#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a22 s LYS 234 N 0.00 0.56 0.13 -0.52 2.20 -1.26 -4.84 119.74 116.01 1a22 s LYS 234 Ca 0.00 0.05 -0.31 0.00 -0.36 0.00 0.00 55.97 55.35 1a22 s LYS 234 Cb 0.00 0.26 -0.10 0.00 -1.51 0.00 0.00 37.83 36.49 1a22 s LYS 234 CO 0.00 -0.19 1.70 -0.06 -0.36 0.00 0.00 175.35 176.43 1a22 s PHE 235 N -1.51 2.56 0.02 4.03 0.08 -1.26 -1.31 117.98 120.60 1a22 s PHE 235 Ca 0.01 0.29 -0.13 0.00 0.12 0.00 0.00 56.93 57.22 1a22 s PHE 235 Cb -0.01 -4.05 -0.34 0.00 -0.57 0.00 0.00 43.02 38.06 1a22 s PHE 235 CO -0.01 -4.13 0.96 1.15 -0.10 0.00 0.00 175.22 173.08 1a22 h THR 236 N 4.44 1.25 0.00 0.64 2.02 -0.59 -3.45 112.91 117.22 1a22 h THR 236 Ca -0.44 -2.72 0.00 0.00 0.77 0.00 0.00 66.41 64.03 1a22 h THR 236 Cb 1.21 2.98 0.00 0.00 -1.74 0.00 0.00 68.15 70.60 1a22 h THR 236 CO 0.94 0.83 0.00 2.29 0.37 0.00 0.00 175.52 179.94 1a22 n LYS 237 N -3.67 0.00 -4.92 6.66 -0.00 -0.46 -4.99 118.16 110.78 1a22 n LYS 237 Ca -0.17 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 57.87 1a22 n LYS 237 Cb 1.09 0.00 -0.16 0.00 -0.00 0.00 0.00 35.03 35.97 1a22 n LYS 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1a22 s ARG 239 N -0.29 0.94 -0.23 0.00 1.70 -0.40 -4.90 118.95 115.77 1a22 s ARG 239 Ca 0.04 -0.42 0.02 0.00 -0.47 0.00 0.00 55.73 54.90 1a22 s ARG 239 Cb -0.09 0.42 0.05 0.00 -0.57 0.00 0.00 34.95 34.76 1a22 s ARG 239 CO 0.00 -0.33 -0.13 0.45 -1.08 0.00 0.00 175.30 174.21 1a22 s SER 240 N -2.12 3.88 0.31 -2.89 0.15 -0.85 -1.61 113.70 110.56 1a22 s SER 240 Ca -0.04 -1.09 0.12 0.00 0.70 0.00 0.00 55.95 55.63 1a22 s SER 240 Cb -0.00 -1.46 0.48 0.00 -1.71 0.00 0.00 66.02 63.33 1a22 s SER 240 CO -0.04 -0.13 1.68 1.55 1.20 0.00 0.00 173.24 177.51 1a22 h PRO 241 N 7.86 0.00 0.00 5.44 0.13 -1.74 -1.52 132.00 142.17 1a22 h PRO 241 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1a22 h PRO 241 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1a22 h PRO 241 CO 0.51 0.53 -0.42 -0.85 -0.23 0.00 0.00 178.00 177.55 1a22 n GLU 242 N -3.88 0.12 -1.28 0.86 0.00 -1.26 -3.65 120.64 111.55 1a22 n GLU 242 Ca -0.01 -1.08 -0.10 0.00 0.00 0.00 0.00 57.16 55.97 1a22 n GLU 242 Cb 0.55 -0.58 -0.04 0.00 0.00 0.00 0.00 31.44 31.37 1a22 n GLU 242 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1a22 n ARG 243 N -0.11 -1.03 0.00 3.44 0.63 -1.26 -4.79 116.66 113.54 1a22 n ARG 243 Ca 0.01 0.79 0.00 0.00 -0.92 0.00 0.00 57.85 57.73 1a22 n ARG 243 Cb 0.68 -4.82 0.00 0.00 0.45 0.00 0.00 32.46 28.76 1a22 n ARG 243 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1a22 n GLU 244 N -1.99 2.25 -3.87 -0.14 1.02 -1.26 -4.94 120.64 111.71 1a22 n GLU 244 Ca -0.10 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 56.96 1a22 n GLU 244 Cb 0.41 -0.94 -0.07 0.00 -0.02 0.00 0.00 31.44 30.81 1a22 n GLU 244 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1a22 s THR 245 N -1.84 0.13 0.23 2.62 -4.23 -1.26 -3.89 115.64 107.40 1a22 s THR 245 Ca 0.00 -1.20 -0.10 0.00 -1.18 0.00 0.00 61.69 59.22 1a22 s THR 245 Cb 0.00 -1.41 -0.01 0.00 1.34 0.00 0.00 72.50 72.42 1a22 s THR 245 CO 0.00 -0.59 0.38 0.72 -0.54 0.00 0.00 174.62 174.58 1a22 s PHE 246 N -3.87 0.57 0.12 3.99 -0.71 -1.12 -3.68 117.98 113.27 1a22 s PHE 246 Ca 0.07 -0.89 -0.16 0.00 -1.04 0.00 0.00 56.93 54.90 1a22 s PHE 246 Cb 0.05 -0.02 0.04 0.00 -1.21 0.00 0.00 43.02 41.87 1a22 s PHE 246 CO -0.10 -0.89 0.40 -1.54 -1.34 0.00 0.00 175.22 171.76 1a22 s SER 247 N -3.05 -0.24 0.04 1.98 1.04 -0.63 -0.70 113.70 112.14 1a22 s SER 247 Ca 0.26 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.47 1a22 s SER 247 Cb 0.02 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 1a22 s SER 247 CO 0.09 -0.84 -0.18 0.00 0.98 0.00 0.00 173.24 173.30 1a22 s HIS 249 N -0.80 1.37 0.15 0.00 3.76 0.10 -1.46 115.29 118.41 1a22 s HIS 249 Ca 0.05 -0.44 0.03 0.00 -0.15 0.00 0.00 55.06 54.55 1a22 s HIS 249 Cb -0.08 -0.77 -0.05 0.00 1.11 0.00 0.00 32.58 32.80 1a22 s HIS 249 CO 0.01 0.09 -0.06 1.67 -0.85 0.00 0.00 174.74 175.61 1a22 s TRP 250 N -1.22 1.20 0.00 1.40 -2.14 -0.65 0.13 118.94 117.67 1a22 s TRP 250 Ca 0.00 -0.87 -0.07 0.00 2.66 0.00 0.00 56.10 57.82 1a22 s TRP 250 Cb -0.10 -0.65 -0.04 0.00 -3.10 0.00 0.00 33.47 29.58 1a22 s TRP 250 CO 0.03 -0.05 0.77 1.79 -2.66 0.00 0.00 176.95 176.82 1a22 h THR 251 N 2.77 0.00 0.00 0.66 1.35 -1.50 -3.43 112.91 112.75 1a22 h THR 251 Ca -0.36 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1a22 h THR 251 Cb 1.19 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1a22 h THR 251 CO 0.64 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 176.09 1a22 n LEU 261 N -2.88 0.00 0.00 3.87 4.32 -1.26 -4.58 117.00 116.46 1a22 n LEU 261 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.96 1a22 n LEU 261 Cb 0.09 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.89 1a22 n LEU 261 CO 0.07 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.85 1a22 n GLY 262 N 0.00 -1.60 3.62 -0.72 0.00 -1.26 -2.34 105.19 102.89 1a22 n GLY 262 Ca 0.00 -1.88 -0.44 0.00 0.00 0.00 0.00 46.02 43.70 1a22 n GLY 262 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a22 n PRO 263 N 0.00 2.23 -2.67 1.61 -0.04 -1.26 -4.91 135.00 129.97 1a22 n PRO 263 Ca 0.00 0.73 -0.43 0.00 -0.04 0.00 0.00 63.50 63.76 1a22 n PRO 263 Cb 0.00 -3.01 -0.02 0.00 -0.04 0.00 0.00 33.50 30.42 1a22 n PRO 263 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1a22 s ILE 264 N 6.33 4.73 0.22 0.52 -1.09 -1.26 -4.62 121.20 126.04 1a22 s ILE 264 Ca 0.96 2.02 0.08 0.00 -2.23 0.00 0.00 60.65 61.48 1a22 s ILE 264 Cb -0.46 -4.30 -0.04 0.00 -1.58 0.00 0.00 42.46 36.08 1a22 s ILE 264 CO 0.41 -0.04 0.06 -1.10 -1.23 0.00 0.00 174.94 173.05 1a22 s GLN 265 N 2.29 2.56 -0.09 2.79 -0.21 -0.55 -4.91 119.66 121.53 1a22 s GLN 265 Ca 0.48 -1.17 0.03 0.00 0.02 0.00 0.00 55.36 54.72 1a22 s GLN 265 Cb -0.18 -2.38 0.01 0.00 1.00 0.00 0.00 33.01 31.46 1a22 s GLN 265 CO 0.16 0.41 -0.19 -1.17 -2.12 0.00 0.00 175.29 172.38 1a22 s LEU 266 N -3.44 1.89 0.13 2.90 1.98 -1.26 -0.32 118.68 120.57 1a22 s LEU 266 Ca 0.31 -0.46 0.10 0.00 -2.89 0.00 0.00 54.13 51.19 1a22 s LEU 266 Cb -0.08 -1.18 -0.04 0.00 0.66 0.00 0.00 46.19 45.55 1a22 s LEU 266 CO 0.21 0.09 -0.23 -0.36 -1.89 0.00 0.00 176.35 174.18 1a22 s PHE 267 N 0.58 2.41 0.09 5.38 0.40 -0.09 -0.55 117.98 126.20 1a22 s PHE 267 Ca -0.15 -0.33 -0.09 0.00 -0.60 0.00 0.00 56.93 55.76 1a22 s PHE 267 Cb -0.17 -1.28 0.00 0.00 0.51 0.00 0.00 43.02 42.09 1a22 s PHE 267 CO 0.05 0.38 0.21 1.52 0.70 0.00 0.00 175.22 178.08 1a22 s TYR 268 N -1.17 0.12 0.04 0.36 1.13 -0.48 -0.95 117.35 116.39 1a22 s TYR 268 Ca 0.17 -0.54 -0.18 0.00 -1.41 0.00 0.00 57.07 55.11 1a22 s TYR 268 Cb -0.10 -0.03 0.04 0.00 -1.10 0.00 0.00 41.96 40.76 1a22 s TYR 268 CO 0.08 -0.55 0.41 -0.08 -2.51 0.00 0.00 175.55 172.90 1a22 s THR 269 N -3.82 0.05 0.01 -3.49 -1.32 -0.58 -2.04 115.64 104.45 1a22 s THR 269 Ca 0.04 -0.45 -0.00 0.00 -1.21 0.00 0.00 61.69 60.07 1a22 s THR 269 Cb 0.04 -0.93 -0.01 0.00 -1.51 0.00 0.00 72.50 70.09 1a22 s THR 269 CO -0.11 -0.25 -0.01 0.00 -2.21 0.00 0.00 174.62 172.04 1a22 s ARG 270 N -2.38 0.17 -0.51 7.08 1.70 -1.26 -1.49 118.95 122.26 1a22 s ARG 270 Ca -0.06 -0.32 -0.27 0.00 -0.47 0.00 0.00 55.73 54.61 1a22 s ARG 270 Cb -0.01 0.06 -0.02 0.00 -0.57 0.00 0.00 34.95 34.41 1a22 s ARG 270 CO -0.02 -0.03 1.80 0.50 -1.08 0.00 0.00 175.30 176.47 1a22 s ARG 271 N -0.77 2.93 -0.37 3.89 3.52 -0.82 -4.66 118.95 122.67 1a22 s ARG 271 Ca -0.08 0.89 -0.06 0.00 -0.13 0.00 0.00 55.73 56.35 1a22 s ARG 271 Cb -0.05 -4.30 0.06 0.00 -1.56 0.00 0.00 34.95 29.11 1a22 s ARG 271 CO -0.00 -2.35 0.15 -0.80 -0.81 0.00 0.00 175.30 171.48 1a22 s ASN 272 N 7.09 5.33 0.00 -2.12 0.02 -1.24 -4.78 114.94 119.24 1a22 s ASN 272 Ca 0.70 -1.42 0.00 0.00 -1.02 0.00 0.00 52.86 51.12 1a22 s ASN 272 Cb -0.16 -1.87 0.00 0.00 0.02 0.00 0.00 41.25 39.24 1a22 s ASN 272 CO 0.26 -0.42 0.00 0.41 0.02 0.00 0.00 177.10 177.37 1a22 n THR 273 N 4.78 0.00 -0.07 1.60 -1.04 -1.26 -4.54 114.28 113.74 1a22 n THR 273 Ca -0.10 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.78 1a22 n THR 273 Cb 0.43 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.84 1a22 n THR 273 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1a22 h GLN 274 N 0.00 0.00 -5.67 -2.82 4.20 -2.02 -3.49 115.11 105.31 1a22 h GLN 274 Ca 0.00 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.13 1a22 h GLN 274 Cb 0.00 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 27.65 1a22 h GLN 274 CO 0.00 0.82 -0.64 -2.00 -0.67 0.00 0.00 178.83 176.33 1a22 s GLU 275 N -2.16 1.79 -1.03 1.46 2.12 -1.26 -5.03 118.70 114.59 1a22 s GLU 275 Ca -0.18 -1.96 -0.23 0.00 0.36 0.00 0.00 54.97 52.95 1a22 s GLU 275 Cb -0.00 -1.47 -0.01 0.00 0.26 0.00 0.00 34.13 32.90 1a22 s GLU 275 CO 0.55 0.02 1.76 -1.58 -0.54 0.00 0.00 175.26 175.47 1a22 s TRP 276 N -2.81 2.18 -0.11 5.30 0.52 -1.26 -3.73 118.94 119.03 1a22 s TRP 276 Ca 0.33 -0.13 0.19 0.00 0.02 0.00 0.00 56.10 56.51 1a22 s TRP 276 Cb 0.06 -4.33 -0.29 0.00 -1.15 0.00 0.00 33.47 27.76 1a22 s TRP 276 CO 0.16 -1.73 0.27 0.25 0.02 0.00 0.00 176.95 175.92 1a22 n THR 277 N 7.38 0.64 -2.36 2.01 -2.24 -1.26 -4.95 114.28 113.49 1a22 n THR 277 Ca 0.40 -0.65 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 1a22 n THR 277 Cb 0.48 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 1a22 n THR 277 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a22 s GLN 278 N -2.99 4.36 0.83 -0.78 -2.07 -1.26 -5.00 119.66 112.75 1a22 s GLN 278 Ca -0.09 1.82 -0.11 0.00 -1.82 0.00 0.00 55.36 55.16 1a22 s GLN 278 Cb 0.10 -3.45 0.10 0.00 -1.09 0.00 0.00 33.01 28.67 1a22 s GLN 278 CO 0.84 -0.40 1.15 -1.83 -1.32 0.00 0.00 175.29 173.73 1a22 s GLU 279 N 1.68 1.59 0.25 9.60 -1.05 -1.26 -4.79 118.70 124.72 1a22 s GLU 279 Ca 0.60 1.51 -0.30 0.00 -0.15 0.00 0.00 54.97 56.63 1a22 s GLU 279 Cb -0.29 -1.79 -0.10 0.00 -0.44 0.00 0.00 34.13 31.50 1a22 s GLU 279 CO 0.27 -2.20 1.43 -1.58 0.95 0.00 0.00 175.26 174.13 1a22 s TRP 280 N -2.55 3.03 -0.02 4.83 0.52 -1.26 -4.83 118.94 118.65 1a22 s TRP 280 Ca 0.67 1.05 0.07 0.00 0.02 0.00 0.00 56.10 57.91 1a22 s TRP 280 Cb -0.23 -3.81 -0.02 0.00 -1.15 0.00 0.00 33.47 28.27 1a22 s TRP 280 CO 0.54 -2.61 -0.23 0.15 0.02 0.00 0.00 176.95 174.82 1a22 s LYS 281 N -0.42 1.91 0.62 4.98 1.02 -0.87 -4.93 119.74 122.05 1a22 s LYS 281 Ca 0.59 -0.81 -0.16 0.00 0.02 0.00 0.00 55.97 55.61 1a22 s LYS 281 Cb -0.42 -1.81 -0.02 0.00 -0.52 0.00 0.00 37.83 35.06 1a22 s LYS 281 CO 0.44 0.47 1.08 -2.00 -0.92 0.00 0.00 175.35 174.41 1a22 s GLU 282 N -0.48 3.12 -0.18 1.68 2.12 -1.26 -1.38 118.70 122.33 1a22 s GLU 282 Ca 0.07 1.29 -0.42 0.00 0.36 0.00 0.00 54.97 56.27 1a22 s GLU 282 Cb -0.09 -2.00 -0.20 0.00 0.26 0.00 0.00 34.13 32.10 1a22 s GLU 282 CO -0.00 -0.98 1.30 0.00 -0.54 0.00 0.00 175.26 175.04 1a22 h PRO 284 N 4.01 0.00 -1.58 0.00 0.13 -1.91 -3.43 132.00 129.22 1a22 h PRO 284 Ca -0.48 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 1a22 h PRO 284 Cb 1.40 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.27 1a22 h PRO 284 CO 0.79 0.00 -0.36 0.34 -0.23 0.00 0.00 178.00 178.54 1a22 s ASP 285 N -4.78 -0.57 0.00 1.44 -1.08 -1.26 -5.02 116.67 105.40 1a22 s ASP 285 Ca 0.07 0.65 0.23 0.00 -0.52 0.00 0.00 52.55 52.99 1a22 s ASP 285 Cb 0.10 1.65 0.13 0.00 -1.46 0.00 0.00 42.92 43.35 1a22 s ASP 285 CO 0.53 -0.27 1.21 -1.22 0.52 0.00 0.00 175.17 175.94 1a22 n TYR 286 N 5.40 0.00 -0.09 -5.34 4.01 -1.26 -1.10 117.16 118.77 1a22 n TYR 286 Ca -0.03 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.56 1a22 n TYR 286 Cb 0.50 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.49 1a22 n TYR 286 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1a22 n VAL 287 N 0.97 1.46 -0.22 -0.72 0.31 -1.26 -4.61 118.33 114.26 1a22 n VAL 287 Ca 0.13 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.40 1a22 n VAL 287 Cb 0.56 -2.16 -0.05 0.00 -0.91 0.00 0.00 33.84 31.27 1a22 n VAL 287 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1a22 n SER 288 N -4.32 -0.55 -0.34 4.52 7.64 -1.26 -0.50 113.62 118.81 1a22 n SER 288 Ca -0.24 1.20 0.00 0.00 1.01 0.00 0.00 58.87 60.84 1a22 n SER 288 Cb 0.60 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.54 1a22 n SER 288 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a22 n ALA 289 N -3.20 2.49 0.00 -0.43 0.00 -1.26 -4.99 120.51 113.13 1a22 n ALA 289 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1a22 n ALA 289 Cb 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1a22 n ALA 289 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a22 n GLY 290 N 0.16 -3.03 3.75 0.00 0.00 0.35 -4.78 105.19 101.65 1a22 n GLY 290 Ca 0.00 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 1a22 n GLY 290 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1a22 s GLU 291 N -0.64 4.25 -1.04 1.61 2.12 -1.26 -3.16 118.70 120.58 1a22 s GLU 291 Ca 0.00 2.34 -0.05 0.00 0.36 0.00 0.00 54.97 57.62 1a22 s GLU 291 Cb 0.00 -3.09 0.01 0.00 0.26 0.00 0.00 34.13 31.31 1a22 s GLU 291 CO 0.00 -0.42 0.90 0.09 -0.54 0.00 0.00 175.26 175.29 1a22 n ASN 292 N 1.98 -4.45 -2.69 -1.70 3.02 -1.26 -4.89 115.26 105.27 1a22 n ASN 292 Ca 0.06 -0.45 -0.14 0.00 -0.03 0.00 0.00 54.58 54.02 1a22 n ASN 292 Cb 0.40 -4.11 -0.05 0.00 -0.61 0.00 0.00 39.78 35.41 1a22 n ASN 292 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1a22 n SER 293 N -2.26 -0.73 -3.67 6.41 3.41 -1.19 -1.63 113.62 113.96 1a22 n SER 293 Ca -0.06 -2.64 -0.08 0.00 -0.26 0.00 0.00 58.87 55.82 1a22 n SER 293 Cb 0.57 1.55 -0.09 0.00 -0.26 0.00 0.00 64.21 65.98 1a22 n SER 293 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a22 s TYR 295 N 1.95 3.05 -0.44 0.00 5.04 -0.26 -1.54 117.35 125.15 1a22 s TYR 295 Ca -0.07 -0.34 -0.07 0.00 -2.44 0.00 0.00 57.07 54.16 1a22 s TYR 295 Cb -0.09 -2.02 0.11 0.00 0.35 0.00 0.00 41.96 40.30 1a22 s TYR 295 CO -0.14 -0.11 0.27 -0.06 -1.34 0.00 0.00 175.55 174.17 1a22 s PHE 296 N 0.63 3.45 0.70 4.97 0.08 0.12 -4.07 117.98 123.87 1a22 s PHE 296 Ca -0.01 -1.97 -0.12 0.00 0.12 0.00 0.00 56.93 54.95 1a22 s PHE 296 Cb -0.14 -3.26 0.18 0.00 -0.57 0.00 0.00 43.02 39.22 1a22 s PHE 296 CO 0.02 -0.95 0.51 0.27 -0.10 0.00 0.00 175.22 174.97 1a22 n ASN 297 N 4.81 -2.33 0.13 1.36 0.23 -1.26 -2.81 115.26 115.39 1a22 n ASN 297 Ca -0.07 -0.66 0.17 0.00 -0.53 0.00 0.00 54.58 53.49 1a22 n ASN 297 Cb 0.41 -0.52 0.75 0.00 -2.08 0.00 0.00 39.78 38.34 1a22 n ASN 297 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1a22 h SER 298 N -2.37 0.00 0.74 0.53 0.02 -1.90 -1.56 113.55 109.01 1a22 h SER 298 Ca -0.21 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.69 1a22 h SER 298 Cb 0.67 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 1a22 h SER 298 CO 0.13 0.00 -0.22 0.28 -1.14 0.00 0.00 176.83 175.88 1a22 h SER 299 N 0.00 0.00 -0.01 3.07 0.02 -1.88 -3.07 113.55 111.68 1a22 h SER 299 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1a22 h SER 299 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1a22 h SER 299 CO -0.00 0.22 -0.04 0.49 -1.14 0.00 0.00 176.83 176.36 1a22 n PHE 300 N -3.50 0.00 -4.07 3.45 3.72 -0.64 -4.97 117.46 111.46 1a22 n PHE 300 Ca -0.01 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.05 1a22 n PHE 300 Cb 0.39 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.82 1a22 n PHE 300 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1a22 s THR 301 N -1.10 4.56 0.06 4.37 2.01 -0.88 -4.95 115.64 119.70 1a22 s THR 301 Ca 0.13 -0.11 -0.01 0.00 0.31 0.00 0.00 61.69 62.01 1a22 s THR 301 Cb 0.10 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 1a22 s THR 301 CO 0.18 0.46 -0.01 -0.44 -0.69 0.00 0.00 174.62 174.11 1a22 s SER 302 N 0.48 0.45 0.24 3.53 0.01 -1.26 -4.88 113.70 112.27 1a22 s SER 302 Ca 0.02 -1.04 0.11 0.00 1.31 0.00 0.00 55.95 56.35 1a22 s SER 302 Cb -0.13 0.22 -0.05 0.00 0.21 0.00 0.00 66.02 66.27 1a22 s SER 302 CO 0.01 -0.62 -0.14 -0.63 0.41 0.00 0.00 173.24 172.26 1a22 s ILE 303 N -3.94 2.82 -0.34 1.44 -1.09 -1.26 -4.34 121.20 114.49 1a22 s ILE 303 Ca 0.10 -2.06 0.00 0.00 -2.23 0.00 0.00 60.65 56.47 1a22 s ILE 303 Cb 0.08 -2.44 0.00 0.00 -1.58 0.00 0.00 42.46 38.52 1a22 s ILE 303 CO -0.08 -0.27 0.00 0.79 -1.23 0.00 0.00 174.94 174.15 1a22 n TRP 304 N -0.34 0.00 -4.95 3.97 8.01 -1.26 -4.97 117.44 117.89 1a22 n TRP 304 Ca -0.08 0.00 -0.31 0.00 -1.31 0.00 0.00 57.50 55.80 1a22 n TRP 304 Cb 0.58 -1.59 -0.17 0.00 -2.01 0.00 0.00 31.31 28.12 1a22 n TRP 304 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 1a22 s ILE 305 N -1.61 1.90 0.53 -0.99 1.01 -1.26 -5.08 121.20 115.71 1a22 s ILE 305 Ca 0.00 -0.91 -0.19 0.00 0.00 0.00 0.00 60.65 59.55 1a22 s ILE 305 Cb 0.00 -1.66 -0.06 0.00 0.01 0.00 0.00 42.46 40.74 1a22 s ILE 305 CO 0.00 0.52 1.07 -2.16 0.00 0.00 0.00 174.94 174.38 1a22 s PRO 306 N 0.55 3.52 0.16 2.79 0.04 -1.26 -4.29 135.00 136.50 1a22 s PRO 306 Ca -0.15 1.41 0.06 0.00 0.04 0.00 0.00 61.00 62.36 1a22 s PRO 306 Cb -0.17 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1a22 s PRO 306 CO 0.05 -0.68 -0.12 0.71 0.04 0.00 0.00 177.00 177.01 1a22 s TYR 307 N -2.02 1.41 -0.07 0.56 1.51 0.28 -1.95 117.35 117.07 1a22 s TYR 307 Ca 0.68 -0.69 -0.03 0.00 -1.01 0.00 0.00 57.07 56.02 1a22 s TYR 307 Cb -0.19 -0.69 0.04 0.00 -0.11 0.00 0.00 41.96 41.00 1a22 s TYR 307 CO 0.26 0.17 0.16 0.00 -1.11 0.00 0.00 175.55 175.04 1a22 s ILE 309 N 1.07 1.94 -0.02 0.00 -4.36 0.76 -1.53 121.20 119.06 1a22 s ILE 309 Ca -0.08 -1.74 -0.01 0.00 -0.26 0.00 0.00 60.65 58.56 1a22 s ILE 309 Cb -0.10 -1.79 0.02 0.00 1.25 0.00 0.00 42.46 41.84 1a22 s ILE 309 CO -0.06 -0.10 0.04 -0.54 0.24 0.00 0.00 174.94 174.53 1a22 s LYS 310 N -2.25 -0.01 -0.19 0.37 1.02 -0.13 -0.60 119.74 117.96 1a22 s LYS 310 Ca 0.12 0.17 -0.17 0.00 0.02 0.00 0.00 55.97 56.11 1a22 s LYS 310 Cb -0.09 -0.17 -0.04 0.00 -0.52 0.00 0.00 37.83 37.02 1a22 s LYS 310 CO 0.06 -0.12 0.44 -0.51 -0.92 0.00 0.00 175.35 174.30 1a22 s LEU 311 N 0.78 4.17 0.10 3.17 1.43 0.12 -0.91 118.68 127.55 1a22 s LEU 311 Ca -0.06 0.60 0.09 0.00 -1.03 0.00 0.00 54.13 53.72 1a22 s LEU 311 Cb -0.09 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.50 1a22 s LEU 311 CO -0.02 -0.10 -0.19 -0.89 0.23 0.00 0.00 176.35 175.38 1a22 s THR 312 N 1.32 2.75 0.00 5.49 2.01 0.57 0.95 115.64 128.72 1a22 s THR 312 Ca 0.21 -1.47 0.00 0.00 0.31 0.00 0.00 61.69 60.75 1a22 s THR 312 Cb -0.15 -2.23 -0.00 0.00 0.01 0.00 0.00 72.50 70.13 1a22 s THR 312 CO 0.09 0.15 0.00 -1.54 -0.69 0.00 0.00 174.62 172.63 1a22 n SER 313 N 0.99 0.33 0.01 3.53 3.41 -1.00 -1.48 113.62 119.40 1a22 n SER 313 Ca -0.16 -1.02 0.12 0.00 -0.26 0.00 0.00 58.87 57.56 1a22 n SER 313 Cb 0.53 0.01 0.53 0.00 -0.26 0.00 0.00 64.21 65.02 1a22 n SER 313 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1a22 n ASN 314 N -2.66 0.04 -0.37 4.04 0.23 -0.99 -3.09 115.26 112.47 1a22 n ASN 314 Ca 0.00 0.51 0.11 0.00 -0.53 0.00 0.00 54.58 54.67 1a22 n ASN 314 Cb 0.00 -0.52 0.03 0.00 -2.08 0.00 0.00 39.78 37.22 1a22 n ASN 314 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1a22 n GLY 315 N 1.10 -0.26 0.00 4.83 0.00 -1.26 -4.96 105.19 104.64 1a22 n GLY 315 Ca 0.06 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1a22 n GLY 315 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a22 n GLY 316 N 1.43 0.69 3.58 -0.02 0.00 -1.18 -5.03 105.19 104.66 1a22 n GLY 316 Ca 0.09 -2.29 -0.47 0.00 0.00 0.00 0.00 46.02 43.35 1a22 n GLY 316 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1a22 n THR 317 N -0.50 0.38 0.11 2.61 -1.04 -1.26 -2.39 114.28 112.20 1a22 n THR 317 Ca 0.00 -0.29 0.06 0.00 -2.04 0.00 0.00 64.05 61.78 1a22 n THR 317 Cb 0.00 -2.09 0.01 0.00 -1.82 0.00 0.00 70.33 66.44 1a22 n THR 317 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1a22 h VAL 318 N 6.61 0.38 -1.57 12.58 2.07 0.25 -3.48 116.25 133.09 1a22 h VAL 318 Ca -0.39 -1.63 0.07 0.00 0.82 0.00 0.00 66.70 65.58 1a22 h VAL 318 Cb 1.27 2.00 -0.24 0.00 -1.52 0.00 0.00 31.29 32.81 1a22 h VAL 318 CO 0.97 0.22 0.52 -0.62 0.02 0.00 0.00 177.57 178.68 1a22 s ASP 319 N -5.95 -0.39 0.12 0.57 -1.08 -1.06 -4.78 116.67 104.10 1a22 s ASP 319 Ca 0.01 0.54 0.05 0.00 -0.52 0.00 0.00 52.55 52.63 1a22 s ASP 319 Cb 0.08 0.47 -0.04 0.00 -1.46 0.00 0.00 42.92 41.97 1a22 s ASP 319 CO 0.76 -0.29 -0.12 -0.70 0.52 0.00 0.00 175.17 175.34 1a22 s GLU 320 N -0.71 0.99 -0.29 4.34 2.12 -1.26 0.16 118.70 124.05 1a22 s GLU 320 Ca -0.00 -1.27 -0.14 0.00 0.36 0.00 0.00 54.97 53.91 1a22 s GLU 320 Cb -0.02 -0.75 0.13 0.00 0.26 0.00 0.00 34.13 33.75 1a22 s GLU 320 CO -0.01 0.13 0.80 0.21 -0.54 0.00 0.00 175.26 175.85 1a22 s LYS 321 N -2.95 0.51 -0.04 4.30 2.20 0.23 -4.97 119.74 119.02 1a22 s LYS 321 Ca 0.10 1.07 0.06 0.00 -0.36 0.00 0.00 55.97 56.83 1a22 s LYS 321 Cb -0.03 0.40 -0.02 0.00 -1.51 0.00 0.00 37.83 36.67 1a22 s LYS 321 CO 0.02 -0.14 -0.21 0.00 -0.36 0.00 0.00 175.35 174.66 1a22 s PHE 323 N -0.52 -0.08 -0.04 0.00 -0.12 0.12 -4.97 117.98 112.37 1a22 s PHE 323 Ca 0.07 -0.24 0.06 0.00 -0.05 0.00 0.00 56.93 56.76 1a22 s PHE 323 Cb -0.11 0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 42.92 1a22 s PHE 323 CO 0.01 -0.83 -0.21 -1.54 -0.05 0.00 0.00 175.22 172.59 1a22 s SER 324 N -3.04 2.56 0.43 1.98 1.04 -1.26 0.10 113.70 115.51 1a22 s SER 324 Ca 0.14 -0.41 0.30 0.00 0.48 0.00 0.00 55.95 56.46 1a22 s SER 324 Cb -0.01 -0.55 1.45 0.00 0.10 0.00 0.00 66.02 67.00 1a22 s SER 324 CO 0.03 0.22 1.60 0.58 0.98 0.00 0.00 173.24 176.65 1a22 h VAL 325 N 4.96 0.06 -0.03 5.02 2.07 -1.76 -0.90 116.25 125.68 1a22 h VAL 325 Ca -0.35 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1a22 h VAL 325 Cb 1.16 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1a22 h VAL 325 CO 0.48 0.01 0.03 -2.24 0.02 0.00 0.00 177.57 175.87 1a22 h ASP 326 N 0.05 0.00 1.10 0.57 2.03 -1.94 -0.31 116.42 117.92 1a22 h ASP 326 Ca 0.85 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 57.15 1a22 h ASP 326 Cb 2.67 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 41.17 1a22 h ASP 326 CO -0.47 0.00 -0.30 -0.62 -1.03 0.00 0.00 179.24 176.82 1a22 n GLU 327 N -3.73 0.23 -0.27 4.15 1.02 -0.34 -3.85 120.64 117.84 1a22 n GLU 327 Ca -0.02 0.12 0.07 0.00 -0.02 0.00 0.00 57.16 57.31 1a22 n GLU 327 Cb 0.12 -1.70 0.20 0.00 -0.02 0.00 0.00 31.44 30.04 1a22 n GLU 327 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1a22 n ILE 328 N -2.06 1.33 -1.94 -3.67 -5.35 -0.13 -4.52 119.36 103.02 1a22 n ILE 328 Ca 0.05 -1.20 -0.39 0.00 -0.27 0.00 0.00 62.75 60.93 1a22 n ILE 328 Cb 0.42 0.31 0.01 0.00 -1.74 0.00 0.00 39.64 38.64 1a22 n ILE 328 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1a22 s VAL 329 N -1.45 2.38 -0.33 7.28 1.01 -1.18 -2.01 120.40 126.10 1a22 s VAL 329 Ca 0.30 0.33 -0.07 0.00 0.00 0.00 0.00 61.98 62.54 1a22 s VAL 329 Cb 0.19 -3.19 0.19 0.00 0.00 0.00 0.00 36.38 33.57 1a22 s VAL 329 CO 0.16 0.04 0.98 -1.58 0.00 0.00 0.00 175.10 174.69 1a22 s GLN 330 N -2.45 0.27 0.83 2.72 0.74 -0.57 -3.16 119.66 118.03 1a22 s GLN 330 Ca 0.61 -0.05 -0.12 0.00 0.05 0.00 0.00 55.36 55.85 1a22 s GLN 330 Cb -0.40 0.04 0.09 0.00 1.10 0.00 0.00 33.01 33.85 1a22 s GLN 330 CO 0.50 -0.41 1.18 -2.14 -0.55 0.00 0.00 175.29 173.87 1a22 s PRO 331 N 2.10 1.56 0.96 1.67 0.02 -1.24 -4.24 135.00 135.82 1a22 s PRO 331 Ca 0.16 1.66 -0.12 0.00 0.02 0.00 0.00 61.00 62.72 1a22 s PRO 331 Cb 0.01 -1.78 0.16 0.00 0.02 0.00 0.00 34.50 32.92 1a22 s PRO 331 CO -0.15 -2.25 1.10 -0.51 -0.33 0.00 0.00 177.00 174.86 1a22 s ASP 332 N -2.37 3.04 0.64 2.53 1.01 -1.26 -4.02 116.67 116.24 1a22 s ASP 332 Ca 0.71 1.16 -0.15 0.00 0.71 0.00 0.00 52.55 54.98 1a22 s ASP 332 Cb -0.26 -1.81 -0.01 0.00 1.01 0.00 0.00 42.92 41.85 1a22 s ASP 332 CO 0.52 -2.87 1.08 -2.84 0.21 0.00 0.00 175.17 171.28 1a22 s PRO 333 N -5.06 2.98 0.65 8.23 0.02 -1.26 -4.61 135.00 135.95 1a22 s PRO 333 Ca 0.64 1.27 -0.16 0.00 0.02 0.00 0.00 61.00 62.78 1a22 s PRO 333 Cb -0.17 -1.98 -0.00 0.00 0.02 0.00 0.00 34.50 32.36 1a22 s PRO 333 CO 0.56 -1.09 1.15 -2.14 -0.33 0.00 0.00 177.00 175.15 1a22 s PRO 334 N -4.21 2.74 0.49 5.54 0.02 -1.26 -4.17 135.00 134.15 1a22 s PRO 334 Ca 0.65 1.57 0.00 0.00 0.02 0.00 0.00 61.00 63.24 1a22 s PRO 334 Cb -0.18 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.42 1a22 s PRO 334 CO 0.42 -1.33 0.04 0.44 -0.33 0.00 0.00 177.00 176.24 1a22 n ILE 335 N -2.22 0.00 -2.74 2.83 -5.35 0.23 -4.66 119.36 107.45 1a22 n ILE 335 Ca 0.12 -2.25 -0.17 0.00 -0.27 0.00 0.00 62.75 60.17 1a22 n ILE 335 Cb 0.51 0.40 0.00 0.00 -1.74 0.00 0.00 39.64 38.81 1a22 n ILE 335 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1a22 n ALA 336 N -1.52 -0.86 -1.57 -1.28 0.00 -1.26 0.20 120.51 114.23 1a22 n ALA 336 Ca -0.20 0.13 -0.43 0.00 0.00 0.00 0.00 53.44 52.95 1a22 n ALA 336 Cb 0.61 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1a22 n ALA 336 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1a22 n LEU 337 N -3.24 1.78 -3.57 0.00 7.99 -1.26 -4.38 117.00 114.32 1a22 n LEU 337 Ca -0.12 1.06 -0.06 0.00 -0.01 0.00 0.00 56.01 56.87 1a22 n LEU 337 Cb 0.61 -1.28 -0.02 0.00 -0.11 0.00 0.00 43.42 42.62 1a22 n LEU 337 CO 0.31 -1.76 0.77 0.21 -1.51 0.00 0.00 177.39 175.42 1a22 s ASN 338 N -0.73 -0.27 0.30 -1.43 2.47 0.10 -4.95 114.94 110.43 1a22 s ASN 338 Ca 0.62 -0.08 0.03 0.00 0.42 0.00 0.00 52.86 53.84 1a22 s ASN 338 Cb -0.62 0.35 -0.04 0.00 -1.45 0.00 0.00 41.25 39.49 1a22 s ASN 338 CO 0.58 -0.58 0.13 -1.66 -3.72 0.00 0.00 177.10 171.85 1a22 s TRP 339 N -2.98 1.60 -0.17 0.43 1.48 -1.26 -0.07 118.94 117.97 1a22 s TRP 339 Ca 0.08 -1.29 -0.28 0.00 -1.06 0.00 0.00 56.10 53.54 1a22 s TRP 339 Cb -0.01 -0.90 0.10 0.00 -1.16 0.00 0.00 33.47 31.50 1a22 s TRP 339 CO -0.06 -0.43 0.88 -0.08 -4.06 0.00 0.00 176.95 173.19 1a22 s THR 340 N -3.62 0.00 0.16 0.66 -1.32 -0.38 -4.95 115.64 106.19 1a22 s THR 340 Ca 0.36 0.00 -0.31 0.00 -1.21 0.00 0.00 61.69 60.53 1a22 s THR 340 Cb 0.06 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.96 1a22 s THR 340 CO 0.16 0.00 1.45 -0.76 -2.21 0.00 0.00 174.62 173.26 1a22 s LEU 341 N -0.60 4.38 0.04 9.08 1.43 -1.26 -0.20 118.68 131.54 1a22 s LEU 341 Ca -0.03 2.48 0.01 0.00 -1.03 0.00 0.00 54.13 55.56 1a22 s LEU 341 Cb -0.02 -3.60 -0.26 0.00 0.03 0.00 0.00 46.19 42.35 1a22 s LEU 341 CO 0.02 -0.71 0.97 -0.07 0.23 0.00 0.00 176.35 176.79 1a22 h LEU 342 N 6.44 0.26 0.00 1.79 3.38 -1.33 -3.45 115.31 122.40 1a22 h LEU 342 Ca -0.43 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.20 1a22 h LEU 342 Cb 1.21 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1a22 h LEU 342 CO 0.86 1.28 0.00 -3.20 0.09 0.00 0.00 178.44 177.47 1a22 n ASN 343 N -3.39 0.00 -2.61 -0.43 5.15 -1.16 -5.03 115.26 107.79 1a22 n ASN 343 Ca -0.11 0.00 -0.07 0.00 -0.60 0.00 0.00 54.58 53.79 1a22 n ASN 343 Cb 1.02 0.00 0.04 0.00 -0.53 0.00 0.00 39.78 40.31 1a22 n ASN 343 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1a22 n GLY 348 N 0.07 3.07 0.11 8.20 0.00 -1.26 -2.53 105.19 112.85 1a22 n GLY 348 Ca 0.00 -1.53 -0.06 0.00 0.00 0.00 0.00 46.02 44.43 1a22 n GLY 348 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1a22 h ILE 349 N 4.49 1.54 -2.03 -0.61 5.03 -1.95 -3.43 117.51 120.55 1a22 h ILE 349 Ca 0.01 -2.68 -0.60 0.00 -0.12 0.00 0.00 64.86 61.47 1a22 h ILE 349 Cb 1.33 2.46 -0.12 0.00 -3.03 0.00 0.00 36.82 37.46 1a22 h ILE 349 CO 0.37 0.77 -0.68 -1.00 -0.68 0.00 0.00 178.15 176.93 1a22 s HIS 350 N -3.21 2.45 -0.00 1.37 3.76 -1.26 -1.96 115.29 116.45 1a22 s HIS 350 Ca -0.01 -0.41 -0.15 0.00 -0.15 0.00 0.00 55.06 54.34 1a22 s HIS 350 Cb 0.11 -1.30 0.02 0.00 1.11 0.00 0.00 32.58 32.53 1a22 s HIS 350 CO 0.80 0.59 0.32 0.00 -0.85 0.00 0.00 174.74 175.61 1a22 s ALA 351 N -2.52 -0.81 -0.09 -1.40 0.00 0.20 -4.83 121.76 112.31 1a22 s ALA 351 Ca 0.32 0.30 0.03 0.00 0.00 0.00 0.00 51.96 52.61 1a22 s ALA 351 Cb -0.01 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 1a22 s ALA 351 CO 0.17 -0.30 -0.17 -0.51 0.00 0.00 0.00 175.76 174.96 1a22 s ASP 352 N -1.48 3.74 0.32 0.00 1.11 -1.05 -0.83 116.67 118.48 1a22 s ASP 352 Ca -0.12 -0.35 0.05 0.00 0.18 0.00 0.00 52.55 52.32 1a22 s ASP 352 Cb -0.04 -1.24 -0.06 0.00 1.07 0.00 0.00 42.92 42.65 1a22 s ASP 352 CO 0.03 0.23 0.01 0.27 1.18 0.00 0.00 175.17 176.88 1a22 s ILE 353 N -0.04 1.52 -0.15 0.77 -4.36 -0.51 -0.98 121.20 117.44 1a22 s ILE 353 Ca -0.04 -2.05 -0.00 0.00 -0.26 0.00 0.00 60.65 58.30 1a22 s ILE 353 Cb -0.14 -2.71 0.03 0.00 1.25 0.00 0.00 42.46 40.89 1a22 s ILE 353 CO 0.04 -0.11 -0.09 -1.58 0.24 0.00 0.00 174.94 173.44 1a22 s GLN 354 N -3.79 1.75 -0.02 0.37 0.74 0.72 -1.62 119.66 117.81 1a22 s GLN 354 Ca 0.34 -0.50 -0.09 0.00 0.05 0.00 0.00 55.36 55.16 1a22 s GLN 354 Cb 0.07 -1.97 -0.05 0.00 1.10 0.00 0.00 33.01 32.16 1a22 s GLN 354 CO 0.15 -0.34 0.28 0.08 -0.55 0.00 0.00 175.29 174.91 1a22 s VAL 355 N 1.59 5.27 -0.02 1.34 1.01 -0.38 -1.24 120.40 127.97 1a22 s VAL 355 Ca 0.03 0.37 -0.07 0.00 0.00 0.00 0.00 61.98 62.30 1a22 s VAL 355 Cb -0.14 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1a22 s VAL 355 CO -0.09 0.47 0.16 0.00 0.00 0.00 0.00 175.10 175.64 1a22 s ARG 356 N -1.43 0.42 0.00 2.72 3.03 0.90 -0.58 118.95 124.01 1a22 s ARG 356 Ca 0.24 -0.22 0.00 0.00 2.03 0.00 0.00 55.73 57.78 1a22 s ARG 356 Cb -0.14 0.18 0.00 0.00 -1.03 0.00 0.00 34.95 33.96 1a22 s ARG 356 CO 0.13 -0.10 0.00 -2.67 -1.13 0.00 0.00 175.30 171.53 1a22 n TRP 357 N 1.84 -0.06 -4.18 5.89 2.14 -1.01 0.02 117.44 122.07 1a22 n TRP 357 Ca -0.20 0.00 -0.17 0.00 2.07 0.00 0.00 57.50 59.20 1a22 n TRP 357 Cb 0.56 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 30.95 1a22 n TRP 357 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 1a22 s GLU 358 N -1.94 0.85 0.53 -2.67 2.02 0.54 -4.85 118.70 113.19 1a22 s GLU 358 Ca 0.00 -1.06 -0.18 0.00 0.02 0.00 0.00 54.97 53.74 1a22 s GLU 358 Cb 0.00 -0.73 -0.06 0.00 0.10 0.00 0.00 34.13 33.44 1a22 s GLU 358 CO 0.00 0.14 1.05 0.00 0.02 0.00 0.00 175.26 176.47 1a22 s ALA 359 N -1.80 2.82 0.21 5.21 0.00 -1.26 0.75 121.76 127.68 1a22 s ALA 359 Ca 0.02 0.51 -0.32 0.00 0.00 0.00 0.00 51.96 52.16 1a22 s ALA 359 Cb -0.07 -3.24 -0.13 0.00 0.00 0.00 0.00 23.12 19.68 1a22 s ALA 359 CO 0.02 -0.53 1.58 -0.35 0.00 0.00 0.00 175.76 176.48 1a22 n PRO 360 N -1.44 2.35 0.08 0.00 -0.04 -1.26 -4.45 135.00 130.24 1a22 n PRO 360 Ca 0.09 0.84 0.19 0.00 -0.04 0.00 0.00 63.50 64.59 1a22 n PRO 360 Cb 0.53 -2.61 0.74 0.00 -0.04 0.00 0.00 33.50 32.12 1a22 n PRO 360 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a22 h ARG 361 N 5.56 0.00 0.00 0.54 2.47 -1.92 -2.66 114.38 118.37 1a22 h ARG 361 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 1a22 h ARG 361 Cb 1.24 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.56 1a22 h ARG 361 CO 0.86 0.00 -0.20 0.27 0.56 0.00 0.00 179.97 181.46 1a22 n ASN 362 N -4.03 0.65 -4.61 7.04 0.23 -1.26 -4.80 115.26 108.48 1a22 n ASN 362 Ca 0.07 0.39 -0.43 0.00 -0.53 0.00 0.00 54.58 54.08 1a22 n ASN 362 Cb 0.54 -0.43 -0.02 0.00 -2.08 0.00 0.00 39.78 37.79 1a22 n ASN 362 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1a22 s ALA 363 N -3.10 3.14 -1.10 -2.53 0.00 -1.01 -4.86 121.76 112.31 1a22 s ALA 363 Ca 0.10 -0.24 -0.22 0.00 0.00 0.00 0.00 51.96 51.60 1a22 s ALA 363 Cb 0.14 -3.90 -0.01 0.00 0.00 0.00 0.00 23.12 19.36 1a22 s ALA 363 CO 0.63 -2.24 1.78 0.34 0.00 0.00 0.00 175.76 176.27 1a22 s ASP 364 N 3.17 5.85 -0.08 0.00 2.15 -1.26 -4.64 116.67 121.86 1a22 s ASP 364 Ca 0.55 -1.56 -0.09 0.00 0.43 0.00 0.00 52.55 51.88 1a22 s ASP 364 Cb -0.12 -2.58 -0.28 0.00 -0.30 0.00 0.00 42.92 39.64 1a22 s ASP 364 CO 0.30 -2.16 0.53 0.40 -0.17 0.00 0.00 175.17 174.07 1a22 h ILE 365 N 6.44 0.79 -0.36 4.11 1.08 -1.93 -2.25 117.51 125.38 1a22 h ILE 365 Ca 0.24 -2.43 0.11 0.00 -0.39 0.00 0.00 64.86 62.38 1a22 h ILE 365 Cb 0.95 2.64 -0.01 0.00 -3.07 0.00 0.00 36.82 37.33 1a22 h ILE 365 CO 1.33 0.88 0.32 0.06 -0.69 0.00 0.00 178.15 180.04 1a22 h GLN 366 N 0.09 0.00 -0.20 2.37 -0.00 -1.87 -2.21 115.11 113.28 1a22 h GLN 366 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.27 1a22 h GLN 366 Cb 2.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.55 1a22 h GLN 366 CO 0.13 0.00 0.00 1.63 -0.00 0.00 0.00 178.83 180.59 1a22 n LYS 367 N -4.06 1.78 0.00 0.06 5.02 -1.26 -5.02 118.16 114.69 1a22 n LYS 367 Ca 0.06 -1.71 0.00 0.00 -2.02 0.00 0.00 58.31 54.64 1a22 n LYS 367 Cb 0.49 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.21 1a22 n LYS 367 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1a22 n GLY 368 N 0.76 2.37 0.31 0.72 0.00 -0.83 -4.93 105.19 103.58 1a22 n GLY 368 Ca 0.11 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.31 1a22 n GLY 368 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1a22 h TRP 369 N 0.00 0.00 -3.76 1.61 2.91 -1.81 -3.43 115.95 111.47 1a22 h TRP 369 Ca 0.00 0.00 -0.17 0.00 1.13 0.00 0.00 58.89 59.85 1a22 h TRP 369 Cb 0.00 0.00 -0.22 0.00 -0.51 0.00 0.00 29.16 28.43 1a22 h TRP 369 CO 0.00 0.02 -0.63 -1.64 -1.03 0.00 0.00 178.44 175.16 1a22 s MET 370 N -4.23 0.31 -0.15 2.65 -1.94 -0.85 -4.98 119.30 110.11 1a22 s MET 370 Ca -0.04 -0.41 -0.04 0.00 -1.71 0.00 0.00 55.69 53.49 1a22 s MET 370 Cb 0.13 0.12 0.05 0.00 2.01 0.00 0.00 34.83 37.15 1a22 s MET 370 CO 0.49 -0.06 0.08 0.08 -0.01 0.00 0.00 175.02 175.60 1a22 s VAL 371 N -1.13 -0.02 0.33 -6.03 1.01 -1.26 -4.33 120.40 108.97 1a22 s VAL 371 Ca -0.12 -0.10 0.07 0.00 0.00 0.00 0.00 61.98 61.83 1a22 s VAL 371 Cb -0.07 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 1a22 s VAL 371 CO -0.00 -0.19 0.37 -0.76 0.00 0.00 0.00 175.10 174.52 1a22 s LEU 372 N 2.11 3.79 0.05 3.92 1.43 -1.26 -0.95 118.68 127.78 1a22 s LEU 372 Ca 0.02 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 1a22 s LEU 372 Cb -0.15 -2.47 -0.03 0.00 0.03 0.00 0.00 46.19 43.57 1a22 s LEU 372 CO -0.08 -0.36 -0.08 -1.83 0.23 0.00 0.00 176.35 174.23 1a22 s GLU 373 N -4.06 0.57 0.16 1.70 -1.05 -0.48 -4.79 118.70 110.75 1a22 s GLU 373 Ca 0.42 -0.83 0.10 0.00 -0.15 0.00 0.00 54.97 54.51 1a22 s GLU 373 Cb -0.08 -0.29 -0.04 0.00 -0.44 0.00 0.00 34.13 33.28 1a22 s GLU 373 CO 0.28 0.04 -0.17 0.71 0.95 0.00 0.00 175.26 177.08 1a22 s TYR 374 N -1.64 2.49 -0.14 4.83 1.51 0.10 -2.05 117.35 122.45 1a22 s TYR 374 Ca -0.07 -0.28 0.00 0.00 -1.01 0.00 0.00 57.07 55.71 1a22 s TYR 374 Cb -0.08 -1.27 0.03 0.00 -0.11 0.00 0.00 41.96 40.53 1a22 s TYR 374 CO -0.00 0.46 -0.11 -2.00 -1.11 0.00 0.00 175.55 172.78 1a22 s GLU 375 N -2.51 1.99 -0.02 -0.62 2.12 0.29 -1.27 118.70 118.68 1a22 s GLU 375 Ca 0.21 -0.49 -0.02 0.00 0.36 0.00 0.00 54.97 55.02 1a22 s GLU 375 Cb -0.09 -1.98 -0.04 0.00 0.26 0.00 0.00 34.13 32.28 1a22 s GLU 375 CO 0.11 -0.28 0.13 -1.17 -0.54 0.00 0.00 175.26 173.52 1a22 s LEU 376 N 1.55 4.17 0.01 2.70 0.20 -1.26 -0.66 118.68 125.39 1a22 s LEU 376 Ca 0.04 0.28 0.01 0.00 0.69 0.00 0.00 54.13 55.15 1a22 s LEU 376 Cb -0.13 -2.40 -0.01 0.00 -0.43 0.00 0.00 46.19 43.22 1a22 s LEU 376 CO -0.10 0.29 -0.03 -1.10 -0.29 0.00 0.00 176.35 175.12 1a22 s GLN 377 N -1.73 0.26 0.10 1.98 -0.21 -0.39 -2.38 119.66 117.29 1a22 s GLN 377 Ca 0.24 -0.27 -0.10 0.00 0.02 0.00 0.00 55.36 55.25 1a22 s GLN 377 Cb -0.12 -0.15 0.00 0.00 1.00 0.00 0.00 33.01 33.74 1a22 s GLN 377 CO 0.15 0.03 0.23 1.52 -2.12 0.00 0.00 175.29 175.10 1a22 s TYR 378 N -0.48 0.13 0.10 0.91 1.13 -1.07 -1.49 117.35 116.58 1a22 s TYR 378 Ca -0.04 -0.54 -0.26 0.00 -1.41 0.00 0.00 57.07 54.82 1a22 s TYR 378 Cb -0.04 -0.01 0.08 0.00 -1.10 0.00 0.00 41.96 40.89 1a22 s TYR 378 CO -0.00 -0.59 0.99 -1.59 -2.51 0.00 0.00 175.55 171.85 1a22 s LYS 379 N -3.87 1.03 0.41 -3.49 -2.85 -0.64 -1.14 119.74 109.20 1a22 s LYS 379 Ca 0.06 -0.54 -0.24 0.00 -1.00 0.00 0.00 55.97 54.25 1a22 s LYS 379 Cb 0.04 0.37 -0.09 0.00 -2.06 0.00 0.00 37.83 36.09 1a22 s LYS 379 CO -0.10 -0.47 1.05 -2.00 0.10 0.00 0.00 175.35 173.94 1a22 s GLU 380 N -3.15 4.11 0.67 1.78 -6.30 -1.26 -0.68 118.70 113.87 1a22 s GLU 380 Ca 0.11 1.51 0.45 0.00 -2.50 0.00 0.00 54.97 54.54 1a22 s GLU 380 Cb -0.01 -2.49 2.44 0.00 0.00 0.00 0.00 34.13 34.08 1a22 s GLU 380 CO -0.00 -0.19 2.38 -0.39 0.02 0.00 0.00 175.26 177.07 1a22 h VAL 381 N 2.11 0.01 0.00 3.70 -1.51 -1.56 -2.98 116.25 116.02 1a22 h VAL 381 Ca -0.48 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 1a22 h VAL 381 Cb 1.22 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1a22 h VAL 381 CO 0.62 0.00 -1.22 0.59 -1.23 0.00 0.00 177.57 176.32 1a22 n ASN 382 N -3.09 0.61 -4.92 4.19 3.02 -1.26 -4.94 115.26 108.86 1a22 n ASN 382 Ca -0.03 -0.45 -0.26 0.00 -0.03 0.00 0.00 54.58 53.81 1a22 n ASN 382 Cb 0.07 1.13 0.03 0.00 -0.61 0.00 0.00 39.78 40.41 1a22 n ASN 382 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1a22 s GLU 383 N -3.19 2.83 -0.01 3.52 -1.05 -1.13 -5.03 118.70 114.64 1a22 s GLU 383 Ca 0.03 -0.11 0.14 0.00 -0.15 0.00 0.00 54.97 54.88 1a22 s GLU 383 Cb 0.15 -2.29 -0.19 0.00 -0.44 0.00 0.00 34.13 31.36 1a22 s GLU 383 CO 0.85 -0.73 0.48 0.25 0.95 0.00 0.00 175.26 177.06 1a22 n THR 384 N -2.57 0.00 -3.26 1.83 -2.24 -1.26 -4.87 114.28 101.91 1a22 n THR 384 Ca 0.05 -0.24 -0.21 0.00 -2.27 0.00 0.00 64.05 61.38 1a22 n THR 384 Cb 0.58 0.62 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1a22 n THR 384 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1a22 s LYS 385 N -2.65 3.12 0.11 -0.78 0.00 -1.26 -5.11 119.74 113.17 1a22 s LYS 385 Ca 0.01 -0.73 0.10 0.00 0.00 0.00 0.00 55.97 55.34 1a22 s LYS 385 Cb 0.10 -2.70 -0.04 0.00 0.00 0.00 0.00 37.83 35.20 1a22 s LYS 385 CO 0.60 -0.07 -0.25 -1.58 0.00 0.00 0.00 175.35 174.04 1a22 s TRP 386 N -2.35 2.16 -0.22 1.78 0.52 -1.26 -4.79 118.94 114.78 1a22 s TRP 386 Ca 0.46 -0.39 -0.17 0.00 0.02 0.00 0.00 56.10 56.02 1a22 s TRP 386 Cb -0.10 -1.19 -0.03 0.00 -1.15 0.00 0.00 33.47 31.00 1a22 s TRP 386 CO 0.34 0.28 0.47 0.15 0.02 0.00 0.00 176.95 178.21 1a22 s LYS 387 N -1.94 4.14 0.72 4.98 1.02 -0.29 -4.95 119.74 123.42 1a22 s LYS 387 Ca 0.12 0.29 -0.09 0.00 0.02 0.00 0.00 55.97 56.30 1a22 s LYS 387 Cb -0.10 -3.58 0.05 0.00 -0.52 0.00 0.00 37.83 33.67 1a22 s LYS 387 CO 0.05 -0.18 1.07 -1.64 -0.92 0.00 0.00 175.35 173.74 1a22 s MET 388 N 1.74 2.38 -0.01 1.68 -1.94 -1.26 -2.61 119.30 119.27 1a22 s MET 388 Ca 0.21 0.08 0.00 0.00 -1.71 0.00 0.00 55.69 54.27 1a22 s MET 388 Cb -0.15 -2.07 0.02 0.00 2.01 0.00 0.00 34.83 34.63 1a22 s MET 388 CO 0.09 -1.24 0.02 -1.64 -0.01 0.00 0.00 175.02 172.24 1a22 s MET 389 N -5.35 -0.01 0.31 2.03 -1.94 -1.00 -4.96 119.30 108.37 1a22 s MET 389 Ca 0.59 0.10 -0.26 0.00 -1.71 0.00 0.00 55.69 54.41 1a22 s MET 389 Cb -0.11 -0.14 -0.14 0.00 2.01 0.00 0.00 34.83 36.45 1a22 s MET 389 CO 0.48 -0.09 0.77 -0.25 -0.01 0.00 0.00 175.02 175.92 1a22 n ASP 390 N 3.67 0.13 -4.69 3.03 8.00 -1.26 -4.34 116.55 121.09 1a22 n ASP 390 Ca -0.21 1.09 -0.41 0.00 0.71 0.00 0.00 54.79 55.98 1a22 n ASP 390 Cb 0.55 -1.16 0.02 0.00 -0.02 0.00 0.00 41.12 40.50 1a22 n ASP 390 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1a22 n PRO 391 N 0.74 1.79 -4.25 -0.24 -0.04 -1.26 -4.80 135.00 126.93 1a22 n PRO 391 Ca 0.12 0.64 -0.21 0.00 -0.04 0.00 0.00 63.50 64.01 1a22 n PRO 391 Cb 0.32 -2.35 -0.12 0.00 -0.04 0.00 0.00 33.50 31.31 1a22 n PRO 391 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1a22 s ILE 392 N -1.23 1.32 -1.24 0.52 -4.36 -0.40 -4.92 121.20 110.90 1a22 s ILE 392 Ca 0.63 -1.34 0.27 0.00 -0.26 0.00 0.00 60.65 59.95 1a22 s ILE 392 Cb -0.50 -1.23 0.17 0.00 1.25 0.00 0.00 42.46 42.15 1a22 s ILE 392 CO 0.56 -0.13 1.62 0.18 0.24 0.00 0.00 174.94 177.42 1a22 n LEU 393 N 1.32 0.48 -4.80 0.37 4.77 -1.26 -0.72 117.00 117.16 1a22 n LEU 393 Ca -0.20 0.05 -0.22 0.00 -0.03 0.00 0.00 56.01 55.61 1a22 n LEU 393 Cb 0.54 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.31 1a22 n LEU 393 CO 0.22 0.11 -0.09 0.28 -1.33 0.00 0.00 177.39 176.57 1a22 s THR 394 N -2.82 2.68 -0.39 -5.08 -1.32 -1.26 -4.92 115.64 102.54 1a22 s THR 394 Ca 0.17 -1.52 0.06 0.00 -1.21 0.00 0.00 61.69 59.18 1a22 s THR 394 Cb 0.19 -3.01 0.55 0.00 -1.51 0.00 0.00 72.50 68.71 1a22 s THR 394 CO 0.60 -0.05 1.65 0.35 -2.21 0.00 0.00 174.62 174.96 1a22 n THR 395 N -1.36 2.89 -3.74 5.08 -2.24 -1.26 -4.78 114.28 108.87 1a22 n THR 395 Ca 0.00 -2.63 -0.13 0.00 -2.27 0.00 0.00 64.05 59.02 1a22 n THR 395 Cb 0.62 -0.52 -0.09 0.00 -2.10 0.00 0.00 70.33 68.24 1a22 n THR 395 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1a22 s SER 396 N -2.16 -0.30 -0.28 3.42 0.01 -1.26 -2.42 113.70 110.71 1a22 s SER 396 Ca 0.51 0.42 -0.17 0.00 1.31 0.00 0.00 55.95 58.03 1a22 s SER 396 Cb 0.44 0.53 0.09 0.00 0.21 0.00 0.00 66.02 67.30 1a22 s SER 396 CO 0.03 -0.31 0.76 0.54 0.41 0.00 0.00 173.24 174.68 1a22 s VAL 397 N -0.61 0.00 0.37 3.43 0.11 0.25 -4.98 120.40 118.97 1a22 s VAL 397 Ca -0.07 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.84 1a22 s VAL 397 Cb -0.04 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.73 1a22 s VAL 397 CO 0.03 0.00 0.77 -2.16 -3.33 0.00 0.00 175.10 170.41 1a22 s PRO 398 N 1.47 3.92 -0.17 1.54 0.04 -1.26 -1.24 135.00 139.30 1a22 s PRO 398 Ca -0.09 0.63 0.01 0.00 0.04 0.00 0.00 61.00 61.59 1a22 s PRO 398 Cb -0.05 -2.39 0.02 0.00 0.04 0.00 0.00 34.50 32.12 1a22 s PRO 398 CO -0.17 0.05 -0.19 0.08 0.04 0.00 0.00 177.00 176.80 1a22 s VAL 399 N -2.18 1.96 0.22 -0.36 1.01 -0.64 -4.94 120.40 115.48 1a22 s VAL 399 Ca 0.54 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.67 1a22 s VAL 399 Cb -0.10 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1a22 s VAL 399 CO 0.23 0.52 0.35 -0.31 0.00 0.00 0.00 175.10 175.90 1a22 s TYR 400 N 1.26 3.46 -1.48 5.22 2.02 -1.26 -1.42 117.35 125.14 1a22 s TYR 400 Ca 0.03 0.03 -0.09 0.00 -0.37 0.00 0.00 57.07 56.68 1a22 s TYR 400 Cb -0.13 -1.61 0.06 0.00 -0.40 0.00 0.00 41.96 39.88 1a22 s TYR 400 CO -0.11 0.44 0.77 0.43 -1.57 0.00 0.00 175.55 175.52 1a22 n SER 401 N -1.22 -2.80 -4.74 2.29 7.64 -1.15 -4.97 113.62 108.66 1a22 n SER 401 Ca -0.08 -0.87 -0.40 0.00 1.01 0.00 0.00 58.87 58.52 1a22 n SER 401 Cb 0.56 -3.58 -0.05 0.00 -1.01 0.00 0.00 64.21 60.13 1a22 n SER 401 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1a22 s LEU 402 N -7.07 4.58 -0.13 -3.43 1.43 -0.01 -4.77 118.68 109.28 1a22 s LEU 402 Ca 0.39 1.92 -0.29 0.00 -1.03 0.00 0.00 54.13 55.11 1a22 s LEU 402 Cb -0.20 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 1a22 s LEU 402 CO 0.85 0.03 1.08 -0.54 0.23 0.00 0.00 176.35 178.01 1a22 s LYS 403 N -0.70 4.35 0.56 1.70 1.02 -1.26 -0.63 119.74 124.78 1a22 s LYS 403 Ca 0.44 1.48 0.31 0.00 0.02 0.00 0.00 55.97 58.21 1a22 s LYS 403 Cb -0.26 -3.59 1.64 0.00 -0.52 0.00 0.00 37.83 35.10 1a22 s LYS 403 CO 0.32 -0.45 2.14 -0.39 -0.92 0.00 0.00 175.35 176.04 1a22 h VAL 404 N 5.19 0.44 -0.09 3.17 -1.51 -1.70 -2.51 116.25 119.25 1a22 h VAL 404 Ca -0.29 -0.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 1a22 h VAL 404 Cb 1.13 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 31.54 1a22 h VAL 404 CO 0.90 0.07 0.00 -0.90 -1.23 0.00 0.00 177.57 176.41 1a22 n ASP 405 N -3.56 0.58 -4.18 4.19 5.75 -1.26 -4.53 116.55 113.53 1a22 n ASP 405 Ca -0.02 -1.80 -0.22 0.00 -0.01 0.00 0.00 54.79 52.74 1a22 n ASP 405 Cb 0.19 -0.06 -0.13 0.00 -1.03 0.00 0.00 41.12 40.09 1a22 n ASP 405 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1a22 s LYS 406 N -1.88 1.08 -0.01 0.11 1.02 -0.95 -5.14 119.74 113.98 1a22 s LYS 406 Ca 0.16 -0.84 -0.14 0.00 0.02 0.00 0.00 55.97 55.17 1a22 s LYS 406 Cb 0.08 -1.13 -0.06 0.00 -0.52 0.00 0.00 37.83 36.20 1a22 s LYS 406 CO 0.12 0.28 0.40 -2.00 -0.92 0.00 0.00 175.35 173.23 1a22 s GLU 407 N -1.20 3.90 0.39 1.68 2.12 -1.26 -4.61 118.70 119.72 1a22 s GLU 407 Ca 0.04 0.39 0.08 0.00 0.36 0.00 0.00 54.97 55.83 1a22 s GLU 407 Cb -0.08 -3.22 -0.07 0.00 0.26 0.00 0.00 34.13 31.02 1a22 s GLU 407 CO 0.02 0.69 0.04 0.71 -0.54 0.00 0.00 175.26 176.18 1a22 s TYR 408 N -1.06 2.53 0.06 5.30 1.51 -0.82 -1.45 117.35 123.43 1a22 s TYR 408 Ca 0.23 -0.60 0.06 0.00 -1.01 0.00 0.00 57.07 55.75 1a22 s TYR 408 Cb -0.16 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1a22 s TYR 408 CO 0.13 0.40 -0.16 -1.21 -1.11 0.00 0.00 175.55 173.60 1a22 s GLU 409 N -3.75 1.00 -0.04 -0.62 2.02 0.15 -0.71 118.70 116.75 1a22 s GLU 409 Ca 0.36 -0.89 -0.05 0.00 0.02 0.00 0.00 54.97 54.40 1a22 s GLU 409 Cb 0.06 -1.06 0.01 0.00 0.10 0.00 0.00 34.13 33.24 1a22 s GLU 409 CO 0.19 0.26 0.14 0.08 0.02 0.00 0.00 175.26 175.94 1a22 s VAL 410 N -1.00 0.02 -0.09 2.63 1.01 -0.21 -1.62 120.40 121.14 1a22 s VAL 410 Ca 0.02 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.73 1a22 s VAL 410 Cb -0.09 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.06 1a22 s VAL 410 CO 0.02 -0.10 0.26 0.00 0.00 0.00 0.00 175.10 175.28 1a22 s ARG 411 N -0.29 0.32 0.08 2.72 1.70 -0.56 -0.06 118.95 122.87 1a22 s ARG 411 Ca -0.04 0.33 0.09 0.00 -0.47 0.00 0.00 55.73 55.64 1a22 s ARG 411 Cb -0.03 0.16 -0.03 0.00 -0.57 0.00 0.00 34.95 34.48 1a22 s ARG 411 CO 0.00 -0.04 -0.23 0.08 -1.08 0.00 0.00 175.30 174.03 1a22 s VAL 412 N 0.05 1.88 0.09 4.99 1.01 -1.26 -1.27 120.40 125.90 1a22 s VAL 412 Ca -0.01 -1.45 0.03 0.00 0.00 0.00 0.00 61.98 60.55 1a22 s VAL 412 Cb -0.02 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1a22 s VAL 412 CO 0.01 0.12 -0.10 0.00 0.00 0.00 0.00 175.10 175.13 1a22 s ARG 413 N -1.60 0.83 0.23 2.72 1.70 0.16 -0.60 118.95 122.39 1a22 s ARG 413 Ca 0.09 -1.16 0.05 0.00 -0.47 0.00 0.00 55.73 54.25 1a22 s ARG 413 Cb -0.10 -0.48 -0.05 0.00 -0.57 0.00 0.00 34.95 33.75 1a22 s ARG 413 CO 0.03 0.07 -0.06 -1.54 -1.08 0.00 0.00 175.30 172.72 1a22 s SER 414 N -2.47 2.26 -0.08 -2.89 1.04 -1.26 -0.55 113.70 109.75 1a22 s SER 414 Ca 0.05 -1.15 -0.20 0.00 0.48 0.00 0.00 55.95 55.13 1a22 s SER 414 Cb -0.02 -0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.07 1a22 s SER 414 CO -0.01 -0.38 0.48 -1.59 0.98 0.00 0.00 173.24 172.72 1a22 s LYS 415 N -3.77 0.75 0.15 4.02 -2.85 -0.87 -2.10 119.74 115.08 1a22 s LYS 415 Ca 0.26 0.22 -0.31 0.00 -1.00 0.00 0.00 55.97 55.14 1a22 s LYS 415 Cb 0.04 0.35 -0.09 0.00 -2.06 0.00 0.00 37.83 36.06 1a22 s LYS 415 CO 0.08 -0.19 1.47 -1.14 0.10 0.00 0.00 175.35 175.67 1a22 s GLN 416 N -0.78 4.27 0.29 1.78 2.00 -1.25 -1.38 119.66 124.60 1a22 s GLN 416 Ca -0.08 2.22 -0.30 0.00 -2.00 0.00 0.00 55.36 55.20 1a22 s GLN 416 Cb -0.03 -3.19 -0.12 0.00 0.80 0.00 0.00 33.01 30.47 1a22 s GLN 416 CO 0.05 -0.50 1.47 0.54 -0.50 0.00 0.00 175.29 176.35 1a22 n ARG 417 N 3.73 2.37 -1.38 1.67 5.12 -0.12 -2.44 116.66 125.62 1a22 n ARG 417 Ca 0.12 0.84 -0.14 0.00 -1.93 0.00 0.00 57.85 56.74 1a22 n ARG 417 Cb 0.40 -2.54 -0.06 0.00 -1.16 0.00 0.00 32.46 29.10 1a22 n ARG 417 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1a22 n ASN 418 N 1.75 -3.80 -3.68 0.55 5.03 -1.26 -4.92 115.26 108.93 1a22 n ASN 418 Ca 0.08 0.34 -0.12 0.00 0.87 0.00 0.00 54.58 55.75 1a22 n ASN 418 Cb 0.35 -3.45 -0.09 0.00 -1.02 0.00 0.00 39.78 35.57 1a22 n ASN 418 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1a22 s SER 419 N -2.18 -0.61 0.19 6.41 0.01 -1.02 -5.13 113.70 111.39 1a22 s SER 419 Ca 0.00 1.12 0.00 0.00 1.31 0.00 0.00 55.95 58.38 1a22 s SER 419 Cb 0.00 1.11 0.00 0.00 0.21 0.00 0.00 66.02 67.34 1a22 s SER 419 CO 0.00 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.06 1a22 n GLY 420 N 3.14 -0.88 2.68 3.44 0.00 -1.26 -3.94 105.19 108.37 1a22 n GLY 420 Ca -0.15 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 44.47 1a22 n GLY 420 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a22 n ASN 421 N -0.45 1.80 -4.75 1.61 6.94 -1.19 -5.00 115.26 114.22 1a22 n ASN 421 Ca 0.00 -2.70 -0.40 0.00 -0.02 0.00 0.00 54.58 51.46 1a22 n ASN 421 Cb 0.00 0.63 -0.05 0.00 -2.36 0.00 0.00 39.78 38.00 1a22 n ASN 421 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1a22 s TYR 422 N -2.63 3.78 0.05 -2.53 2.02 -1.26 -4.58 117.35 112.20 1a22 s TYR 422 Ca 0.11 1.54 -0.01 0.00 -0.37 0.00 0.00 57.07 58.34 1a22 s TYR 422 Cb 0.01 -2.83 0.01 0.00 -0.40 0.00 0.00 41.96 38.75 1a22 s TYR 422 CO 0.08 0.32 0.07 0.41 -1.57 0.00 0.00 175.55 174.85 1a22 n GLY 423 N 2.21 -0.95 3.71 0.71 0.00 -0.89 -4.97 105.19 105.01 1a22 n GLY 423 Ca -0.03 -1.70 -0.31 0.00 0.00 0.00 0.00 46.02 43.98 1a22 n GLY 423 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a22 s GLU 424 N -3.09 1.55 0.33 1.61 0.41 -1.26 -4.66 118.70 113.60 1a22 s GLU 424 Ca 0.04 1.39 -0.12 0.00 -0.41 0.00 0.00 54.97 55.86 1a22 s GLU 424 Cb -0.00 -1.80 -0.08 0.00 -1.78 0.00 0.00 34.13 30.47 1a22 s GLU 424 CO 0.03 -2.21 0.71 -0.06 -0.49 0.00 0.00 175.26 173.24 1a22 s PHE 425 N -2.76 3.41 1.03 1.61 0.08 -1.26 -4.14 117.98 115.95 1a22 s PHE 425 Ca 0.64 1.09 -0.14 0.00 0.12 0.00 0.00 56.93 58.64 1a22 s PHE 425 Cb -0.20 -2.45 0.21 0.00 -0.57 0.00 0.00 43.02 40.01 1a22 s PHE 425 CO 0.57 0.07 1.11 -1.54 -0.10 0.00 0.00 175.22 175.33 1a22 s SER 426 N -2.57 2.34 0.48 1.36 1.04 0.23 -4.80 113.70 111.79 1a22 s SER 426 Ca 0.52 1.00 -0.22 0.00 0.48 0.00 0.00 55.95 57.73 1a22 s SER 426 Cb -0.10 -1.56 -0.07 0.00 0.10 0.00 0.00 66.02 64.39 1a22 s SER 426 CO 0.22 -3.28 1.16 -0.70 0.98 0.00 0.00 173.24 171.62 1a22 s GLU 427 N -5.12 3.63 0.63 4.02 2.56 -1.26 -4.65 118.70 118.52 1a22 s GLU 427 Ca 0.67 1.75 -0.17 0.00 0.00 0.00 0.00 54.97 57.22 1a22 s GLU 427 Cb -0.16 -2.30 -0.01 0.00 2.00 0.00 0.00 34.13 33.66 1a22 s GLU 427 CO 0.57 -0.65 1.16 0.14 -0.56 0.00 0.00 175.26 175.92 1a22 s VAL 428 N -1.59 2.83 -0.27 3.70 -7.23 -1.26 -4.78 120.40 111.80 1a22 s VAL 428 Ca 0.66 0.45 -0.02 0.00 -1.81 0.00 0.00 61.98 61.26 1a22 s VAL 428 Cb -0.28 -3.06 0.04 0.00 0.56 0.00 0.00 36.38 33.63 1a22 s VAL 428 CO 0.33 -0.17 -0.03 -0.22 -0.31 0.00 0.00 175.10 174.70 1a22 s LEU 429 N -4.50 3.51 0.06 1.32 0.20 0.92 -4.92 118.68 115.27 1a22 s LEU 429 Ca 0.73 -1.03 -0.22 0.00 0.69 0.00 0.00 54.13 54.30 1a22 s LEU 429 Cb -0.26 -1.69 -0.06 0.00 -0.43 0.00 0.00 46.19 43.74 1a22 s LEU 429 CO 0.37 -0.18 0.65 -0.31 -0.29 0.00 0.00 176.35 176.58 1a22 s TYR 430 N 1.30 3.77 -0.26 5.38 2.02 -1.26 -1.05 117.35 127.25 1a22 s TYR 430 Ca -0.02 1.35 0.02 0.00 -0.37 0.00 0.00 57.07 58.05 1a22 s TYR 430 Cb -0.18 -2.64 0.07 0.00 -0.40 0.00 0.00 41.96 38.81 1a22 s TYR 430 CO -0.03 0.45 -0.06 0.08 -1.57 0.00 0.00 175.55 174.42 1a22 s VAL 431 N -0.64 1.88 -0.29 0.71 1.01 0.12 -4.98 120.40 118.20 1a22 s VAL 431 Ca 0.32 -1.55 -0.04 0.00 0.00 0.00 0.00 61.98 60.72 1a22 s VAL 431 Cb -0.20 -2.11 0.03 0.00 0.00 0.00 0.00 36.38 34.10 1a22 s VAL 431 CO 0.20 -0.15 0.02 -0.89 0.00 0.00 0.00 175.10 174.28 1a22 s THR 432 N 1.21 3.40 0.63 3.92 2.01 -1.26 -1.94 115.64 123.61 1a22 s THR 432 Ca -0.05 -1.00 -0.11 0.00 0.31 0.00 0.00 61.69 60.84 1a22 s THR 432 Cb -0.19 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.47 1a22 s THR 432 CO -0.07 0.04 1.03 -0.76 -0.69 0.00 0.00 174.62 174.18 1a22 s LEU 433 N 1.38 3.23 0.10 4.42 2.01 -1.26 -5.05 118.68 123.51 1a22 s LEU 433 Ca -0.00 1.48 -0.30 0.00 0.01 0.00 0.00 54.13 55.31 1a22 s LEU 433 Cb -0.18 -4.48 -0.06 0.00 0.01 0.00 0.00 46.19 41.49 1a22 s LEU 433 CO -0.00 -0.98 1.03 -2.84 1.01 0.00 0.00 176.35 174.57 1a22 s PRO 434 N -5.08 4.61 -0.17 1.29 0.02 -1.26 -4.95 135.00 129.46 1a22 s PRO 434 Ca 0.56 1.56 -0.00 0.00 0.02 0.00 0.00 61.00 63.14 1a22 s PRO 434 Cb -0.12 -3.36 0.00 0.00 0.02 0.00 0.00 34.50 31.05 1a22 s PRO 434 CO 0.53 0.07 -0.14 -1.14 -0.33 0.00 0.00 177.00 175.99 1a22 s GLN 435 N 0.20 3.20 -0.52 5.54 0.74 -1.26 -4.96 119.66 122.60 1a22 s GLN 435 Ca 0.50 -0.74 -0.20 0.00 0.05 0.00 0.00 55.36 54.96 1a22 s GLN 435 Cb -0.25 -2.68 0.06 0.00 1.10 0.00 0.00 33.01 31.23 1a22 s GLN 435 CO 0.31 -0.07 0.70 -1.64 -0.55 0.00 0.00 175.29 174.04 1a22 s MET 436 N 1.04 3.17 0.00 1.67 -1.94 -1.26 -5.18 119.30 116.79 1a22 s MET 436 Ca -0.01 -0.76 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 1a22 s MET 436 Cb -0.15 -4.09 0.00 0.00 2.01 0.00 0.00 34.83 32.60 1a22 s MET 436 CO -0.04 -1.29 0.40 0.43 -0.01 0.00 0.00 175.02 174.51