0.0059 0.0075 307 LEU 33 CB -0.0042 -0.0035 0.0063 308 LEU 33 CG -0.0042 -0.0040 0.0056 309 LEU 33 CD1 -0.0029 -0.0029 0.0047 310 LEU 33 CD2 -0.0049 -0.0040 0.0069 311 LEU 33 H -0.0043 -0.0032 0.0072 312 GLU 34 N -0.0067 -0.0069 0.0047 313 GLU 34 CA -0.0080 -0.0084 0.0047 314 GLU 34 C -0.0085 -0.0089 0.0048 315 GLU 34 O -0.0077 -0.0084 0.0041 316 GLU 34 CB -0.0083 -0.0094 0.0033 317 GLU 34 CG -0.0088 -0.0097 0.0036 318 GLU 34 CD -0.0091 -0.0108 0.0021 319 GLU 34 OE1 -0.0082 -0.0105 0.0008 320 GLU 34 OE2 -0.0102 -0.0120 0.0022 321 GLU 34 H -0.0060 -0.0068 0.0037 322 SER 35 N -0.0104 -0.0091 0.0064 323 SER 35 CA -0.0103 -0.0086 0.0066 324 SER 35 C -0.0103 -0.0087 0.0066 325 SER 35 O -0.0106 -0.0089 0.0063 326 SER 35 CB -0.0106 -0.0081 0.0066 327 SER 35 OG -0.0112 -0.0080 0.0063 328 SER 35 H -0.0108 -0.0091 0.0061 329 SER 35 HG -0.0113 -0.0084 0.0061 330 GLU 36 N -0.0100 -0.0084 0.0069 331 GLU 36 CA -0.0099 -0.0085 0.0070 332 GLU 36 C -0.0102 -0.0083 0.0068 333 GLU 36 O -0.0103 -0.0078 0.0070 334 GLU 36 CB -0.0094 -0.0084 0.0074 335 GLU 36 CG -0.0091 -0.0088 0.0074 336 GLU 36 CD -0.0087 -0.0087 0.0078 337 GLU 36 OE1 -0.0087 -0.0087 0.0078 338 GLU 36 OE2 -0.0083 -0.0088 0.0080 339 GLU 36 H -0.0099 -0.0081 0.0071 340 GLY 37 N -0.0100 -0.0099 0.0069 341 GLY 37 CA -0.0099 -0.0095 0.0067 342 GLY 37 C -0.0090 -0.0106 0.0080 343 GLY 37 O -0.0073 -0.0100 0.0086 344 GLY 37 H -0.0103 -0.0112 0.0076 345 ALA 38 N -0.0100 -0.0124 0.0085 346 ALA 38 CA -0.0092 -0.0133 0.0096 347 ALA 38 C -0.0084 -0.0149 0.0111 348 ALA 38 O -0.0093 -0.0162 0.0114 349 ALA 38 CB -0.0107 -0.0140 0.0091 350 ALA 38 H -0.0110 -0.0132 0.0084 351 GLY 39 N -0.0085 -0.0142 0.0134 352 GLY 39 CA -0.0088 -0.0147 0.0155 353 GLY 39 C -0.0080 -0.0130 0.0169 354 GLY 39 O -0.0076 -0.0121 0.0161 355 GLY 39 H -0.0081 -0.0131 0.0133 356 GLU 40 N -0.0079 -0.0128 0.0191 357 GLU 40 CA -0.0071 -0.0110 0.0204 358 GLU 40 C -0.0065 -0.0097 0.0208 359 GLU 40 O -0.0058 -0.0081 0.0197 360 GLU 40 CB -0.0073 -0.0117 0.0224 361 GLU 40 CG -0.0067 -0.0101 0.0234 362 GLU 40 CD -0.0070 -0.0110 0.0254 363 GLU 40 OE1 -0.0075 -0.0120 0.0269 364 GLU 40 OE2 -0.0068 -0.0106 0.0253 365 GLU 40 H -0.0084 -0.0139 0.0200 366 GLY 41 N -0.0069 -0.0099 0.0217 367 GLY 41 CA -0.0060 -0.0084 0.0225 368 GLY 41 C -0.0050 -0.0069 0.0235 369 GLY 41 O -0.0051 -0.0074 0.0243 370 GLY 41 H -0.0072 -0.0110 0.0228 371 ALA 42 N -0.0044 -0.0052 0.0228 372 ALA 42 CA -0.0034 -0.0034 0.0230 373 ALA 42 C -0.0036 -0.0027 0.0208 374 ALA 42 O -0.0037 -0.0022 0.0192 375 ALA 42 CB -0.0025 -0.0018 0.0239 376 ALA 42 H -0.0045 -0.0050 0.0218 377 ALA 43 N -0.0059 -0.0018 0.0192 378 ALA 43 CA -0.0053 -0.0012 0.0175 379 ALA 43 C -0.0043 0.0007 0.0177 380 ALA 43 O -0.0041 0.0017 0.0189 381 ALA 43 CB -0.0055 -0.0017 0.0172 382 ALA 43 H -0.0059 -0.0015 0.0203 383 ALA 44 N -0.0038 0.0013 0.0163 384 ALA 44 CA -0.0028 0.0032 0.0160 385 ALA 44 C -0.0023 0.0035 0.0140 386 ALA 44 O -0.0024 0.0030 0.0131 387 ALA 44 CB -0.0026 0.0039 0.0169 388 ALA 44 H -0.0040 0.0007 0.0158 389 SER 45 N -0.0042 0.0029 0.0114 390 SER 45 CA -0.0033 0.0028 0.0107 391 SER 45 C -0.0018 0.0030 0.0111 392 SER 45 O -0.0014 0.0034 0.0123 393 SER 45 CB -0.0037 0.0029 0.0111 394 SER 45 OG -0.0026 0.0029 0.0108 395 SER 45 H -0.0044 0.0032 0.0124 396 SER 45 HG -0.0027 0.0031 0.0115 397 PRO 46 N -0.0008 0.0029 0.0101 398 PRO 46 CA 0.0007 0.0030 0.0103 399 PRO 46 C 0.0015 0.0032 0.0106 400 PRO 46 O 0.0011 0.0030 0.0101 401 PRO 46 CB 0.0011 0.0027 0.0090 402 PRO 46 CG 0.0002 0.0024 0.0079 403 PRO 46 CD -0.0012 0.0024 0.0086 404 GLU 47 N 0.0003 0.0057 0.0084 405 GLU 47 CA 0.0024 0.0058 0.0100 406 GLU 47 C 0.0035 0.0038 0.0100 407 GLU 47 O 0.0032 0.0036 0.0097 408 GLU 47 CB 0.0026 0.0079 0.0112 409 GLU 47 CG 0.0019 0.0098 0.0115 410 GLU 47 CD 0.0022 0.0121 0.0127 411 GLU 47 OE1 0.0038 0.0120 0.0140 412 GLU 47 OE2 0.0009 0.0138 0.0125 413 GLU 47 H -0.0002 0.0049 0.0077 414 LEU 48 N 0.0045 0.0021 0.0100 415 LEU 48 CA 0.0052 -0.0002 0.0095 416 LEU 48 C 0.0074 -0.0011 0.0108 417 LEU 48 O 0.0085 0.0002 0.0122 418 LEU 48 CB 0.0041 -0.0018 0.0079 419 LEU 48 CG 0.0020 -0.0016 0.0064 420 LEU 48 CD1 0.0010 -0.0028 0.0051 421 LEU 48 CD2 0.0020 -0.0023 0.0060 422 LEU 48 H 0.0050 0.0024 0.0105 423 SER 49 N 0.0094 -0.0055 0.0116 424 SER 49 CA 0.0101 -0.0060 0.0127 425 SER 49 C 0.0091 -0.0052 0.0114 426 SER 49 O 0.0085 -0.0048 0.0093 427 SER 49 CB 0.0122 -0.0079 0.0125 428 SER 49 OG 0.0128 -0.0086 0.0103 429 SER 49 H 0.0096 -0.0058 0.0098 430 SER 49 HG 0.0122 -0.0083 0.0090 431 ALA 50 N 0.0086 -0.0046 0.0130 432 ALA 50 CA 0.0077 -0.0038 0.0125 433 ALA 50 C 0.0071 -0.0035 0.0098 434 ALA 50 O 0.0055 -0.0021 0.0091 435 ALA 50 CB 0.0087 -0.0046 0.0135 436 ALA 50 H 0.0084 -0.0043 0.0146 437 LEU 51 N 0.0090 -0.0037 0.0085 438 LEU 51 CA 0.0088 -0.0036 0.0063 439 LEU 51 C 0.0082 -0.0032 0.0049 440 LEU 51 O 0.0070 -0.0023 0.0038 441 LEU 51 CB 0.0104 -0.0047 0.0051 442 LEU 51 CG 0.0109 -0.0050 0.0054 443 LEU 51 CD1 0.0125 -0.0062 0.0042 444 LEU 51 CD2 0.0095 -0.0041 0.0046 445 LEU 51 H 0.0100 -0.0044 0.0093 446 GLU 52 N 0.0090 -0.0038 0.0053 447 GLU 52 CA 0.0083 -0.0033 0.0042 448 GLU 52 C 0.0067 -0.0021 0.0053 449 GLU 52 O 0.0055 -0.0013 0.0041 450 GLU 52 CB 0.0098 -0.0043 0.0037 451 GLU 52 CG 0.0105 -0.0047 0.0055 452 GLU 52 CD 0.0119 -0.0057 0.0067 453 GLU 52 OE1 0.0128 -0.0064 0.0060 454 GLU 52 OE2 0.0123 -0.0060 0.0084 455 GLU 52 H 0.0100 -0.0044 0.0062 456 GLU 53 N 0.0053 -0.0018 0.0068 457 GLU 53 CA 0.0040 -0.0007 0.0077 458 GLU 53 C 0.0028 0.0001 0.0070 459 GLU 53 O 0.0016 0.0009 0.0065 460 GLU 53 CB 0.0042 -0.0006 0.0096 461 GLU 53 CG 0.0031 0.0003 0.0104 462 GLU 53 CD 0.0031 0.0005 0.0123 463 GLU 53 OE1 0.0023 0.0011 0.0128 464 GLU 53 OE2 0.0038 0.0001 0.0134 465 GLU 53 H 0.0061 -0.0023 0.0076 466 ALA 54 N 0.0030 -0.0001 0.0065 467 ALA 54 CA 0.0019 0.0006 0.0059 468 ALA 54 C 0.0017 0.0006 0.0039 469 ALA 54 O 0.0005 0.0014 0.0034 470 ALA 54 CB 0.0023 0.0004 0.0062 471 ALA 54 H 0.0039 -0.0007 0.0070 472 PHE 55 N 0.0037 0.0012 0.0030 473 PHE 55 CA 0.0038 0.0014 0.0010 474 PHE 55 C 0.0032 0.0016 0.0011 475 PHE 55 O 0.0019 0.0023 0.0001 476 PHE 55 CB 0.0058 0.0007 -0.0000 477 PHE 55 CG 0.0056 0.0010 -0.0015 478 PHE 55 CD1 0.0061 0.0007 -0.0009 479 PHE 55 CD2 0.0049 0.0015 -0.0034 480 PHE 55 CE1 0.0060 0.0009 -0.0022 481 PHE 55 CE2 0.0046 0.0018 -0.0046 482 PHE 55 CZ 0.0052 0.0015 -0.0041 483 PHE 55 H 0.0049 0.0007 0.0032 484 PHE 55 HD1 0.0067 0.0002 0.0006 485 PHE 55 HD2 0.0051 0.0015 -0.0039 486 PHE 55 HE1 0.0065 0.0006 -0.0016 487 PHE 55 HE2 0.0037 0.0023 -0.0059 488 PHE 55 HZ 0.0052 0.0016 -0.0052 489 ARG 56 N 0.0040 0.0011 0.0025 490 ARG 56 CA 0.0037 0.0012 0.0029 491 ARG 56 C 0.0016 0.0020 0.0037 492 ARG 56 O 0.0011 0.0022 0.0038 493 ARG 56 CB 0.0051 0.0004 0.0046 494 ARG 56 CG 0.0071 -0.0003 0.0037 495 ARG 56 CD 0.0072 -0.0002 0.0027 496 ARG 56 NE 0.0091 -0.0009 0.0017 497 ARG 56 CZ 0.0097 -0.0009 0.0003 498 ARG 56 NH1 0.0085 -0.0003 -0.0006 499 ARG 56 NH2 0.0115 -0.0017 0.0000 500 ARG 56 H 0.0050 0.0006 0.0033 501 ARG 56 HE 0.0100 -0.0013 0.0020 502 ARG 56 HH11 0.0071 0.0002 -0.0002 503 ARG 56 HH12 0.0089 -0.0004 -0.0016 504 ARG 56 HH21 0.0126 -0.0022 0.0008 505 ARG 56 HH22 0.0119 -0.0017 -0.0010 506 ARG 57 N -0.0005 0.0028 0.0044 507 ARG 57 CA -0.0018 0.0029 0.0046 508 ARG 57 C -0.0027 0.0034 0.0037 509 ARG 57 O -0.0029 0.0036 0.0031 510 ARG 57 CB -0.0023 0.0026 0.0058 511 ARG 57 CG -0.0018 0.0022 0.0069 512 ARG 57 CD -0.0026 0.0020 0.0077 513 ARG 57 NE -0.0021 0.0016 0.0088 514 ARG 57 CZ -0.0021 0.0013 0.0097 515 ARG 57 NH1 -0.0029 0.0014 0.0097 516 ARG 57 NH2 -0.0013 0.0009 0.0106 517 ARG 57 H -0.0003 0.0027 0.0048 518 ARG 57 HE -0.0018 0.0015 0.0090 519 ARG 57 HH11 -0.0034 0.0017 0.0090 520 ARG 57 HH12 -0.0029 0.0012 0.0104 521 ARG 57 HH21 -0.0007 0.0008 0.0104 522 ARG 57 HH22 -0.0012 0.0006 0.0112 523 PHE 58 N -0.0028 0.0035 0.0033 524 PHE 58 CA -0.0038 0.0039 0.0026 525 PHE 58 C -0.0037 0.0043 0.0013 526 PHE 58 O -0.0047 0.0046 0.0008 527 PHE 58 CB -0.0039 0.0039 0.0027 528 PHE 58 CG -0.0053 0.0040 0.0029 529 PHE 58 CD1 -0.0060 0.0044 0.0020 530 PHE 58 CD2 -0.0058 0.0037 0.0040 531 PHE 58 CE1 -0.0072 0.0045 0.0022 532 PHE 58 CE2 -0.0071 0.0039 0.0042 533 PHE 58 CZ -0.0077 0.0042 0.0033 534 PHE 58 H -0.0022 0.0034 0.0033 535 PHE 58 HD1 -0.0056 0.0047 0.0011 536 PHE 58 HD2 -0.0053 0.0034 0.0046 537 PHE 58 HE1 -0.0078 0.0048 0.0016 538 PHE 58 HE2 -0.0075 0.0036 0.0050 539 PHE 58 HZ -0.0087 0.0043 0.0034 540 ALA 59 N -0.0016 0.0037 -0.0000 541 ALA 59 CA -0.0011 0.0046 -0.0018 542 ALA 59 C -0.0009 0.0046 -0.0018 543 ALA 59 O -0.0013 0.0052 -0.0031 544 ALA 59 CB 0.0008 0.0049 -0.0025 545 ALA 59 H -0.0006 0.0035 0.0004 546 VAL 60 N 0.0000 0.0039 -0.0005 547 VAL 60 CA 0.0003 0.0037 -0.0000 548 VAL 60 C -0.0017 0.0035 0.0005 549 VAL 60 O -0.0019 0.0037 0.0002 550 VAL 60 CB 0.0018 0.0029 0.0014 551 VAL 60 CG1 0.0025 0.0027 0.0017 552 VAL 60 CG2 0.0035 0.0030 0.0011 553 VAL 60 H 0.0009 0.0035 0.0003 554 HIS 61 N -0.0025 0.0034 0.0034 555 HIS 61 CA -0.0041 0.0028 0.0039 556 HIS 61 C -0.0056 0.0029 0.0030 557 HIS 61 O -0.0056 0.0032 0.0025 558 HIS 61 CB -0.0043 0.0019 0.0054 559 HIS 61 CG -0.0031 0.0016 0.0064 560 HIS 61 CD2 -0.0017 0.0015 0.0071 561 HIS 61 ND1 -0.0034 0.0011 0.0071 562 HIS 61 CE1 -0.0022 0.0008 0.0082 563 HIS 61 NE2 -0.0013 0.0010 0.0082 564 HIS 61 H -0.0023 0.0032 0.0038 565 HIS 61 HD2 -0.0012 0.0017 0.0070 566 HIS 61 HE1 -0.0020 0.0006 0.0087 567 HIS 61 HE2 -0.0003 0.0009 0.0089 568 GLY 62 N -0.0066 0.0030 0.0024 569 GLY 62 CA -0.0083 0.0029 0.0019 570 GLY 62 C -0.0089 0.0035 0.0006 571 GLY 62 O -0.0085 0.0036 0.0006 572 GLY 62 H -0.0063 0.0030 0.0025 573 ASP 63 N -0.0109 0.0070 -0.0016 574 ASP 63 CA -0.0117 0.0083 -0.0033 575 ASP 63 C -0.0102 0.0088 -0.0049 576 ASP 63 O -0.0108 0.0096 -0.0060 577 ASP 63 CB -0.0127 0.0087 -0.0034 578 ASP 63 CG -0.0147 0.0088 -0.0023 579 ASP 63 OD1 -0.0147 0.0078 -0.0008 580 ASP 63 OD2 -0.0161 0.0097 -0.0030 581 ASP 63 H -0.0111 0.0067 -0.0010 582 ALA 64 N -0.0088 0.0086 -0.0054 583 ALA 64 CA -0.0070 0.0087 -0.0067 584 ALA 64 C -0.0052 0.0077 -0.0060 585 ALA 64 O -0.0049 0.0067 -0.0046 586 ALA 64 CB -0.0068 0.0094 -0.0078 587 ALA 64 H -0.0090 0.0083 -0.0048 588 ARG 65 N -0.0051 0.0070 -0.0075 589 ARG 65 CA -0.0028 0.0062 -0.0060 590 ARG 65 C -0.0003 0.0067 -0.0074 591 ARG 65 O 0.0000 0.0076 -0.0095 592 ARG 65 CB -0.0025 0.0057 -0.0049 593 ARG 65 CG -0.0045 0.0050 -0.0030 594 ARG 65 CD -0.0037 0.0044 -0.0018 595 ARG 65 NE -0.0035 0.0033 0.0007 596 ARG 65 CZ -0.0016 0.0026 0.0022 597 ARG 65 NH1 0.0004 0.0029 0.0012 598 ARG 65 NH2 -0.0018 0.0016 0.0043 599 ARG 65 H -0.0055 0.0076 -0.0086 600 ARG 65 HE -0.0051 0.0031 0.0015 601 ARG 65 HH11 0.0004 0.0037 -0.0006 602 ARG 65 HH12 0.0017 0.0024 0.0020 603 ARG 65 HH21 -0.0034 0.0015 0.0049 604 ARG 65 HH22 -0.0001 0.0011 0.0053 605 ALA 66 N 0.0013 0.0061 -0.0063 606 ALA 66 CA 0.0040 0.0062 -0.0069 607 ALA 66 C 0.0059 0.0059 -0.0064 608 ALA 66 O 0.0054 0.0053 -0.0051 609 ALA 66 CB 0.0048 0.0056 -0.0058 610 ALA 66 H 0.0006 0.0055 -0.0048 611 THR 67 N 0.0066 0.0044 -0.0092 612 THR 67 CA 0.0083 0.0039 -0.0096 613 THR 67 C 0.0094 0.0028 -0.0089 614 THR 67 O 0.0106 0.0020 -0.0085 615 THR 67 CB 0.0092 0.0047 -0.0112 616 THR 67 CG2 0.0085 0.0055 -0.0118 617 THR 67 OG1 0.0093 0.0053 -0.0121 618 THR 67 H 0.0064 0.0047 -0.0096 619 THR 67 HG1 0.0097 0.0058 -0.0130 620 GLY 68 N 0.0093 0.0031 -0.0091 621 GLY 68 CA 0.0103 0.0022 -0.0086 622 GLY 68 C 0.0090 0.0020 -0.0075 623 GLY 68 O 0.0077 0.0021 -0.0068 624 GLY 68 H 0.0085 0.0037 -0.0095 625 ARG 69 N 0.0110 0.0016 -0.0088 626 ARG 69 CA 0.0100 0.0016 -0.0079 627 ARG 69 C 0.0088 0.0026 -0.0090 628 ARG 69 O 0.0094 0.0027 -0.0097 629 ARG 69 CB 0.0111 0.0006 -0.0068 630 ARG 69 CG 0.0114 -0.0004 -0.0049 631 ARG 69 CD 0.0123 -0.0014 -0.0037 632 ARG 69 NE 0.0141 -0.0017 -0.0048 633 ARG 69 CZ 0.0157 -0.0027 -0.0040 634 ARG 69 NH1 0.0157 -0.0035 -0.0023 635 ARG 69 NH2 0.0170 -0.0028 -0.0049 636 ARG 69 H 0.0124 0.0011 -0.0091 637 ARG 69 HE 0.0139 -0.0010 -0.0059 638 ARG 69 HH11 0.0145 -0.0034 -0.0016 639 ARG 69 HH12 0.0168 -0.0043 -0.0017 640 ARG 69 HH21 0.0169 -0.0022 -0.0060 641 ARG 69 HH22 0.0182 -0.0036 -0.0044 642 GLU 70 N 0.0070 0.0035 -0.0092 643 GLU 70 CA 0.0058 0.0044 -0.0101 644 GLU 70 C 0.0037 0.0048 -0.0090 645 GLU 70 O 0.0029 0.0050 -0.0088 646 GLU 70 CB 0.0060 0.0053 -0.0122 647 GLU 70 CG 0.0056 0.0057 -0.0125 648 GLU 70 CD 0.0071 0.0049 -0.0122 649 GLU 70 OE1 0.0067 0.0051 -0.0123 650 GLU 70 OE2 0.0087 0.0042 -0.0123 651 GLU 70 H 0.0068 0.0036 -0.0092 652 MET 71 N 0.0027 0.0056 -0.0090 653 MET 71 CA 0.0005 0.0059 -0.0079 654 MET 71 C -0.0011 0.0072 -0.0096 655 MET 71 O -0.0011 0.0076 -0.0107 656 MET 71 CB 0.0001 0.0053 -0.0061 657 MET 71 CG -0.0022 0.0056 -0.0050 658 MET 71 SD -0.0028 0.0051 -0.0032 659 MET 71 CE -0.0011 0.0038 -0.0013 660 MET 71 H 0.0032 0.0059 -0.0100 661 HIS 72 N -0.0025 0.0077 -0.0097 662 HIS 72 CA -0.0044 0.0088 -0.0110 663 HIS 72 C -0.0063 0.0091 -0.0100 664 HIS 72 O -0.0071 0.0086 -0.0082 665 HIS 72 CB -0.0053 0.0094 -0.0116 666 HIS 72 CG -0.0037 0.0093 -0.0128 667 HIS 72 CD2 -0.0033 0.0101 -0.0148 668 HIS 72 ND1 -0.0026 0.0086 -0.0118 669 HIS 72 CE1 -0.0015 0.0087 -0.0130 670 HIS 72 NE2 -0.0020 0.0097 -0.0149 671 HIS 72 H -0.0023 0.0075 -0.0093 672 HIS 72 HD1 -0.0026 0.0079 -0.0103 673 HIS 72 HD2 -0.0041 0.0108 -0.0161 674 HIS 72 HE1 -0.0007 0.0082 -0.0124 675 GLY 73 N -0.0075 0.0115 -0.0104 676 GLY 73 CA -0.0094 0.0118 -0.0102 677 GLY 73 C -0.0110 0.0115 -0.0087 678 GLY 73 O -0.0115 0.0111 -0.0075 679 GLY 73 H -0.0070 0.0120 -0.0117 680 LYS 74 N -0.0113 0.0116 -0.0087 681 LYS 74 CA -0.0127 0.0113 -0.0073 682 LYS 74 C -0.0123 0.0103 -0.0054 683 LYS 74 O -0.0136 0.0100 -0.0043 684 LYS 74 CB -0.0129 0.0116 -0.0079 685 LYS 74 CG -0.0150 0.0123 -0.0084 686 LYS 74 CD -0.0165 0.0119 -0.0067 687 LYS 74 CE -0.0185 0.0126 -0.0072 688 LYS 74 NZ -0.0185 0.0128 -0.0077 689 LYS 74 H -0.0108 0.0119 -0.0097 690 LYS 74 HZ1 -0.0199 0.0132 -0.0079 691 LYS 74 HZ2 -0.0178 0.0132 -0.0089 692 LYS 74 HZ3 -0.0179 0.0122 -0.0068 693 ASN 75 N -0.0105 0.0093 -0.0050 694 ASN 75 CA -0.0093 0.0079 -0.0029 695 ASN 75 C -0.0089 0.0074 -0.0020 696 ASN 75 O -0.0097 0.0067 0.0001 697 ASN 75 CB -0.0070 0.0073 -0.0032 698 ASN 75 CG -0.0072 0.0077 -0.0040 699 ASN 75 ND2 -0.0060 0.0069 -0.0031 700 ASN 75 OD1 -0.0085 0.0087 -0.0052 701 ASN 75 H -0.0095 0.0095 -0.0061 702 ASN 75 HD21 -0.0050 0.0060 -0.0018 703 ASN 75 HD22 -0.0060 0.0073 -0.0039 704 TRP 76 N -0.0078 0.0077 -0.0035 705 TRP 76 CA -0.0078 0.0075 -0.0031 706 TRP 76 C -0.0101 0.0078 -0.0020 707 TRP 76 O -0.0101 0.0070 -0.0003 708 TRP 76 CB -0.0066 0.0081 -0.0051 709 TRP 76 CG -0.0066 0.0080 -0.0051 710 TRP 76 CD1 -0.0081 0.0090 -0.0061 711 TRP 76 CD2 -0.0055 0.0069 -0.0035 712 TRP 76 CE2 -0.0066 0.0074 -0.0038 713 TRP 76 CE3 -0.0036 0.0057 -0.0023 714 TRP 76 NE1 -0.0081 0.0086 -0.0053 715 TRP 76 CZ2 -0.0057 0.0067 -0.0028 716 TRP 76 CZ3 -0.0030 0.0050 -0.0011 717 TRP 76 CH2 -0.0040 0.0054 -0.0014 718 TRP 76 H -0.0073 0.0083 -0.0052 719 TRP 76 HD1 -0.0092 0.0100 -0.0073 720 TRP 76 HE1 -0.0088 0.0092 -0.0059 721 TRP 76 HE3 -0.0022 0.0055 -0.0027 722 TRP 76 HZ2 -0.0065 0.0071 -0.0031 723 TRP 76 HZ3 -0.0015 0.0040 -0.0001 724 TRP 76 HH2 -0.0033 0.0049 -0.0006 725 SER 77 N -0.0118 0.0103 -0.0033 726 SER 77 CA -0.0139 0.0103 -0.0028 727 SER 77 C -0.0145 0.0094 -0.0007 728 SER 77 O -0.0148 0.0090 0.0002 729 SER 77 CB -0.0156 0.0112 -0.0041 730 SER 77 OG -0.0175 0.0114 -0.0041 731 SER 77 H -0.0116 0.0108 -0.0045 732 SER 77 HG -0.0174 0.0118 -0.0050 733 LYS 78 N -0.0144 0.0091 -0.0001 734 LYS 78 CA -0.0151 0.0082 0.0018 735 LYS 78 C -0.0138 0.0073 0.0034 736 LYS 78 O -0.0148 0.0067 0.0048 737 LYS 78 CB -0.0152 0.0082 0.0020 738 LYS 78 CG -0.0173 0.0088 0.0012 739 LYS 78 CD -0.0175 0.0088 0.0012 740 LYS 78 CE -0.0192 0.0097 -0.0000 741 LYS 78 NZ -0.0198 0.0097 -0.0000 742 LYS 78 H -0.0138 0.0094 -0.0009 743 LYS 78 HZ1 -0.0199 0.0092 0.0012 744 LYS 78 HZ2 -0.0210 0.0103 -0.0009 745 LYS 78 HZ3 -0.0186 0.0099 -0.0007 746 LEU 79 N -0.0115 0.0073 0.0034 747 LEU 79 CA -0.0098 0.0057 0.0047 748 LEU 79 C -0.0101 0.0054 0.0059 749 LEU 79 O -0.0108 0.0048 0.0081 750 LEU 79 CB -0.0075 0.0051 0.0032 751 LEU 79 CG -0.0054 0.0035 0.0041 752 LEU 79 CD1 -0.0049 0.0029 0.0049 753 LEU 79 CD2 -0.0055 0.0027 0.0061 754 LEU 79 H -0.0109 0.0077 0.0017 755 CYS 80 N -0.0102 0.0060 0.0045 756 CYS 80 CA -0.0103 0.0057 0.0054 757 CYS 80 C -0.0126 0.0064 0.0066 758 CYS 80 O -0.0127 0.0055 0.0087 759 CYS 80 CB -0.0094 0.0061 0.0033 760 CYS 80 SG -0.0111 0.0080 0.0011 761 CYS 80 H -0.0098 0.0066 0.0028 762 CYS 80 HG -0.0101 0.0082 -0.0005 763 LYS 81 N -0.0143 0.0075 0.0063 764 LYS 81 CA -0.0167 0.0085 0.0078 765 LYS 81 C -0.0174 0.0079 0.0104 766 LYS 81 O -0.0190 0.0083 0.0121 767 LYS 81 CB -0.0184 0.0103 0.0060 768 LYS 81 CG -0.0186 0.0111 0.0043 769 LYS 81 CD -0.0202 0.0129 0.0024 770 LYS 81 CE -0.0209 0.0138 0.0012 771 LYS 81 NZ -0.0225 0.0155 -0.0007 772 LYS 81 H -0.0141 0.0081 0.0046 773 LYS 81 HZ1 -0.0234 0.0159 0.0000 774 LYS 81 HZ2 -0.0236 0.0163 -0.0008 775 LYS 81 HZ3 -0.0216 0.0156 -0.0025 776 ASP 82 N -0.0161 0.0070 0.0107 777 ASP 82 CA -0.0162 0.0061 0.0131 778 ASP 82 C -0.0144 0.0043 0.0148 779 ASP 82 O -0.0142 0.0034 0.0167 780 ASP 82 CB -0.0160 0.0063 0.0124 781 ASP 82 CG -0.0182 0.0071 0.0138 782 ASP 82 OD1 -0.0189 0.0067 0.0162 783 ASP 82 OD2 -0.0192 0.0083 0.0124 784 ASP 82 H -0.0149 0.0069 0.0090 785 CYS 83 N -0.0124 0.0055 0.0140 786 CYS 83 CA -0.0103 0.0036 0.0152 787 CYS 83 C -0.0102 0.0031 0.0164 788 CYS 83 O -0.0103 0.0036 0.0151 789 CYS 83 CB -0.0081 0.0025 0.0134 790 CYS 83 SG -0.0057 0.0003 0.0147 791 CYS 83 H -0.0125 0.0060 0.0127 792 CYS 83 HG -0.0063 0.0001 0.0168 793 GLN 84 N -0.0094 0.0018 0.0185 794 GLN 84 CA -0.0091 0.0011 0.0200 795 GLN 84 C -0.0075 0.0003 0.0189 796 GLN 84 O -0.0072 -0.0004 0.0204 797 GLN 84 CB -0.0085 -0.0002 0.0226 798 GLN 84 CG -0.0103 0.0007 0.0240 799 GLN 84 CD -0.0100 -0.0004 0.0269 800 GLN 84 NE2 -0.0084 -0.0018 0.0274 801 GLN 84 OE1 -0.0116 0.0002 0.0286 802 GLN 84 H -0.0087 0.0010 0.0194 803 GLN 84 HE21 -0.0073 -0.0021 0.0259 804 GLN 84 HE22 -0.0082 -0.0025 0.0292 805 VAL 85 N -0.0076 0.0013 0.0172 806 VAL 85 CA -0.0058 0.0007 0.0154 807 VAL 85 C -0.0070 0.0014 0.0154 808 VAL 85 O -0.0058 0.0004 0.0162 809 VAL 85 CB -0.0051 0.0013 0.0123 810 VAL 85 CG1 -0.0034 0.0009 0.0105 811 VAL 85 CG2 -0.0038 0.0005 0.0124 812 VAL 85 H -0.0083 0.0020 0.0163 813 ILE 86 N -0.0094 0.0030 0.0154 814 ILE 86 CA -0.0109 0.0039 0.0155 815 ILE 86 C -0.0122 0.0037 0.0186 816 ILE 86 O -0.0132 0.0037 0.0203 817 ILE 86 CB -0.0130 0.0060 0.0134 818 ILE 86 CG1 -0.0146 0.0069 0.0139 819 ILE 86 CG2 -0.0116 0.0062 0.0103 820 ILE 86 CD -0.0171 0.0090 0.0124 821 ILE 86 H -0.0103 0.0037 0.0152 822 ASP 87 N -0.0123 0.0035 0.0202 823 ASP 87 CA -0.0137 0.0034 0.0231 824 ASP 87 C -0.0170 0.0052 0.0236 825 ASP 87 O -0.0184 0.0052 0.0261 826 ASP 87 CB -0.0125 0.0025 0.0235 827 ASP 87 CG -0.0132 0.0037 0.0212 828 ASP 87 OD1 -0.0149 0.0043 0.0224 829 ASP 87 OD2 -0.0128 0.0044 0.0183 830 ASP 87 H -0.0115 0.0036 0.0185 831 GLY 88 N -0.0180 0.0067 0.0209 832 GLY 88 CA -0.0210 0.0085 0.0210 833 GLY 88 C -0.0215 0.0093 0.0192 834 GLY 88 O -0.0221 0.0106 0.0165 835 GLY 88 H -0.0170 0.0068 0.0187 836 ARG 89 N -0.0212 0.0084 0.0210 837 ARG 89 CA -0.0221 0.0093 0.0201 838 ARG 89 C -0.0198 0.0090 0.0171 839 ARG 89 O -0.0212 0.0104 0.0152 840 ARG 89 CB -0.0224 0.0083 0.0234 841 ARG 89 CG -0.0246 0.0085 0.0265 842 ARG 89 CD -0.0281 0.0105 0.0265 843 ARG 89 NE -0.0299 0.0105 0.0296 844 ARG 89 CZ -0.0304 0.0097 0.0328 845 ARG 89 NH1 -0.0296 0.0091 0.0333 846 ARG 89 NH2 -0.0312 0.0092 0.0356 847 ARG 89 H -0.0191 0.0069 0.0218 848 ARG 89 HE -0.0314 0.0115 0.0293 849 ARG 89 HH11 -0.0290 0.0094 0.0312 850 ARG 89 HH12 -0.0293 0.0080 0.0357 851 ARG 89 HH21 -0.0315 0.0093 0.0357 852 ARG 89 HH22 -0.0318 0.0087 0.0378 853 ASN 90 N -0.0167 0.0072 0.0171 854 ASN 90 CA -0.0142 0.0066 0.0146 855 ASN 90 C -0.0132 0.0072 0.0112 856 ASN 90 O -0.0132 0.0082 0.0082 857 ASN 90 CB -0.0111 0.0043 0.0160 858 ASN 90 CG -0.0114 0.0034 0.0191 859 ASN 90 ND2 -0.0123 0.0027 0.0223 860 ASN 90 OD1 -0.0107 0.0030 0.0188 861 ASN 90 H -0.0160 0.0060 0.0193 862 ASN 90 HD21 -0.0130 0.0031 0.0226 863 ASN 90 HD22 -0.0120 0.0019 0.0244 864 VAL 91 N -0.0133 0.0066 0.0119 865 VAL 91 CA -0.0134 0.0074 0.0096 866 VAL 91 C -0.0158 0.0085 0.0104 867 VAL 91 O -0.0160 0.0077 0.0130 868 VAL 91 CB -0.0105 0.0061 0.0089 869 VAL 91 CG1 -0.0087 0.0059 0.0065 870 VAL 91 CG2 -0.0089 0.0043 0.0115 871 VAL 91 H -0.0127 0.0057 0.0138 872 THR 92 N -0.0172 0.0099 0.0082 873 THR 92 CA -0.0198 0.0112 0.0087 874 THR 92 C -0.0194 0.0114 0.0074 875 THR 92 O -0.0171 0.0105 0.0064 876 THR 92 CB -0.0221 0.0130 0.0071 877 THR 92 CG2 -0.0225 0.0129 0.0081 878 THR 92 OG1 -0.0213 0.0136 0.0039 879 THR 92 H -0.0171 0.0105 0.0062 880 THR 92 HG1 -0.0200 0.0130 0.0034 881 VAL 93 N -0.0212 0.0115 0.0078 882 VAL 93 CA -0.0216 0.0124 0.0062 883 VAL 93 C -0.0208 0.0132 0.0028 884 VAL 93 O -0.0190 0.0126 0.0016 885 VAL 93 CB -0.0246 0.0137 0.0073 886 VAL 93 CG1 -0.0250 0.0127 0.0105 887 VAL 93 CG2 -0.0268 0.0152 0.0068 888 VAL 93 H -0.0226 0.0116 0.0096 889 THR 94 N -0.0218 0.0143 0.0015 890 THR 94 CA -0.0214 0.0152 -0.0016 891 THR 94 C -0.0186 0.0140 -0.0026 892 THR 94 O -0.0176 0.0144 -0.0051 893 THR 94 CB -0.0237 0.0168 -0.0021 894 THR 94 CG2 -0.0238 0.0181 -0.0052 895 THR 94 OG1 -0.0262 0.0175 -0.0001 896 THR 94 H -0.0234 0.0148 0.0026 897 THR 94 HG1 -0.0275 0.0183 -0.0001 898 ASP 95 N -0.0177 0.0129 -0.0007 899 ASP 95 CA -0.0150 0.0115 -0.0013 900 ASP 95 C -0.0129 0.0104 -0.0016 901 ASP 95 O -0.0114 0.0104 -0.0038 902 ASP 95 CB -0.0145 0.0104 0.0008 903 ASP 95 CG -0.0165 0.0116 0.0008 904 ASP 95 OD1 -0.0168 0.0127 -0.0015 905 ASP 95 OD2 -0.0176 0.0113 0.0033 906 ASP 95 H -0.0187 0.0128 0.0012 907 VAL 96 N -0.0130 0.0097 0.0005 908 VAL 96 CA -0.0114 0.0088 0.0001 909 VAL 96 C -0.0116 0.0099 -0.0022 910 VAL 96 O -0.0096 0.0093 -0.0036 911 VAL 96 CB -0.0116 0.0078 0.0031 912 VAL 96 CG1 -0.0140 0.0088 0.0041 913 VAL 96 CG2 -0.0090 0.0060 0.0036 914 VAL 96 H -0.0145 0.0099 0.0021 915 ASP 97 N -0.0141 0.0111 -0.0026 916 ASP 97 CA -0.0147 0.0123 -0.0048 917 ASP 97 C -0.0132 0.0126 -0.0077 918 ASP 97 O -0.0116 0.0122 -0.0085 919 ASP 97 CB -0.0177 0.0139 -0.0049 920 ASP 97 CG -0.0186 0.0149 -0.0063 921 ASP 97 OD1 -0.0200 0.0163 -0.0080 922 ASP 97 OD2 -0.0186 0.0145 -0.0053 923 ASP 97 H -0.0157 0.0114 -0.0012 924 ILE 98 N -0.0137 0.0135 -0.0091 925 ILE 98 CA -0.0122 0.0137 -0.0117 926 ILE 98 C -0.0094 0.0122 -0.0116 927 ILE 98 O -0.0090 0.0118 -0.0111 928 ILE 98 CB -0.0139 0.0152 -0.0132 929 ILE 98 CG1 -0.0165 0.0166 -0.0135 930 ILE 98 CG2 -0.0125 0.0156 -0.0161 931 ILE 98 CD -0.0182 0.0181 -0.0151 932 ILE 98 H -0.0155 0.0142 -0.0086 933 VAL 99 N -0.0081 0.0110 -0.0122 934 VAL 99 CA -0.0052 0.0098 -0.0130 935 VAL 99 C -0.0043 0.0103 -0.0161 936 VAL 99 O -0.0021 0.0095 -0.0166 937 VAL 99 CB -0.0034 0.0088 -0.0121 938 VAL 99 CG1 -0.0038 0.0081 -0.0089 939 VAL 99 CG2 -0.0042 0.0095 -0.0133 940 VAL 99 H -0.0086 0.0111 -0.0118 941 PHE 100 N -0.0060 0.0116 -0.0182 942 PHE 100 CA -0.0051 0.0121 -0.0213 943 PHE 100 C -0.0041 0.0118 -0.0218 944 PHE 100 O -0.0018 0.0110 -0.0230 945 PHE 100 CB -0.0075 0.0137 -0.0231 946 PHE 100 CG -0.0067 0.0142 -0.0263 947 PHE 100 CD1 -0.0062 0.0143 -0.0276 948 PHE 100 CD2 -0.0062 0.0144 -0.0280 949 PHE 100 CE1 -0.0054 0.0147 -0.0304 950 PHE 100 CE2 -0.0050 0.0146 -0.0308 951 PHE 100 CZ -0.0046 0.0148 -0.0321 952 PHE 100 H -0.0074 0.0123 -0.0183 953 PHE 100 HD1 -0.0065 0.0141 -0.0263 954 PHE 100 HD2 -0.0072 0.0146 -0.0271 955 PHE 100 HE1 -0.0046 0.0145 -0.0312 956 PHE 100 HE2 -0.0046 0.0148 -0.0322 957 PHE 100 HZ -0.0043 0.0153 -0.0344 958 SER 101 N -0.0058 0.0124 -0.0206 959 SER 101 CA -0.0050 0.0119 -0.0201 960 SER 101 C -0.0026 0.0101 -0.0184 961 SER 101 O -0.0013 0.0096 -0.0191 962 SER 101 CB -0.0073 0.0126 -0.0183 963 SER 101 OG -0.0084 0.0125 -0.0159 964 SER 101 H -0.0075 0.0130 -0.0194 965 SER 101 HG -0.0103 0.0133 -0.0154 966 LYS 102 N -0.0020 0.0092 -0.0164 967 LYS 102 CA -0.0001 0.0076 -0.0144 968 LYS 102 C 0.0027 0.0062 -0.0149 969 LYS 102 O 0.0043 0.0049 -0.0132 970 LYS 102 CB -0.0013 0.0073 -0.0113 971 LYS 102 CG -0.0040 0.0085 -0.0104 972 LYS 102 CD -0.0056 0.0085 -0.0077 973 LYS 102 CE -0.0081 0.0096 -0.0068 974 LYS 102 NZ -0.0100 0.0113 -0.0089 975 LYS 102 H -0.0024 0.0094 -0.0165 976 LYS 102 HZ1 -0.0094 0.0115 -0.0107 977 LYS 102 HZ2 -0.0101 0.0115 -0.0095 978 LYS 102 HZ3 -0.0118 0.0119 -0.0079 979 ILE 103 N 0.0031 0.0065 -0.0168 980 ILE 103 CA 0.0058 0.0056 -0.0179 981 ILE 103 C 0.0074 0.0055 -0.0205 982 ILE 103 O 0.0063 0.0064 -0.0221 983 ILE 103 CB 0.0056 0.0059 -0.0188 984 ILE 103 CG1 0.0032 0.0075 -0.0207 985 ILE 103 CG2 0.0056 0.0052 -0.0163 986 ILE 103 CD 0.0025 0.0079 -0.0212 987 ILE 103 H 0.0017 0.0075 -0.0180 988 LYS 104 N 0.0101 0.0043 -0.0210 989 LYS 104 CA 0.0118 0.0041 -0.0234 990 LYS 104 C 0.0135 0.0039 -0.0257 991 LYS 104 O 0.0150 0.0030 -0.0246 992 LYS 104 CB 0.0136 0.0029 -0.0219 993 LYS 104 CG 0.0120 0.0032 -0.0202 994 LYS 104 CD 0.0144 0.0019 -0.0194 995 LYS 104 CE 0.0135 0.0017 -0.0169 996 LYS 104 NZ 0.0135 0.0011 -0.0143 997 LYS 104 H 0.0113 0.0034 -0.0197 998 LYS 104 HZ1 0.0129 0.0010 -0.0127 999 LYS 104 HZ2 0.0121 0.0017 -0.0142 1000 LYS 104 HZ3 0.0153 0.0001 -0.0137 1001 GLY 105 N 0.0139 0.0051 -0.0281 1002 GLY 105 CA 0.0154 0.0053 -0.0309 1003 GLY 105 C 0.0132 0.0067 -0.0320 1004 GLY 105 O 0.0116 0.0080 -0.0339 1005 GLY 105 H 0.0129 0.0056 -0.0284 1006 LYS 106 N 0.0132 0.0062 -0.0307 1007 LYS 106 CA 0.0114 0.0074 -0.0317 1008 LYS 106 C 0.0085 0.0081 -0.0298 1009 LYS 106 O 0.0081 0.0074 -0.0271 1010 LYS 106 CB 0.0133 0.0065 -0.0315 1011 LYS 106 CG 0.0124 0.0074 -0.0332 1012 LYS 106 CD 0.0141 0.0076 -0.0362 1013 LYS 106 CE 0.0131 0.0086 -0.0379 1014 LYS 106 NZ 0.0137 0.0079 -0.0366 1015 LYS 106 H 0.0148 0.0051 -0.0294 1016 LYS 106 HZ1 0.0126 0.0078 -0.0345 1017 LYS 106 HZ2 0.0132 0.0085 -0.0379 1018 LYS 106 HZ3 0.0158 0.0069 -0.0364 1019 SER 107 N 0.0069 0.0099 -0.0310 1020 SER 107 CA 0.0039 0.0108 -0.0300 1021 SER 107 C 0.0024 0.0113 -0.0300 1022 SER 107 O 0.0020 0.0120 -0.0321 1023 SER 107 CB 0.0020 0.0119 -0.0318 1024 SER 107 OG 0.0031 0.0115 -0.0318 1025 SER 107 H 0.0072 0.0103 -0.0331 1026 SER 107 HG 0.0042 0.0116 -0.0338 1027 CYS 108 N 0.0021 0.0107 -0.0273 1028 CYS 108 CA 0.0011 0.0110 -0.0267 1029 CYS 108 C -0.0017 0.0116 -0.0249 1030 CYS 108 O -0.0023 0.0112 -0.0225 1031 CYS 108 CB 0.0035 0.0097 -0.0252 1032 CYS 108 SG 0.0070 0.0088 -0.0271 1033 CYS 108 H 0.0031 0.0100 -0.0257 1034 CYS 108 HG 0.0082 0.0078 -0.0251 1035 ARG 109 N -0.0025 0.0126 -0.0256 1036 ARG 109 CA -0.0053 0.0128 -0.0238 1037 ARG 109 C -0.0046 0.0116 -0.0209 1038 ARG 109 O -0.0051 0.0107 -0.0181 1039 ARG 109 CB -0.0076 0.0143 -0.0260 1040 ARG 109 CG -0.0094 0.0156 -0.0281 1041 ARG 109 CD -0.0114 0.0171 -0.0304 1042 ARG 109 NE -0.0135 0.0183 -0.0320 1043 ARG 109 CZ -0.0158 0.0197 -0.0339 1044 ARG 109 NH1 -0.0169 0.0200 -0.0341 1045 ARG 109 NH2 -0.0173 0.0207 -0.0356 1046 ARG 109 H -0.0015 0.0130 -0.0276 1047 ARG 109 HE -0.0134 0.0179 -0.0311 1048 ARG 109 HH11 -0.0164 0.0193 -0.0324 1049 ARG 109 HH12 -0.0183 0.0211 -0.0359 1050 ARG 109 HH21 -0.0165 0.0205 -0.0357 1051 ARG 109 HH22 -0.0191 0.0217 -0.0369 1052 THR 110 N -0.0020 0.0111 -0.0218 1053 THR 110 CA -0.0004 0.0098 -0.0195 1054 THR 110 C 0.0026 0.0084 -0.0184 1055 THR 110 O 0.0053 0.0082 -0.0201 1056 THR 110 CB 0.0004 0.0100 -0.0209 1057 THR 110 CG2 0.0015 0.0087 -0.0181 1058 THR 110 OG1 -0.0022 0.0113 -0.0223 1059 THR 110 H -0.0009 0.0115 -0.0240 1060 THR 110 HG1 -0.0016 0.0111 -0.0223 1061 ILE 111 N 0.0014 0.0077 -0.0164 1062 ILE 111 CA 0.0034 0.0065 -0.0155 1063 ILE 111 C 0.0052 0.0054 -0.0144 1064 ILE 111 O 0.0046 0.0052 -0.0132 1065 ILE 111 CB 0.0027 0.0063 -0.0139 1066 ILE 111 CG1 0.0006 0.0066 -0.0120 1067 ILE 111 CG2 0.0021 0.0071 -0.0155 1068 ILE 111 CD 0.0002 0.0060 -0.0099 1069 ILE 111 H -0.0001 0.0080 -0.0153 1070 THR 112 N 0.0074 0.0045 -0.0147 1071 THR 112 CA 0.0094 0.0033 -0.0138 1072 THR 112 C 0.0098 0.0022 -0.0112 1073 THR 112 O 0.0085 0.0024 -0.0100 1074 THR 112 CB 0.0117 0.0028 -0.0154 1075 THR 112 CG2 0.0119 0.0036 -0.0181 1076 THR 112 OG1 0.0123 0.0023 -0.0149 1077 THR 112 H 0.0080 0.0045 -0.0156 1078 THR 112 HG1 0.0132 0.0025 -0.0163 1079 PHE 113 N 0.0102 0.0011 -0.0104 1080 PHE 113 CA 0.0112 0.0002 -0.0082 1081 PHE 113 C 0.0123 -0.0004 -0.0079 1082 PHE 113 O 0.0119 -0.0006 -0.0061 1083 PHE 113 CB 0.0128 -0.0006 -0.0079 1084 PHE 113 CG 0.0136 -0.0015 -0.0055 1085 PHE 113 CD1 0.0158 -0.0025 -0.0052 1086 PHE 113 CD2 0.0122 -0.0012 -0.0036 1087 PHE 113 CE1 0.0166 -0.0033 -0.0030 1088 PHE 113 CE2 0.0130 -0.0021 -0.0014 1089 PHE 113 CZ 0.0152 -0.0031 -0.0011 1090 PHE 113 H 0.0099 0.0013 -0.0109 1091 PHE 113 HD1 0.0170 -0.0026 -0.0067 1092 PHE 113 HD2 0.0104 -0.0005 -0.0037 1093 PHE 113 HE1 0.0183 -0.0041 -0.0027 1094 PHE 113 HE2 0.0119 -0.0020 0.0002 1095 PHE 113 HZ 0.0158 -0.0037 0.0006 1096 GLU 114 N 0.0134 -0.0004 -0.0098 1097 GLU 114 CA 0.0145 -0.0009 -0.0099 1098 GLU 114 C 0.0128 -0.0001 -0.0099 1099 GLU 114 O 0.0125 -0.0003 -0.0084 1100 GLU 114 CB 0.0165 -0.0013 -0.0118 1101 GLU 114 CG 0.0178 -0.0018 -0.0122 1102 GLU 114 CD 0.0168 -0.0010 -0.0142 1103 GLU 114 OE1 0.0154 -0.0004 -0.0137 1104 GLU 114 OE2 0.0174 -0.0008 -0.0162 1105 GLU 114 H 0.0140 -0.0004 -0.0112 1106 GLN 115 N 0.0121 0.0010 -0.0122 1107 GLN 115 CA 0.0100 0.0021 -0.0126 1108 GLN 115 C 0.0080 0.0024 -0.0105 1109 GLN 115 O 0.0071 0.0027 -0.0102 1110 GLN 115 CB 0.0091 0.0031 -0.0150 1111 GLN 115 CG 0.0104 0.0032 -0.0175 1112 GLN 115 CD 0.0092 0.0045 -0.0198 1113 GLN 115 NE2 0.0095 0.0048 -0.0215 1114 GLN 115 OE1 0.0083 0.0051 -0.0206 1115 GLN 115 H 0.0124 0.0012 -0.0134 1116 GLN 115 HE21 0.0105 0.0042 -0.0211 1117 GLN 115 HE22 0.0083 0.0057 -0.0228 1118 PHE 116 N 0.0075 0.0022 -0.0091 1119 PHE 116 CA 0.0061 0.0022 -0.0068 1120 PHE 116 C 0.0071 0.0012 -0.0049 1121 PHE 116 O 0.0057 0.0015 -0.0038 1122 PHE 116 CB 0.0062 0.0018 -0.0057 1123 PHE 116 CG 0.0045 0.0019 -0.0032 1124 PHE 116 CD1 0.0022 0.0029 -0.0032 1125 PHE 116 CD2 0.0056 0.0008 -0.0009 1126 PHE 116 CE1 0.0009 0.0030 -0.0012 1127 PHE 116 CE2 0.0042 0.0008 0.0013 1128 PHE 116 CZ 0.0019 0.0019 0.0011 1129 PHE 116 H 0.0080 0.0022 -0.0098 1130 PHE 116 HD1 0.0013 0.0038 -0.0049 1131 PHE 116 HD2 0.0074 -0.0001 -0.0008 1132 PHE 116 HE1 -0.0010 0.0039 -0.0015 1133 PHE 116 HE2 0.0045 0.0000 0.0033 1134 PHE 116 HZ 0.0005 0.0020 0.0028 1135 GLN 117 N 0.0093 -0.0003 -0.0045 1136 GLN 117 CA 0.0106 -0.0012 -0.0028 1137 GLN 117 C 0.0109 -0.0011 -0.0038 1138 GLN 117 O 0.0105 -0.0012 -0.0023 1139 GLN 117 CB 0.0131 -0.0023 -0.0022 1140 GLN 117 CG 0.0130 -0.0026 -0.0004 1141 GLN 117 CD 0.0155 -0.0036 -0.0007 1142 GLN 117 NE2 0.0158 -0.0035 -0.0022 1143 GLN 117 OE1 0.0172 -0.0046 0.0006 1144 GLN 117 H 0.0101 -0.0006 -0.0048 1145 GLN 117 HE21 0.0144 -0.0027 -0.0032 1146 GLN 117 HE22 0.0176 -0.0041 -0.0028 1147 GLU 118 N 0.0113 -0.0007 -0.0064 1148 GLU 118 CA 0.0113 -0.0005 -0.0076 1149 GLU 118 C 0.0089 0.0004 -0.0071 1150 GLU 118 O 0.0089 0.0003 -0.0066 1151 GLU 118 CB 0.0117 -0.0001 -0.0105 1152 GLU 118 CG 0.0128 -0.0002 -0.0120 1153 GLU 118 CD 0.0137 -0.0001 -0.0148 1154 GLU 118 OE1 0.0130 0.0006 -0.0167 1155 GLU 118 OE2 0.0154 -0.0007 -0.0152 1156 GLU 118 H 0.0122 -0.0009 -0.0073 1157 ALA 119 N 0.0064 0.0017 -0.0073 1158 ALA 119 CA 0.0037 0.0028 -0.0063 1159 ALA 119 C 0.0033 0.0021 -0.0031 1160 ALA 119 O 0.0024 0.0024 -0.0021 1161 ALA 119 CB 0.0021 0.0040 -0.0071 1162 ALA 119 H 0.0065 0.0019 -0.0084 1163 LEU 120 N 0.0042 0.0012 -0.0015 1164 LEU 120 CA 0.0041 0.0004 0.0015 1165 LEU 120 C 0.0054 -0.0006 0.0025 1166 LEU 120 O 0.0041 -0.0002 0.0038 1167 LEU 120 CB 0.0054 -0.0006 0.0025 1168 LEU 120 CG 0.0035 0.0001 0.0036 1169 LEU 120 CD1 0.0047 -0.0005 0.0036 1170 LEU 120 CD2 0.0027 -0.0003 0.0067 1171 LEU 120 H 0.0042 0.0015 -0.0023 1172 GLU 121 N 0.0083 -0.0017 0.0009 1173 GLU 121 CA 0.0099 -0.0030 0.0016 1174 GLU 121 C 0.0085 -0.0020 0.0013 1175 GLU 121 O 0.0081 -0.0023 0.0034 1176 GLU 121 CB 0.0128 -0.0044 -0.0001 1177 GLU 121 CG 0.0146 -0.0059 0.0011 1178 GLU 121 CD 0.0172 -0.0071 -0.0010 1179 GLU 121 OE1 0.0183 -0.0078 -0.0009 1180 GLU 121 OE2 0.0184 -0.0075 -0.0026 1181 GLU 121 H 0.0092 -0.0019 -0.0008 1182 GLU 122 N 0.0076 -0.0007 -0.0015 1183 GLU 122 CA 0.0060 0.0006 -0.0024 1184 GLU 122 C 0.0035 0.0016 0.0000 1185 GLU 122 O 0.0034 0.0013 0.0013 1186 GLU 122 CB 0.0051 0.0020 -0.0058 1187 GLU 122 CG 0.0045 0.0026 -0.0065 1188 GLU 122 CD 0.0071 0.0012 -0.0076 1189 GLU 122 OE1 0.0082 -0.0000 -0.0057 1190 GLU 122 OE2 0.0083 0.0011 -0.0102 1191 GLU 122 H 0.0080 -0.0005 -0.0032 1192 LEU 123 N 0.0021 0.0015 0.0011 1193 LEU 123 CA -0.0002 0.0021 0.0036 1194 LEU 123 C 0.0005 0.0007 0.0068 1195 LEU 123 O -0.0003 0.0009 0.0079 1196 LEU 123 CB -0.0020 0.0030 0.0039 1197 LEU 123 CG -0.0035 0.0047 0.0011 1198 LEU 123 CD1 -0.0041 0.0054 0.0001 1199 LEU 123 CD2 -0.0062 0.0061 0.0020 1200 LEU 123 H 0.0024 0.0018 -0.0002 1201 ALA 124 N 0.0029 -0.0008 0.0075 1202 ALA 124 CA 0.0040 -0.0023 0.0104 1203 ALA 124 C 0.0050 -0.0031 0.0110 1204 ALA 124 O 0.0047 -0.0038 0.0138 1205 ALA 124 CB 0.0063 -0.0038 0.0107 1206 ALA 124 H 0.0041 -0.0012 0.0063 1207 LYS 125 N 0.0062 -0.0031 0.0086 1208 LYS 125 CA 0.0072 -0.0036 0.0083 1209 LYS 125 C 0.0049 -0.0023 0.0084 1210 LYS 125 O 0.0047 -0.0027 0.0102 1211 LYS 125 CB 0.0091 -0.0038 0.0052 1212 LYS 125 CG 0.0119 -0.0053 0.0050 1213 LYS 125 CD 0.0138 -0.0056 0.0020 1214 LYS 125 CE 0.0127 -0.0041 -0.0007 1215 LYS 125 NZ 0.0141 -0.0040 -0.0037 1216 LYS 125 H 0.0062 -0.0025 0.0066 1217 LYS 125 HZ1 0.0158 -0.0048 -0.0042 1218 LYS 125 HZ2 0.0128 -0.0028 -0.0052 1219 LYS 125 HZ3 0.0149 -0.0045 -0.0036 1220 LYS 126 N 0.0024 -0.0006 0.0074 1221 LYS 126 CA -0.0002 0.0008 0.0080 1222 LYS 126 C -0.0016 0.0006 0.0114 1223 LYS 126 O -0.0035 0.0014 0.0126 1224 LYS 126 CB -0.0021 0.0026 0.0056 1225 LYS 126 CG -0.0007 0.0029 0.0023 1226 LYS 126 CD -0.0028 0.0047 0.0004 1227 LYS 126 CE -0.0019 0.0052 -0.0030 1228 LYS 126 NZ -0.0012 0.0053 -0.0048 1229 LYS 126 H 0.0023 -0.0001 0.0062 1230 LYS 126 HZ1 -0.0010 0.0059 -0.0071 1231 LYS 126 HZ2 -0.0026 0.0059 -0.0041 1232 LYS 126 HZ3 0.0005 0.0041 -0.0041 1233 ARG 127 N -0.0014 0.0002 0.0130 1234 ARG 127 CA -0.0026 -0.0001 0.0162 1235 ARG 127 C -0.0011 -0.0019 0.0187 1236 ARG 127 O -0.0022 -0.0019 0.0205 1237 ARG 127 CB -0.0028 -0.0000 0.0164 1238 ARG 127 CG -0.0035 -0.0007 0.0197 1239 ARG 127 CD -0.0040 -0.0006 0.0203 1240 ARG 127 NE -0.0047 -0.0013 0.0236 1241 ARG 127 CZ -0.0049 -0.0016 0.0249 1242 ARG 127 NH1 -0.0044 -0.0014 0.0233 1243 ARG 127 NH2 -0.0053 -0.0024 0.0280 1244 ARG 127 H -0.0009 0.0004 0.0116 1245 ARG 127 HE -0.0056 -0.0011 0.0247 1246 ARG 127 HH11 -0.0038 -0.0010 0.0211 1247 ARG 127 HH12 -0.0048 -0.0016 0.0246 1248 ARG 127 HH21 -0.0054 -0.0028 0.0291 1249 ARG 127 HH22 -0.0058 -0.0025 0.0291 1250 PHE 128 N 0.0014 -0.0035 0.0189 1251 PHE 128 CA 0.0031 -0.0053 0.0211 1252 PHE 128 C 0.0048 -0.0060 0.0199 1253 PHE 128 O 0.0072 -0.0071 0.0188 1254 PHE 128 CB 0.0047 -0.0067 0.0224 1255 PHE 128 CG 0.0034 -0.0061 0.0228 1256 PHE 128 CD1 0.0044 -0.0060 0.0207 1257 PHE 128 CD2 0.0018 -0.0061 0.0257 1258 PHE 128 CE1 0.0039 -0.0058 0.0211 1259 PHE 128 CE2 0.0014 -0.0060 0.0262 1260 PHE 128 CZ 0.0023 -0.0058 0.0240 1261 PHE 128 H 0.0025 -0.0038 0.0176 1262 PHE 128 HD1 0.0059 -0.0063 0.0188 1263 PHE 128 HD2 0.0008 -0.0059 0.0271 1264 PHE 128 HE1 0.0055 -0.0065 0.0202 1265 PHE 128 HE2 0.0010 -0.0065 0.0285 1266 PHE 128 HZ 0.0015 -0.0054 0.0244 1267 LYS 129 N 0.0041 -0.0054 0.0218 1268 LYS 129 CA 0.0062 -0.0066 0.0204 1269 LYS 129 C 0.0100 -0.0090 0.0227 1270 LYS 129 O 0.0104 -0.0093 0.0258 1271 LYS 129 CB 0.0033 -0.0048 0.0209 1272 LYS 129 CG -0.0001 -0.0026 0.0183 1273 LYS 129 CD -0.0021 -0.0015 0.0190 1274 LYS 129 CE -0.0058 0.0009 0.0169 1275 LYS 129 NZ -0.0083 0.0024 0.0168 1276 LYS 129 H 0.0015 -0.0038 0.0229 1277 LYS 129 HZ1 -0.0078 0.0020 0.0197 1278 LYS 129 HZ2 -0.0081 0.0024 0.0143 1279 LYS 129 HZ3 -0.0109 0.0040 0.0171 1280 ASP 130 N 0.0130 -0.0107 0.0213 1281 ASP 130 CA 0.0167 -0.0131 0.0233 1282 ASP 130 C 0.0199 -0.0150 0.0210 1283 ASP 130 O 0.0204 -0.0151 0.0169 1284 ASP 130 CB 0.0181 -0.0140 0.0249 1285 ASP 130 CG 0.0191 -0.0147 0.0297 1286 ASP 130 OD1 0.0166 -0.0133 0.0324 1287 ASP 130 OD2 0.0223 -0.0167 0.0308 1288 ASP 130 H 0.0128 -0.0105 0.0185 1289 LYS 131 N 0.0234 -0.0173 0.0243 1290 LYS 131 CA 0.0273 -0.0198 0.0231 1291 LYS 131 C 0.0304 -0.0215 0.0241 1292 LYS 131 O 0.0328 -0.0234 0.0216 1293 LYS 131 CB 0.0288 -0.0204 0.0246 1294 LYS 131 CG 0.0274 -0.0202 0.0213 1295 LYS 131 CD 0.0285 -0.0217 0.0166 1296 LYS 131 CE 0.0269 -0.0214 0.0130 1297 LYS 131 NZ 0.0277 -0.0227 0.0085 1298 LYS 131 H 0.0233 -0.0167 0.0274 1299 LYS 131 HZ1 0.0303 -0.0243 0.0081 1300 LYS 131 HZ2 0.0257 -0.0217 0.0071 1301 LYS 131 HZ3 0.0279 -0.0232 0.0064 1302 SER 132 N 0.0308 -0.0210 0.0280 1303 SER 132 CA 0.0338 -0.0227 0.0291 1304 SER 132 C 0.0326 -0.0221 0.0280 1305 SER 132 O 0.0344 -0.0237 0.0253 1306 SER 132 CB 0.0351 -0.0226 0.0338 1307 SER 132 OG 0.0321 -0.0203 0.0366 1308 SER 132 H 0.0290 -0.0196 0.0303 1309 SER 132 HG 0.0311 -0.0197 0.0367 1310 SER 133 N 0.0290 -0.0201 0.0293 1311 SER 133 CA 0.0282 -0.0196 0.0289 1312 SER 133 C 0.0265 -0.0186 0.0252 1313 SER 133 O 0.0239 -0.0169 0.0251 1314 SER 133 CB 0.0267 -0.0185 0.0325 1315 SER 133 OG 0.0285 -0.0195 0.0361 1316 SER 133 H 0.0272 -0.0189 0.0306 1317 SER 133 HG 0.0270 -0.0184 0.0382 1318 GLU 134 N 0.0282 -0.0200 0.0221 1319 GLU 134 CA 0.0270 -0.0194 0.0180 1320 GLU 134 C 0.0264 -0.0190 0.0170 1321 GLU 134 O 0.0236 -0.0172 0.0169 1322 GLU 134 CB 0.0295 -0.0212 0.0154 1323 GLU 134 CG 0.0299 -0.0213 0.0163 1324 GLU 134 CD 0.0321 -0.0230 0.0135 1325 GLU 134 OE1 0.0307 -0.0221 0.0111 1326 GLU 134 OE2 0.0351 -0.0250 0.0138 1327 GLU 134 H 0.0305 -0.0214 0.0228 1328 GLU 135 N 0.0284 -0.0206 0.0174 1329 GLU 135 CA 0.0286 -0.0207 0.0164 1330 GLU 135 C 0.0261 -0.0188 0.0178 1331 GLU 135 O 0.0251 -0.0180 0.0158 1332 GLU 135 CB 0.0316 -0.0230 0.0175 1333 GLU 135 CG 0.0327 -0.0238 0.0154 1334 GLU 135 CD 0.0337 -0.0244 0.0115 1335 GLU 135 OE1 0.0324 -0.0233 0.0090 1336 GLU 135 OE2 0.0355 -0.0257 0.0108 1337 GLU 135 H 0.0300 -0.0219 0.0186 1338 ALA 136 N 0.0249 -0.0181 0.0212 1339 ALA 136 CA 0.0226 -0.0164 0.0234 1340 ALA 136 C 0.0195 -0.0140 0.0220 1341 ALA 136 O 0.0178 -0.0126 0.0210 1342 ALA 136 CB 0.0231 -0.0170 0.0273 1343 ALA 136 H 0.0256 -0.0187 0.0224 1344 VAL 137 N 0.0187 -0.0136 0.0211 1345 VAL 137 CA 0.0158 -0.0114 0.0200 1346 VAL 137 C 0.0153 -0.0106 0.0162 1347 VAL 137 O 0.0129 -0.0088 0.0156 1348 VAL 137 CB 0.0150 -0.0109 0.0207 1349 VAL 137 CG1 0.0153 -0.0115 0.0245 1350 VAL 137 CG2 0.0163 -0.0115 0.0181 1351 VAL 137 H 0.0197 -0.0143 0.0218 1352 ARG 138 N 0.0176 -0.0119 0.0140 1353 ARG 138 CA 0.0179 -0.0118 0.0104 1354 ARG 138 C 0.0181 -0.0119 0.0103 1355 ARG 138 O 0.0195 -0.0126 0.0080 1356 ARG 138 CB 0.0206 -0.0134 0.0085 1357 ARG 138 CG 0.0201 -0.0130 0.0079 1358 ARG 138 CD 0.0226 -0.0146 0.0059 1359 ARG 138 NE 0.0226 -0.0142 0.0024 1360 ARG 138 CZ 0.0250 -0.0156 0.0001 1361 ARG 138 NH1 0.0274 -0.0174 0.0010 1362 ARG 138 NH2 0.0247 -0.0150 -0.0032 1363 ARG 138 H 0.0192 -0.0132 0.0147 1364 ARG 138 HE 0.0208 -0.0128 0.0014 1365 ARG 138 HH11 0.0280 -0.0181 0.0034 1366 ARG 138 HH12 0.0290 -0.0184 -0.0008 1367 ARG 138 HH21 0.0227 -0.0135 -0.0039 1368 ARG 138 HH22 0.0263 -0.0160 -0.0049 1369 GLU 139 N 0.0165 -0.0107 0.0129 1370 GLU 139 CA 0.0165 -0.0108 0.0130 1371 GLU 139 C 0.0138 -0.0087 0.0122 1372 GLU 139 O 0.0118 -0.0075 0.0137 1373 GLU 139 CB 0.0171 -0.0117 0.0164 1374 GLU 139 CG 0.0189 -0.0130 0.0164 1375 GLU 139 CD 0.0173 -0.0118 0.0161 1376 GLU 139 OE1 0.0179 -0.0118 0.0136 1377 GLU 139 OE2 0.0154 -0.0108 0.0181 1378 GLU 139 H 0.0158 -0.0106 0.0149 1379 VAL 140 N 0.0138 -0.0085 0.0107 1380 VAL 140 CA 0.0113 -0.0066 0.0098 1381 VAL 140 C 0.0103 -0.0062 0.0121 1382 VAL 140 O 0.0079 -0.0047 0.0129 1383 VAL 140 CB 0.0116 -0.0062 0.0062 1384 VAL 140 CG1 0.0116 -0.0059 0.0040 1385 VAL 140 CG2 0.0140 -0.0078 0.0056 1386 VAL 140 H 0.0153 -0.0096 0.0112 1387 HIS 141 N 0.0118 -0.0080 0.0133 1388 HIS 141 CA 0.0113 -0.0078 0.0147 1389 HIS 141 C 0.0095 -0.0069 0.0178 1390 HIS 141 O 0.0076 -0.0057 0.0184 1391 HIS 141 CB 0.0140 -0.0096 0.0151 1392 HIS 141 CG 0.0143 -0.0100 0.0171 1393 HIS 141 CD2 0.0138 -0.0099 0.0201 1394 HIS 141 ND1 0.0144 -0.0099 0.0161 1395 HIS 141 CE1 0.0138 -0.0097 0.0183 1396 HIS 141 NE2 0.0135 -0.0098 0.0209 1397 HIS 141 H 0.0138 -0.0093 0.0134 1398 HIS 141 HD2 0.0139 -0.0102 0.0219 1399 HIS 141 HE1 0.0133 -0.0095 0.0183 1400 HIS 141 HE2 0.0132 -0.0098 0.0232 1401 ARG 142 N 0.0098 -0.0072 0.0195 1402 ARG 142 CA 0.0083 -0.0065 0.0224 1403 ARG 142 C 0.0053 -0.0045 0.0219 1404 ARG 142 O 0.0035 -0.0036 0.0240 1405 ARG 142 CB 0.0096 -0.0075 0.0239 1406 ARG 142 CG 0.0123 -0.0094 0.0254 1407 ARG 142 CD 0.0129 -0.0101 0.0279 1408 ARG 142 NE 0.0145 -0.0109 0.0266 1409 ARG 142 CZ 0.0171 -0.0126 0.0257 1410 ARG 142 NH1 0.0187 -0.0137 0.0262 1411 ARG 142 NH2 0.0185 -0.0134 0.0246 1412 ARG 142 H 0.0113 -0.0081 0.0187 1413 ARG 142 HE 0.0134 -0.0102 0.0257 1414 ARG 142 HH11 0.0179 -0.0133 0.0272 1415 ARG 142 HH12 0.0207 -0.0149 0.0259 1416 ARG 142 HH21 0.0176 -0.0127 0.0239 1417 ARG 142 HH22 0.0204 -0.0146 0.0240 1418 LEU 143 N 0.0044 -0.0053 0.0180 1419 LEU 143 CA 0.0020 -0.0034 0.0174 1420 LEU 143 C 0.0009 -0.0023 0.0162 1421 LEU 143 O -0.0011 -0.0012 0.0172 1422 LEU 143 CB 0.0021 -0.0030 0.0156 1423 LEU 143 CG 0.0027 -0.0038 0.0170 1424 LEU 143 CD1 0.0030 -0.0035 0.0147 1425 LEU 143 CD2 0.0006 -0.0028 0.0191 1426 LEU 143 H 0.0056 -0.0058 0.0164 1427 ILE 144 N 0.0022 -0.0028 0.0144 1428 ILE 144 CA 0.0014 -0.0019 0.0128 1429 ILE 144 C 0.0007 -0.0018 0.0145 1430 ILE 144 O 0.0021 -0.0031 0.0159 1431 ILE 144 CB 0.0030 -0.0024 0.0102 1432 ILE 144 CG1 0.0022 -0.0014 0.0082 1433 ILE 144 CG2 0.0053 -0.0043 0.0108 1434 ILE 144 CD 0.0000 0.0005 0.0071 1435 ILE 144 H 0.0039 -0.0040 0.0140 1436 GLU 145 N -0.0013 -0.0016 0.0135 1437 GLU 145 CA -0.0016 -0.0018 0.0145 1438 GLU 145 C -0.0013 -0.0010 0.0123 1439 GLU 145 O -0.0017 0.0004 0.0105 1440 GLU 145 CB -0.0034 -0.0006 0.0163 1441 GLU 145 CG -0.0038 -0.0013 0.0186 1442 GLU 145 CD -0.0056 0.0002 0.0199 1443 GLU 145 OE1 -0.0060 -0.0004 0.0220 1444 GLU 145 OE2 -0.0067 0.0020 0.0187 1445 GLU 145 H -0.0024 -0.0006 0.0140 1446 GLY 146 N -0.0006 -0.0020 0.0125 1447 GLY 146 CA -0.0003 -0.0014 0.0109 1448 GLY 146 C -0.0021 0.0005 0.0112 1449 GLY 146 O -0.0024 0.0005 0.0118 1450 GLY 146 H -0.0003 -0.0030 0.0140 1451 LYS 147 N -0.0050 -0.0013 0.0096 1452 LYS 147 CA -0.0058 0.0004 0.0095 1453 LYS 147 C -0.0047 0.0007 0.0079 1454 LYS 147 O -0.0034 0.0007 0.0064 1455 LYS 147 CB -0.0067 0.0024 0.0092 1456 LYS 147 CG -0.0081 0.0025 0.0109 1457 LYS 147 CD -0.0093 0.0022 0.0124 1458 LYS 147 CE -0.0104 0.0015 0.0141 1459 LYS 147 NZ -0.0116 0.0012 0.0157 1460 LYS 147 H -0.0053 -0.0009 0.0096 1461 LYS 147 HZ1 -0.0111 0.0001 0.0158 1462 LYS 147 HZ2 -0.0121 0.0006 0.0168 1463 LYS 147 HZ3 -0.0123 0.0026 0.0157 1464 ALA 148 N -0.0055 0.0016 0.0084 1465 ALA 148 CA -0.0047 0.0020 0.0072 1466 ALA 148 C -0.0053 0.0041 0.0065 1467 ALA 148 O -0.0064 0.0047 0.0074 1468 ALA 148 CB -0.0047 0.0004 0.0081 1469 ALA 148 H -0.0067 0.0021 0.0095 1470 PRO 149 N -0.0062 0.0007 0.0044 1471 PRO 149 CA -0.0066 -0.0010 0.0045 1472 PRO 149 C -0.0069 -0.0023 0.0057 1473 PRO 149 O -0.0068 -0.0019 0.0064 1474 PRO 149 CB -0.0065 -0.0007 0.0051 1475 PRO 149 CG -0.0061 0.0011 0.0061 1476 PRO 149 CD -0.0059 0.0021 0.0052 1477 ILE 150 N -0.0073 -0.0040 0.0053 1478 ILE 150 CA -0.0077 -0.0056 0.0062 1479 ILE 150 C -0.0079 -0.0065 0.0074 1480 ILE 150 O -0.0082 -0.0077 0.0070 1481 ILE 150 CB -0.0079 -0.0070 0.0048 1482 ILE 150 CG1 -0.0077 -0.0062 0.0032 1483 ILE 150 CG2 -0.0083 -0.0084 0.0058 1484 ILE 150 CD -0.0075 -0.0052 0.0037 1485 ILE 150 H -0.0073 -0.0043 0.0044 1486 ILE 151 N -0.0092 -0.0058 0.0062 1487 ILE 151 CA -0.0086 -0.0055 0.0070 1488 ILE 151 C -0.0076 -0.0053 0.0088 1489 ILE 151 O -0.0071 -0.0047 0.0090 1490 ILE 151 CB -0.0082 -0.0041 0.0059 1491 ILE 151 CG1 -0.0078 -0.0038 0.0064 1492 ILE 151 CG2 -0.0074 -0.0027 0.0057 1493 ILE 151 CD -0.0085 -0.0053 0.0068 1494 ILE 151 H -0.0087 -0.0056 0.0069 1495 SER 152 N -0.0076 -0.0063 0.0100 1496 SER 152 CA -0.0069 -0.0064 0.0117 1497 SER 152 C -0.0057 -0.0049 0.0122 1498 SER 152 O -0.0054 -0.0040 0.0117 1499 SER 152 CB -0.0070 -0.0075 0.0129 1500 SER 152 OG -0.0080 -0.0091 0.0129 1501 SER 152 H -0.0083 -0.0070 0.0097 1502 SER 152 HG -0.0083 -0.0096 0.0130 1503 GLY 153 N -0.0058 -0.0037 0.0137 1504 GLY 153 CA -0.0049 -0.0022 0.0138 1505 GLY 153 C -0.0045 -0.0013 0.0134 1506 GLY 153 O -0.0039 -0.0005 0.0144 1507 GLY 153 H -0.0060 -0.0041 0.0139 1508 VAL 154 N -0.0048 -0.0017 0.0120 1509 VAL 154 CA -0.0046 -0.0011 0.0114 1510 VAL 154 C -0.0052 -0.0022 0.0115 1511 VAL 154 O -0.0049 -0.0019 0.0120 1512 VAL 154 CB -0.0043 -0.0002 0.0097 1513 VAL 154 CG1 -0.0050 -0.0012 0.0084 1514 VAL 154 CG2 -0.0037 0.0009 0.0094 1515 VAL 154 H -0.0052 -0.0022 0.0112 1516 THR 155 N -0.0057 -0.0035 0.0120 1517 THR 155 CA -0.0058 -0.0049 0.0108 1518 THR 155 C -0.0062 -0.0065 0.0128 1519 THR 155 O -0.0065 -0.0078 0.0140 1520 THR 155 CB -0.0060 -0.0066 0.0090 1521 THR 155 CG2 -0.0060 -0.0068 0.0069 1522 THR 155 OG1 -0.0059 -0.0058 0.0084 1523 THR 155 H -0.0058 -0.0041 0.0119 1524 THR 155 HG1 -0.0057 -0.0052 0.0067 1525 LYS 156 N -0.0062 -0.0063 0.0131 1526 LYS 156 CA -0.0065 -0.0074 0.0149 1527 LYS 156 C -0.0068 -0.0094 0.0138 1528 LYS 156 O -0.0066 -0.0088 0.0124 1529 LYS 156 CB -0.0063 -0.0056 0.0162 1530 LYS 156 CG -0.0064 -0.0057 0.0189 1531 LYS 156 CD -0.0063 -0.0043 0.0202 1532 LYS 156 CE -0.0065 -0.0053 0.0206 1533 LYS 156 NZ -0.0062 -0.0037 0.0220 1534 LYS 156 H -0.0060 -0.0056 0.0117 1535 LYS 156 HZ1 -0.0064 -0.0044 0.0226 1536 LYS 156 HZ2 -0.0062 -0.0030 0.0234 1537 LYS 156 HZ3 -0.0059 -0.0023 0.0210 1538 ALA 157 N -0.0062 -0.0129 0.0152 1539 ALA 157 CA -0.0066 -0.0158 0.0140 1540 ALA 157 C -0.0067 -0.0160 0.0160 1541 ALA 157 O -0.0068 -0.0153 0.0191 1542 ALA 157 CB -0.0070 -0.0188 0.0144 1543 ALA 157 H -0.0064 -0.0136 0.0165 1544 ILE 158 N -0.0067 -0.0166 0.0140 1545 ILE 158 CA -0.0068 -0.0172 0.0151 1546 ILE 158 C -0.0072 -0.0207 0.0142 1547 ILE 158 O -0.0074 -0.0227 0.0126 1548 ILE 158 CB -0.0064 -0.0145 0.0139 1549 ILE 158 CG1 -0.0061 -0.0142 0.0100 1550 ILE 158 CG2 -0.0060 -0.0112 0.0157 1551 ILE 158 CD -0.0056 -0.0110 0.0089 1552 ILE 158 H -0.0065 -0.0168 0.0115 1553 SER 159 N -0.0056 -0.0230 0.0151 1554 SER 159 CA -0.0050 -0.0268 0.0145 1555 SER 159 C -0.0041 -0.0268 0.0105 1556 SER 159 O -0.0041 -0.0250 0.0099 1557 SER 159 CB -0.0056 -0.0276 0.0173 1558 SER 159 OG -0.0051 -0.0314 0.0169 1559 SER 159 H -0.0059 -0.0210 0.0154 1560 SER 159 HG -0.0044 -0.0319 0.0143 1561 SER 160 N -0.0034 -0.0275 0.0081 1562 SER 160 CA -0.0023 -0.0284 0.0042 1563 SER 160 C -0.0020 -0.0278 0.0027 1564 SER 160 O -0.0021 -0.0295 0.0039 1565 SER 160 CB -0.0017 -0.0324 0.0037 1566 SER 160 OG -0.0012 -0.0325 0.0016 1567 SER 160 H -0.0035 -0.0283 0.0089 1568 SER 160 HG -0.0017 -0.0318 0.0034 1569 PRO 161 N -0.0008 -0.0253 0.0021 1570 PRO 161 CA -0.0002 -0.0241 -0.0003 1571 PRO 161 C 0.0013 -0.0256 -0.0044 1572 PRO 161 O 0.0019 -0.0288 -0.0049 1573 PRO 161 CB -0.0008 -0.0195 -0.0004 1574 PRO 161 CG -0.0012 -0.0185 0.0003 1575 PRO 161 CD -0.0016 -0.0218 0.0031 1576 THR 162 N 0.0018 -0.0242 -0.0066 1577 THR 162 CA 0.0032 -0.0249 -0.0108 1578 THR 162 C 0.0036 -0.0214 -0.0135 1579 THR 162 O 0.0031 -0.0179 -0.0134 1580 THR 162 CB 0.0038 -0.0259 -0.0122 1581 THR 162 CG2 0.0037 -0.0297 -0.0101 1582 THR 162 OG1 0.0032 -0.0228 -0.0117 1583 THR 162 H 0.0012 -0.0224 -0.0057 1584 THR 162 HG1 0.0023 -0.0223 -0.0090 1585 VAL 163 N 0.0037 -0.0219 -0.0140 1586 VAL 163 CA 0.0039 -0.0195 -0.0159 1587 VAL 163 C 0.0053 -0.0215 -0.0191 1588 VAL 163 O 0.0055 -0.0240 -0.0185 1589 VAL 163 CB 0.0030 -0.0184 -0.0135 1590 VAL 163 CG1 0.0033 -0.0156 -0.0157 1591 VAL 163 CG2 0.0015 -0.0165 -0.0100 1592 VAL 163 H 0.0039 -0.0245 -0.0134 1593 SER 164 N 0.0062 -0.0202 -0.0225 1594 SER 164 CA 0.0075 -0.0218 -0.0257 1595 SER 164 C 0.0075 -0.0203 -0.0264 1596 SER 164 O 0.0070 -0.0171 -0.0262 1597 SER 164 CB 0.0084 -0.0208 -0.0289 1598 SER 164 OG 0.0097 -0.0217 -0.0323 1599 SER 164 H 0.0061 -0.0185 -0.0231 1600 SER 164 HG 0.0099 -0.0194 -0.0340 1601 ARG 165 N 0.0076 -0.0226 -0.0274 1602 ARG 165 CA 0.0076 -0.0229 -0.0273 1603 ARG 165 C 0.0078 -0.0196 -0.0284 1604 ARG 165 O 0.0071 -0.0184 -0.0264 1605 ARG 165 CB 0.0083 -0.0263 -0.0291 1606 ARG 165 CG 0.0080 -0.0272 -0.0280 1607 ARG 165 CD 0.0070 -0.0288 -0.0244 1608 ARG 165 NE 0.0067 -0.0296 -0.0233 1609 ARG 165 CZ 0.0062 -0.0325 -0.0214 1610 ARG 165 NH1 0.0061 -0.0346 -0.0206 1611 ARG 165 NH2 0.0059 -0.0331 -0.0202 1612 ARG 165 H 0.0077 -0.0249 -0.0274 1613 ARG 165 HE 0.0070 -0.0284 -0.0247 1614 ARG 165 HH11 0.0062 -0.0345 -0.0212 1615 ARG 165 HH12 0.0060 -0.0371 -0.0201 1616 ARG 165 HH21 0.0057 -0.0308 -0.0200 1617 ARG 165 HH22 0.0060 -0.0354 -0.0203 1618 LEU 166 N 0.0087 -0.0184 -0.0315 1619 LEU 166 CA 0.0089 -0.0150 -0.0327 1620 LEU 166 C 0.0083 -0.0119 -0.0312 1621 LEU 166 O 0.0086 -0.0110 -0.0322 1622 LEU 166 CB 0.0102 -0.0147 -0.0366 1623 LEU 166 CG 0.0104 -0.0112 -0.0379 1624 LEU 166 CD1 0.0106 -0.0118 -0.0384 1625 LEU 166 CD2 0.0114 -0.0102 -0.0412 1626 LEU 166 H 0.0093 -0.0196 -0.0332 1627 THR 167 N 0.0077 -0.0103 -0.0277 1628 THR 167 CA 0.0066 -0.0077 -0.0255 1629 THR 167 C 0.0066 -0.0038 -0.0271 1630 THR 167 O 0.0066 -0.0017 -0.0282 1631 THR 167 CB 0.0054 -0.0070 -0.0218 1632 THR 167 CG2 0.0051 -0.0103 -0.0193 1633 THR 167 OG1 0.0055 -0.0065 -0.0223 1634 THR 167 H 0.0074 -0.0114 -0.0263 1635 THR 167 HG1 0.0047 -0.0060 -0.0200 1636 ASP 168 N 0.0068 -0.0035 -0.0279 1637 ASP 168 CA 0.0070 -0.0002 -0.0301 1638 ASP 168 C 0.0061 0.0037 -0.0289 1639 ASP 168 O 0.0051 0.0044 -0.0258 1640 ASP 168 CB 0.0070 -0.0007 -0.0299 1641 ASP 168 CG 0.0077 0.0013 -0.0330 1642 ASP 168 OD1 0.0088 -0.0004 -0.0358 1643 ASP 168 OD2 0.0071 0.0045 -0.0327 1644 ASP 168 H 0.0068 -0.0055 -0.0271 1645 THR 169 N 0.0071 0.0059 -0.0313 1646 THR 169 CA 0.0063 0.0097 -0.0308 1647 THR 169 C 0.0054 0.0122 -0.0295 1648 THR 169 O 0.0043 0.0148 -0.0276 1649 THR 169 CB 0.0071 0.0118 -0.0340 1650 THR 169 CG2 0.0078 0.0103 -0.0351 1651 THR 169 OG1 0.0081 0.0119 -0.0367 1652 THR 169 H 0.0081 0.0050 -0.0337 1653 THR 169 HG1 0.0082 0.0143 -0.0381 1654 THR 170 N 0.0059 0.0116 -0.0306 1655 THR 170 CA 0.0051 0.0140 -0.0294 1656 THR 170 C 0.0041 0.0123 -0.0260 1657 THR 170 O 0.0030 0.0144 -0.0239 1658 THR 170 CB 0.0062 0.0142 -0.0324 1659 THR 170 CG2 0.0070 0.0161 -0.0356 1660 THR 170 OG1 0.0070 0.0107 -0.0332 1661 THR 170 H 0.0068 0.0095 -0.0320 1662 THR 170 HG1 0.0073 0.0082 -0.0329 1663 LYS 171 N 0.0044 0.0090 -0.0256 1664 LYS 171 CA 0.0035 0.0070 -0.0223 1665 LYS 171 C 0.0024 0.0070 -0.0191 1666 LYS 171 O 0.0011 0.0084 -0.0163 1667 LYS 171 CB 0.0045 0.0029 -0.0231 1668 LYS 171 CG 0.0056 0.0022 -0.0256 1669 LYS 171 CD 0.0066 -0.0020 -0.0266 1670 LYS 171 CE 0.0079 -0.0022 -0.0300 1671 LYS 171 NZ 0.0092 -0.0058 -0.0316 1672 LYS 171 H 0.0054 0.0072 -0.0275 1673 LYS 171 HZ1 0.0092 -0.0073 -0.0311 1674 LYS 171 HZ2 0.0101 -0.0054 -0.0342 1675 LYS 171 HZ3 0.0089 -0.0075 -0.0303 1676 PHE 172 N 0.0027 0.0062 -0.0196 1677 PHE 172 CA 0.0016 0.0065 -0.0169 1678 PHE 172 C 0.0013 0.0100 -0.0177 1679 PHE 172 O 0.0020 0.0100 -0.0196 1680 PHE 172 CB 0.0023 0.0028 -0.0171 1681 PHE 172 CG 0.0025 -0.0008 -0.0159 1682 PHE 172 CD1 0.0013 -0.0019 -0.0124 1683 PHE 172 CD2 0.0037 -0.0026 -0.0182 1684 PHE 172 CE1 0.0013 -0.0048 -0.0109 1685 PHE 172 CE2 0.0036 -0.0056 -0.0167 1686 PHE 172 CZ 0.0024 -0.0067 -0.0131 1687 PHE 172 H 0.0037 0.0048 -0.0217 1688 PHE 172 HD1 0.0005 -0.0009 -0.0105 1689 PHE 172 HD2 0.0045 -0.0016 -0.0210 1690 PHE 172 HE1 0.0003 -0.0055 -0.0080 1691 PHE 172 HE2 0.0046 -0.0076 -0.0186 1692 PHE 172 HZ 0.0023 -0.0086 -0.0118 1693 THR 173 N 0.0017 0.0122 -0.0160 1694 THR 173 CA 0.0015 0.0160 -0.0172 1695 THR 173 C 0.0007 0.0171 -0.0156 1696 THR 173 O -0.0005 0.0171 -0.0126 1697 THR 173 CB 0.0007 0.0187 -0.0162 1698 THR 173 CG2 0.0018 0.0190 -0.0191 1699 THR 173 OG1 -0.0005 0.0179 -0.0128 1700 THR 173 H 0.0010 0.0120 -0.0142 1701 THR 173 HG1 -0.0009 0.0194 -0.0126 1702 GLY 174 N 0.0014 0.0189 -0.0180 1703 GLY 174 CA 0.0008 0.0200 -0.0169 1704 GLY 174 C -0.0000 0.0179 -0.0141 1705 GLY 174 O 0.0006 0.0146 -0.0143 1706 GLY 174 H 0.0024 0.0193 -0.0205 1707 SER 175 N -0.0002 0.0191 -0.0104 1708 SER 175 CA -0.0010 0.0178 -0.0079 1709 SER 175 C -0.0014 0.0145 -0.0062 1710 SER 175 O -0.0019 0.0131 -0.0048 1711 SER 175 CB -0.0021 0.0207 -0.0057 1712 SER 175 OG -0.0024 0.0222 -0.0050 1713 SER 175 H -0.0004 0.0212 -0.0103 1714 SER 175 HG -0.0033 0.0229 -0.0028 1715 HIS 176 N -0.0012 0.0135 -0.0066 1716 HIS 176 CA -0.0016 0.0104 -0.0051 1717 HIS 176 C -0.0008 0.0072 -0.0065 1718 HIS 176 O -0.0013 0.0050 -0.0049 1719 HIS 176 CB -0.0016 0.0102 -0.0050 1720 HIS 176 CG -0.0027 0.0127 -0.0025 1721 HIS 176 CD2 -0.0027 0.0143 -0.0027 1722 HIS 176 ND1 -0.0038 0.0126 0.0004 1723 HIS 176 CE1 -0.0045 0.0145 0.0020 1724 HIS 176 NE2 -0.0039 0.0157 0.0001 1725 HIS 176 H -0.0008 0.0150 -0.0079 1726 HIS 176 HD2 -0.0021 0.0147 -0.0046 1727 HIS 176 HE1 -0.0055 0.0150 0.0044 1728 HIS 176 HE2 -0.0042 0.0167 0.0008 1729 LYS 177 N -0.0001 0.0066 -0.0095 1730 LYS 177 CA 0.0008 0.0040 -0.0117 1731 LYS 177 C 0.0006 0.0041 -0.0112 1732 LYS 177 O 0.0008 0.0015 -0.0114 1733 LYS 177 CB 0.0020 0.0051 -0.0152 1734 LYS 177 CG 0.0030 0.0027 -0.0178 1735 LYS 177 CD 0.0039 0.0046 -0.0205 1736 LYS 177 CE 0.0050 0.0025 -0.0233 1737 LYS 177 NZ 0.0057 0.0047 -0.0257 1738 LYS 177 H 0.0003 0.0086 -0.0108 1739 LYS 177 HZ1 0.0052 0.0069 -0.0246 1740 LYS 177 HZ2 0.0060 0.0038 -0.0264 1741 LYS 177 HZ3 0.0064 0.0051 -0.0276 1742 GLU 178 N 0.0006 0.0072 -0.0116 1743 GLU 178 CA 0.0003 0.0077 -0.0107 1744 GLU 178 C -0.0007 0.0059 -0.0077 1745 GLU 178 O -0.0006 0.0040 -0.0076 1746 GLU 178 CB 0.0001 0.0115 -0.0106 1747 GLU 178 CG -0.0000 0.0128 -0.0105 1748 GLU 178 CD -0.0005 0.0166 -0.0098 1749 GLU 178 OE1 0.0002 0.0186 -0.0121 1750 GLU 178 OE2 -0.0015 0.0176 -0.0071 1751 GLU 178 H 0.0010 0.0091 -0.0129 1752 ARG 179 N -0.0009 0.0062 -0.0048 1753 ARG 179 CA -0.0017 0.0046 -0.0017 1754 ARG 179 C -0.0019 0.0014 -0.0009 1755 ARG 179 O -0.0026 0.0005 0.0020 1756 ARG 179 CB -0.0025 0.0069 0.0011 1757 ARG 179 CG -0.0026 0.0080 0.0015 1758 ARG 179 CD -0.0035 0.0095 0.0047 1759 ARG 179 NE -0.0036 0.0113 0.0048 1760 ARG 179 CZ -0.0034 0.0144 0.0039 1761 ARG 179 NH1 -0.0032 0.0160 0.0029 1762 ARG 179 NH2 -0.0032 0.0158 0.0032 1763 ARG 179 H -0.0010 0.0074 -0.0046 1764 ARG 179 HE -0.0039 0.0103 0.0062 1765 ARG 179 HH11 -0.0030 0.0148 0.0024 1766 ARG 179 HH12 -0.0032 0.0184 0.0028 1767 ARG 179 HH21 -0.0032 0.0142 0.0030 1768 ARG 179 HH22 -0.0033 0.0181 0.0032 1769 PHE 180 N -0.0012 -0.0002 -0.0033 1770 PHE 180 CA -0.0012 -0.0033 -0.0031 1771 PHE 180 C -0.0004 -0.0060 -0.0057 1772 PHE 180 O 0.0003 -0.0056 -0.0084 1773 PHE 180 CB -0.0014 -0.0030 -0.0025 1774 PHE 180 CG -0.0014 -0.0061 -0.0023 1775 PHE 180 CD1 -0.0021 -0.0076 0.0006 1776 PHE 180 CD2 -0.0006 -0.0073 -0.0050 1777 PHE 180 CE1 -0.0021 -0.0103 0.0007 1778 PHE 180 CE2 -0.0006 -0.0100 -0.0048 1779 PHE 180 CZ -0.0014 -0.0114 -0.0019 1780 PHE 180 H -0.0006 0.0007 -0.0054 1781 PHE 180 HD1 -0.0028 -0.0065 0.0028 1782 PHE 180 HD2 -0.0000 -0.0062 -0.0072 1783 PHE 180 HE1 -0.0027 -0.0117 0.0029 1784 PHE 180 HE2 -0.0001 -0.0107 -0.0068 1785 PHE 180 HZ -0.0015 -0.0136 -0.0016 1786 ASP 181 N -0.0014 -0.0074 -0.0046 1787 ASP 181 CA -0.0006 -0.0107 -0.0063 1788 ASP 181 C -0.0002 -0.0137 -0.0064 1789 ASP 181 O -0.0006 -0.0145 -0.0037 1790 ASP 181 CB -0.0007 -0.0121 -0.0046 1791 ASP 181 CG 0.0001 -0.0153 -0.0065 1792 ASP 181 OD1 0.0005 -0.0148 -0.0088 1793 ASP 181 OD2 0.0003 -0.0183 -0.0060 1794 ASP 181 H -0.0018 -0.0080 -0.0020 1795 PRO 182 N 0.0007 -0.0149 -0.0097 1796 PRO 182 CA 0.0012 -0.0178 -0.0105 1797 PRO 182 C 0.0010 -0.0208 -0.0076 1798 PRO 182 O 0.0010 -0.0217 -0.0069 1799 PRO 182 CB 0.0021 -0.0192 -0.0139 1800 PRO 182 CG 0.0021 -0.0160 -0.0158 1801 PRO 182 CD 0.0012 -0.0138 -0.0130 1802 SER 183 N -0.0012 -0.0211 -0.0062 1803 SER 183 CA -0.0017 -0.0239 -0.0041 1804 SER 183 C -0.0025 -0.0229 -0.0007 1805 SER 183 O -0.0031 -0.0242 0.0016 1806 SER 183 CB -0.0017 -0.0251 -0.0038 1807 SER 183 OG -0.0020 -0.0223 -0.0028 1808 SER 183 H -0.0010 -0.0202 -0.0069 1809 SER 183 HG -0.0016 -0.0209 -0.0046 1810 GLY 184 N -0.0026 -0.0204 -0.0006 1811 GLY 184 CA -0.0033 -0.0189 0.0022 1812 GLY 184 C -0.0039 -0.0175 0.0044 1813 GLY 184 O -0.0046 -0.0182 0.0073 1814 GLY 184 H -0.0022 -0.0190 -0.0024 1815 LYS 185 N -0.0045 -0.0147 0.0034 1816 LYS 185 CA -0.0045 -0.0128 0.0051 1817 LYS 185 C -0.0043 -0.0094 0.0049 1818 LYS 185 O -0.0041 -0.0083 0.0025 1819 LYS 185 CB -0.0044 -0.0131 0.0041 1820 LYS 185 CG -0.0046 -0.0160 0.0048 1821 LYS 185 CD -0.0046 -0.0159 0.0039 1822 LYS 185 CE -0.0048 -0.0190 0.0042 1823 LYS 185 NZ -0.0048 -0.0211 0.0021 1824 LYS 185 H -0.0043 -0.0140 0.0014 1825 LYS 185 HZ1 -0.0048 -0.0214 0.0022 1826 LYS 185 HZ2 -0.0046 -0.0208 0.0000 1827 LYS 185 HZ3 -0.0049 -0.0230 0.0025 1828 GLY 186 N -0.0043 -0.0081 0.0073 1829 GLY 186 CA -0.0042 -0.0050 0.0074 1830 GLY 186 C -0.0041 -0.0034 0.0083 1831 GLY 186 O -0.0043 -0.0046 0.0096 1832 GLY 186 H -0.0045 -0.0092 0.0091 1833 LYS 187 N -0.0037 -0.0012 0.0083 1834 LYS 187 CA -0.0039 -0.0001 0.0090 1835 LYS 187 C -0.0042 0.0019 0.0101 1836 LYS 187 O -0.0042 0.0034 0.0092 1837 LYS 187 CB -0.0036 0.0005 0.0069 1838 LYS 187 CG -0.0033 -0.0014 0.0059 1839 LYS 187 CD -0.0031 -0.0009 0.0038 1840 LYS 187 CE -0.0028 -0.0026 0.0028 1841 LYS 187 NZ -0.0025 -0.0020 0.0009 1842 LYS 187 H -0.0036 -0.0006 0.0071 1843 LYS 187 HZ1 -0.0025 -0.0013 0.0000 1844 LYS 187 HZ2 -0.0026 -0.0010 0.0011 1845 LYS 187 HZ3 -0.0023 -0.0032 0.0001 1846 GLY 188 N -0.0045 0.0016 0.0121 1847 GLY 188 CA -0.0049 0.0029 0.0137 1848 GLY 188 C -0.0049 0.0029 0.0140 1849 GLY 188 O -0.0050 0.0017 0.0151 1850 GLY 188 H -0.0045 0.0003 0.0126 1851 LYS 189 N -0.0051 0.0062 0.0138 1852 LYS 189 CA -0.0055 0.0074 0.0150 1853 LYS 189 C -0.0051 0.0061 0.0136 1854 LYS 189 O -0.0042 0.0075 0.0115 1855 LYS 189 CB -0.0051 0.0108 0.0150 1856 LYS 189 CG -0.0055 0.0124 0.0167 1857 LYS 189 CD -0.0050 0.0160 0.0164 1858 LYS 189 CE -0.0051 0.0175 0.0170 1859 LYS 189 NZ -0.0047 0.0208 0.0170 1860 LYS 189 H -0.0045 0.0073 0.0123 1861 LYS 189 HZ1 -0.0046 0.0219 0.0170 1862 LYS 189 HZ2 -0.0053 0.0215 0.0188 1863 LYS 189 HZ3 -0.0040 0.0214 0.0153 1864 ALA 190 N -0.0056 0.0032 0.0142 1865 ALA 190 CA -0.0054 0.0016 0.0130 1866 ALA 190 C -0.0062 -0.0011 0.0146 1867 ALA 190 O -0.0065 -0.0035 0.0148 1868 ALA 190 CB -0.0043 0.0010 0.0098 1869 ALA 190 H -0.0062 0.0017 0.0153 1870 GLY 191 N -0.0065 -0.0007 0.0165 1871 GLY 191 CA -0.0073 -0.0038 0.0182 1872 GLY 191 C -0.0071 -0.0040 0.0175 1873 GLY 191 O -0.0062 -0.0024 0.0148 1874 GLY 191 H -0.0067 0.0017 0.0177 1875 ARG 192 N -0.0080 -0.0060 0.0199 1876 ARG 192 CA -0.0082 -0.0070 0.0203 1877 ARG 192 C -0.0073 -0.0051 0.0180 1878 ARG 192 O -0.0066 -0.0066 0.0152 1879 ARG 192 CB -0.0094 -0.0069 0.0242 1880 ARG 192 CG -0.0099 -0.0094 0.0253 1881 ARG 192 CD -0.0110 -0.0089 0.0292 1882 ARG 192 NE -0.0113 -0.0111 0.0297 1883 ARG 192 CZ -0.0115 -0.0098 0.0306 1884 ARG 192 NH1 -0.0112 -0.0061 0.0307 1885 ARG 192 NH2 -0.0116 -0.0120 0.0303 1886 ARG 192 H -0.0087 -0.0073 0.0219 1887 ARG 192 HE -0.0115 -0.0139 0.0295 1888 ARG 192 HH11 -0.0109 -0.0045 0.0300 1889 ARG 192 HH12 -0.0112 -0.0049 0.0309 1890 ARG 192 HH21 -0.0115 -0.0147 0.0294 1891 ARG 192 HH22 -0.0119 -0.0111 0.0318 1892 VAL 193 N -0.0082 -0.0011 0.0182 1893 VAL 193 CA -0.0076 0.0013 0.0163 1894 VAL 193 C -0.0067 0.0040 0.0137 1895 VAL 193 O -0.0062 0.0067 0.0126 1896 VAL 193 CB -0.0082 0.0028 0.0186 1897 VAL 193 CG1 -0.0086 -0.0003 0.0195 1898 VAL 193 CG2 -0.0091 0.0050 0.0218 1899 VAL 193 H -0.0088 0.0000 0.0201 1900 ASP 194 N -0.0064 0.0032 0.0126 1901 ASP 194 CA -0.0055 0.0054 0.0100 1902 ASP 194 C -0.0044 0.0036 0.0064 1903 ASP 194 O -0.0037 0.0041 0.0042 1904 ASP 194 CB -0.0059 0.0065 0.0116 1905 ASP 194 CG -0.0069 0.0089 0.0149 1906 ASP 194 OD1 -0.0078 0.0075 0.0177 1907 ASP 194 OD2 -0.0066 0.0122 0.0146 1908 ASP 194 H -0.0066 0.0008 0.0130 1909 LEU 195 N -0.0049 0.0004 0.0064 1910 LEU 195 CA -0.0037 -0.0017 0.0032 1911 LEU 195 C -0.0034 -0.0051 0.0033 1912 LEU 195 O -0.0039 -0.0075 0.0055 1913 LEU 195 CB -0.0034 -0.0025 0.0027 1914 LEU 195 CG -0.0031 0.0008 0.0008 1915 LEU 195 CD1 -0.0019 0.0015 -0.0030 1916 LEU 195 CD2 -0.0041 0.0044 0.0028 1917 LEU 195 H -0.0056 -0.0004 0.0087 1918 VAL 196 N -0.0027 -0.0046 0.0011 1919 VAL 196 CA -0.0024 -0.0072 0.0010 1920 VAL 196 C -0.0011 -0.0090 -0.0025 1921 VAL 196 O -0.0004 -0.0091 -0.0045 1922 VAL 196 CB -0.0030 -0.0055 0.0022 1923 VAL 196 CG1 -0.0044 -0.0046 0.0061 1924 VAL 196 CG2 -0.0026 -0.0019 0.0002 1925 VAL 196 H -0.0024 -0.0023 -0.0004 1926 ASP 197 N -0.0005 -0.0106 -0.0036 1927 ASP 197 CA 0.0010 -0.0127 -0.0071 1928 ASP 197 C 0.0016 -0.0096 -0.0102 1929 ASP 197 O 0.0011 -0.0066 -0.0102 1930 ASP 197 CB 0.0012 -0.0150 -0.0067 1931 ASP 197 CG 0.0003 -0.0174 -0.0029 1932 ASP 197 OD1 -0.0008 -0.0158 -0.0002 1933 ASP 197 OD2 0.0010 -0.0210 -0.0030 1934 ASP 197 H -0.0011 -0.0110 -0.0016 1935 GLU 198 N 0.0029 -0.0109 -0.0136 1936 GLU 198 CA 0.0038 -0.0086 -0.0172 1937 GLU 198 C 0.0037 -0.0070 -0.0176 1938 GLU 198 O 0.0033 -0.0037 -0.0182 1939 GLU 198 CB 0.0053 -0.0104 -0.0208 1940 GLU 198 CG 0.0056 -0.0118 -0.0210 1941 GLU 198 CD 0.0072 -0.0137 -0.0247 1942 GLU 198 OE1 0.0077 -0.0172 -0.0247 1943 GLU 198 OE2 0.0079 -0.0118 -0.0277 1944 GLU 198 H 0.0034 -0.0133 -0.0137 1945 SER 199 N 0.0045 -0.0099 -0.0179 1946 SER 199 CA 0.0045 -0.0086 -0.0186 1947 SER 199 C 0.0033 -0.0095 -0.0148 1948 SER 199 O 0.0035 -0.0101 -0.0151 1949 SER 199 CB 0.0064 -0.0108 -0.0226 1950 SER 199 OG 0.0073 -0.0088 -0.0263 1951 SER 199 H 0.0049 -0.0131 -0.0172 1952 SER 199 HG 0.0066 -0.0061 -0.0258 1953 GLY 200 N 0.0019 -0.0091 -0.0112 1954 GLY 200 CA 0.0004 -0.0095 -0.0070 1955 GLY 200 C 0.0010 -0.0138 -0.0062 1956 GLY 200 O 0.0009 -0.0135 -0.0061 1957 GLY 200 H 0.0015 -0.0074 -0.0112 1958 TYR 201 N 0.0006 -0.0167 -0.0045 1959 TYR 201 CA 0.0008 -0.0209 -0.0033 1960 TYR 201 C -0.0005 -0.0224 0.0012 1961 TYR 201 O -0.0015 -0.0206 0.0036 1962 TYR 201 CB 0.0023 -0.0243 -0.0064 1963 TYR 201 CG 0.0035 -0.0238 -0.0106 1964 TYR 201 CD1 0.0043 -0.0217 -0.0140 1965 TYR 201 CD2 0.0040 -0.0257 -0.0111 1966 TYR 201 CE1 0.0055 -0.0214 -0.0176 1967 TYR 201 CE2 0.0052 -0.0258 -0.0148 1968 TYR 201 CZ 0.0059 -0.0233 -0.0181 1969 TYR 201 OH 0.0068 -0.0223 -0.0214 1970 TYR 201 H 0.0004 -0.0166 -0.0042 1971 TYR 201 HD1 0.0043 -0.0215 -0.0140 1972 TYR 201 HD2 0.0033 -0.0273 -0.0084 1973 TYR 201 HE1 0.0060 -0.0196 -0.0201 1974 TYR 201 HE2 0.0057 -0.0284 -0.0153 1975 TYR 201 HH 0.0075 -0.0244 -0.0224 1976 VAL 202 N -0.0006 -0.0236 0.0021 1977 VAL 202 CA -0.0016 -0.0258 0.0062 1978 VAL 202 C -0.0032 -0.0226 0.0097 1979 VAL 202 O -0.0042 -0.0233 0.0132 1980 VAL 202 CB -0.0010 -0.0287 0.0055 1981 VAL 202 CG1 -0.0017 -0.0319 0.0091 1982 VAL 202 CG2 0.0007 -0.0313 0.0016 1983 VAL 202 H -0.0002 -0.0224 0.0003 1984 SER 203 N -0.0036 -0.0186 0.0081 1985 SER 203 CA -0.0048 -0.0150 0.0108 1986 SER 203 C -0.0048 -0.0109 0.0095 1987 SER 203 O -0.0058 -0.0082 0.0119 1988 SER 203 CB -0.0052 -0.0145 0.0120 1989 SER 203 OG -0.0041 -0.0147 0.0085 1990 SER 203 H -0.0028 -0.0180 0.0056 1991 SER 203 HG -0.0044 -0.0139 0.0094 1992 GLY 204 N -0.0035 -0.0108 0.0057 1993 GLY 204 CA -0.0031 -0.0075 0.0034 1994 GLY 204 C -0.0032 -0.0074 0.0036 1995 GLY 204 O -0.0028 -0.0104 0.0032 1996 GLY 204 H -0.0028 -0.0126 0.0039 1997 TYR 205 N -0.0042 -0.0033 0.0037 1998 TYR 205 CA -0.0043 -0.0023 0.0035 1999 TYR 205 C -0.0030 -0.0000 -0.0009 2000 TYR 205 O -0.0031 0.0038 -0.0022 2001 TYR 205 CB -0.0061 0.0006 0.0076 2002 TYR 205 CG -0.0064 0.0035 0.0072 2003 TYR 205 CD1 -0.0063 0.0013 0.0080 2004 TYR 205 CD2 -0.0071 0.0081 0.0075 2005 TYR 205 CE1 -0.0069 0.0036 0.0087 2006 TYR 205 CE2 -0.0078 0.0105 0.0084 2007 TYR 205 CZ -0.0076 0.0083 0.0089 2008 TYR 205 OH -0.0083 0.0109 0.0097 2009 TYR 205 H -0.0046 -0.0008 0.0037 2010 TYR 205 HD1 -0.0063 -0.0023 0.0093 2011 TYR 205 HD2 -0.0069 0.0099 0.0062 2012 TYR 205 HE1 -0.0069 0.0012 0.0097 2013 TYR 205 HE2 -0.0078 0.0141 0.0071 2014 TYR 205 HH -0.0076 0.0093 0.0084 2015 LYS 206 N -0.0021 -0.0020 -0.0027 2016 LYS 206 CA -0.0009 -0.0005 -0.0069 2017 LYS 206 C -0.0017 0.0035 -0.0060 2018 LYS 206 O -0.0021 0.0030 -0.0047 2019 LYS 206 CB 0.0005 -0.0042 -0.0093 2020 LYS 206 CG 0.0019 -0.0072 -0.0123 2021 LYS 206 CD 0.0034 -0.0101 -0.0153 2022 LYS 206 CE 0.0047 -0.0139 -0.0174 2023 LYS 206 NZ 0.0040 -0.0169 -0.0143 2024 LYS 206 H -0.0025 -0.0044 -0.0008 2025 LYS 206 HZ1 0.0032 -0.0152 -0.0128 2026 LYS 206 HZ2 0.0032 -0.0177 -0.0118 2027 LYS 206 HZ3 0.0049 -0.0198 -0.0159 2028 HIS 207 N -0.0024 0.0077 -0.0067 2029 HIS 207 CA -0.0031 0.0123 -0.0072 2030 HIS 207 C -0.0016 0.0127 -0.0121 2031 HIS 207 O -0.0005 0.0133 -0.0157 2032 HIS 207 CB -0.0042 0.0163 -0.0063 2033 HIS 207 CG -0.0051 0.0214 -0.0064 2034 HIS 207 CD2 -0.0046 0.0250 -0.0099 2035 HIS 207 ND1 -0.0064 0.0229 -0.0031 2036 HIS 207 CE1 -0.0068 0.0271 -0.0042 2037 HIS 207 NE2 -0.0057 0.0283 -0.0085 2038 HIS 207 H -0.0027 0.0081 -0.0061 2039 HIS 207 HD2 -0.0038 0.0255 -0.0126 2040 HIS 207 HE1 -0.0078 0.0292 -0.0026 2041 HIS 207 HE2 -0.0055 0.0312 -0.0106 2042 ALA 208 N -0.0016 0.0130 -0.0123 2043 ALA 208 CA -0.0002 0.0133 -0.0168 2044 ALA 208 C 0.0004 0.0171 -0.0207 2045 ALA 208 O -0.0006 0.0216 -0.0201 2046 ALA 208 CB -0.0003 0.0135 -0.0163 2047 ALA 208 H -0.0027 0.0141 -0.0096 2048 GLY 209 N 0.0019 0.0156 -0.0255 2049 GLY 209 CA 0.0026 0.0189 -0.0302 2050 GLY 209 C 0.0041 0.0161 -0.0327 2051 GLY 209 O 0.0036 0.0146 -0.0298 2052 GLY 209 H 0.0029 0.0117 -0.0257 2053 THR 210 N 0.0056 0.0163 -0.0377 2054 THR 210 CA 0.0076 0.0133 -0.0413 2055 THR 210 C 0.0072 0.0136 -0.0403 2056 THR 210 O 0.0081 0.0096 -0.0401 2057 THR 210 CB 0.0090 0.0149 -0.0469 2058 THR 210 CG2 0.0102 0.0121 -0.0486 2059 THR 210 OG1 0.0079 0.0204 -0.0479 2060 THR 210 H 0.0056 0.0189 -0.0396 2061 THR 210 HG1 0.0089 0.0211 -0.0516 2062 TYR 211 N 0.0058 0.0181 -0.0393 2063 TYR 211 CA 0.0052 0.0190 -0.0382 2064 TYR 211 C 0.0039 0.0171 -0.0327 2065 TYR 211 O 0.0046 0.0137 -0.0324 2066 TYR 211 CB 0.0040 0.0248 -0.0388 2067 TYR 211 CG 0.0051 0.0275 -0.0442 2068 TYR 211 CD1 0.0055 0.0292 -0.0466 2069 TYR 211 CD2 0.0056 0.0281 -0.0462 2070 TYR 211 CE1 0.0064 0.0318 -0.0515 2071 TYR 211 CE2 0.0067 0.0301 -0.0510 2072 TYR 211 CZ 0.0070 0.0322 -0.0535 2073 TYR 211 OH 0.0078 0.0348 -0.0581 2074 TYR 211 H 0.0054 0.0213 -0.0405 2075 TYR 211 HD1 0.0050 0.0289 -0.0450 2076 TYR 211 HD2 0.0050 0.0272 -0.0438 2077 TYR 211 HE1 0.0063 0.0341 -0.0529 2078 TYR 211 HE2 0.0073 0.0298 -0.0527 2079 TYR 211 HH 0.0076 0.0370 -0.0591 2080 ASP 212 N 0.0025 0.0182 -0.0290 2081 ASP 212 CA 0.0011 0.0168 -0.0237 2082 ASP 212 C 0.0022 0.0111 -0.0227 2083 ASP 212 O 0.0019 0.0088 -0.0202 2084 ASP 212 CB -0.0007 0.0196 -0.0201 2085 ASP 212 CG -0.0023 0.0257 -0.0196 2086 ASP 212 OD1 -0.0029 0.0273 -0.0188 2087 ASP 212 OD2 -0.0030 0.0288 -0.0196 2088 ASP 212 H 0.0021 0.0201 -0.0294 2089 GLN 213 N 0.0027 0.0092 -0.0241 2090 GLN 213 CA 0.0041 0.0037 -0.0240 2091 GLN 213 C 0.0056 0.0004 -0.0259 2092 GLN 213 O 0.0065 -0.0042 -0.0246 2093 GLN 213 CB 0.0055 0.0026 -0.0271 2094 GLN 213 CG 0.0043 0.0031 -0.0241 2095 GLN 213 CD 0.0055 0.0027 -0.0273 2096 GLN 213 NE2 0.0073 -0.0016 -0.0293 2097 GLN 213 OE1 0.0047 0.0063 -0.0278 2098 GLN 213 H 0.0025 0.0116 -0.0256 2099 GLN 213 HE21 0.0078 -0.0047 -0.0283 2100 GLN 213 HE22 0.0085 -0.0013 -0.0328 2101 LYS 214 N 0.0061 0.0030 -0.0293 2102 LYS 214 CA 0.0075 0.0003 -0.0311 2103 LYS 214 C 0.0062 0.0022 -0.0290 2104 LYS 214 O 0.0068 -0.0007 -0.0285 2105 LYS 214 CB 0.0090 0.0018 -0.0367 2106 LYS 214 CG 0.0105 0.0003 -0.0400 2107 LYS 214 CD 0.0121 0.0014 -0.0456 2108 LYS 214 CE 0.0110 0.0073 -0.0471 2109 LYS 214 NZ 0.0126 0.0084 -0.0526 2110 LYS 214 H 0.0055 0.0067 -0.0305 2111 LYS 214 HZ1 0.0135 0.0066 -0.0538 2112 LYS 214 HZ2 0.0119 0.0122 -0.0536 2113 LYS 214 HZ3 0.0136 0.0068 -0.0542 2114 VAL 215 N 0.0049 0.0061 -0.0263 2115 VAL 215 CA 0.0040 0.0080 -0.0252 2116 VAL 215 C 0.0021 0.0089 -0.0206 2117 VAL 215 O 0.0008 0.0125 -0.0196 2118 VAL 215 CB 0.0043 0.0120 -0.0285 2119 VAL 215 CG1 0.0034 0.0141 -0.0274 2120 VAL 215 CG2 0.0063 0.0102 -0.0329 2121 VAL 215 H 0.0045 0.0080 -0.0265 2122 GLN 216 N 0.0019 0.0055 -0.0180 2123 GLN 216 CA 0.0001 0.0063 -0.0137 2124 GLN 216 C -0.0004 0.0060 -0.0123 2125 GLN 216 O -0.0010 0.0094 -0.0128 2126 GLN 216 CB -0.0002 0.0029 -0.0108 2127 GLN 216 CG -0.0001 0.0032 -0.0112 2128 GLN 216 CD -0.0018 0.0071 -0.0091 2129 GLN 216 NE2 -0.0014 0.0097 -0.0117 2130 GLN 216 OE1 -0.0032 0.0072 -0.0054 2131 GLN 216 H 0.0029 0.0025 -0.0188 2132 GLN 216 HE21 -0.0002 0.0092 -0.0147 2133 GLN 216 HE22 -0.0024 0.0128 -0.0112 2134 GLY 217 N 0.0008 0.0011 -0.0119 2135 GLY 217 CA 0.0007 0.0003 -0.0114 2136 GLY 217 C -0.0006 0.0022 -0.0083 2137 GLY 217 O -0.0015 0.0006 -0.0053 2138 GLY 217 H 0.0008 -0.0012 -0.0114 2139 GLY 218 N -0.0007 0.0057 -0.0091 2140 GLY 218 CA -0.0019 0.0075 -0.0065 2141 GLY 218 C -0.0028 0.0111 -0.0051 2142 GLY 218 O -0.0021 0.0133 -0.0076 2143 GLY 218 H -0.0002 0.0073 -0.0112 2144 LYS 219 N -0.0033 0.0108 -0.0018 2145 LYS 219 CA -0.0045 0.0146 -0.0004 2146 LYS 219 C -0.0051 0.0183 -0.0001 2147 LYS 219 CB -0.0063 0.0137 0.0029 2148 LYS 219 CG -0.0059 0.0112 0.0026 2149 LYS 219 CD -0.0048 0.0133 0.0004 2150 LYS 219 CE -0.0064 0.0159 0.0026 2151 LYS 219 NZ -0.0058 0.0189 0.0009 2152 LYS 219 O1 -0.0039 0.0208 -0.0027 2153 LYS 219 O2 -0.0066 0.0180 0.0026 2154 LYS 219 H -0.0039 0.0083 -0.0002 2155 LYS 219 HZ1 -0.0059 0.0182 0.0012 2156 LYS 219 HZ2 -0.0067 0.0216 0.0020 2157 LYS 219 HZ3 -0.0044 0.0193 -0.0017