#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bfv n LYS 198 N 0.00 3.63 -2.60 -1.24 5.02 -1.26 -4.96 118.16 116.74 3bfv n LYS 198 Ca 0.00 -2.65 -0.40 0.00 -2.02 0.00 0.00 58.31 53.24 3bfv n LYS 198 Cb 0.00 -2.11 -0.05 0.00 -0.02 0.00 0.00 35.03 32.85 3bfv n LYS 198 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3bfv s ARG 199 N -2.60 4.70 -0.41 1.97 0.52 -1.23 0.13 118.95 122.03 3bfv s ARG 199 Ca 0.47 1.64 -0.29 0.00 -0.52 0.00 0.00 55.73 57.03 3bfv s ARG 199 Cb 0.37 -3.17 0.01 0.00 0.52 0.00 0.00 34.95 32.69 3bfv s ARG 199 CO 0.12 0.32 1.37 0.42 0.02 0.00 0.00 175.30 177.55 3bfv s ILE 200 N -1.22 3.96 -0.14 1.52 -1.09 -1.26 -4.87 121.20 118.10 3bfv s ILE 200 Ca 0.44 0.99 0.16 0.00 -2.23 0.00 0.00 60.65 60.02 3bfv s ILE 200 Cb -0.28 -4.25 -0.23 0.00 -1.58 0.00 0.00 42.46 36.12 3bfv s ILE 200 CO 0.36 -0.76 0.13 0.29 -1.23 0.00 0.00 174.94 173.73 3bfv n LYS 201 N 7.97 1.05 -2.83 2.79 5.02 -1.26 -4.42 118.16 126.48 3bfv n LYS 201 Ca 0.16 -0.04 -0.05 0.00 -2.02 0.00 0.00 58.31 56.35 3bfv n LYS 201 Cb 0.48 -1.44 0.02 0.00 -0.02 0.00 0.00 35.03 34.06 3bfv n LYS 201 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3bfv n ASP 202 N -2.54 -1.43 -0.21 4.39 5.68 -1.26 -4.87 116.55 116.32 3bfv n ASP 202 Ca -0.23 -1.96 -0.02 0.00 -0.50 0.00 0.00 54.79 52.08 3bfv n ASP 202 Cb 0.94 2.38 0.09 0.00 -1.14 0.00 0.00 41.12 43.39 3bfv n ASP 202 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3bfv h GLU 203 N 0.00 0.54 -0.58 0.11 3.07 -1.99 -1.59 114.58 114.13 3bfv h GLU 203 Ca -0.21 -0.03 0.03 0.00 -0.50 0.00 0.00 59.36 58.65 3bfv h GLU 203 Cb 0.80 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.55 3bfv h GLU 203 CO 0.27 0.35 0.35 1.49 -1.40 0.00 0.00 179.01 180.07 3bfv h GLU 204 N 0.55 0.66 -0.86 2.33 4.81 -1.99 -1.43 114.58 118.65 3bfv h GLU 204 Ca 0.28 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 3bfv h GLU 204 Cb 0.24 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 3bfv h GLU 204 CO -0.22 0.44 0.49 -0.44 -0.73 0.00 0.00 179.01 178.55 3bfv h ASP 205 N 0.68 1.06 -0.06 1.04 3.32 -1.79 0.11 116.42 120.78 3bfv h ASP 205 Ca 0.24 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 3bfv h ASP 205 Cb 0.05 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 3bfv h ASP 205 CO -0.11 0.84 0.03 0.58 -1.72 0.00 0.00 179.24 178.86 3bfv h VAL 206 N 1.19 1.12 0.27 -1.35 2.07 -0.90 0.24 116.25 118.88 3bfv h VAL 206 Ca 0.30 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 3bfv h VAL 206 Cb 0.01 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3bfv h VAL 206 CO -0.05 0.10 -0.16 -0.33 0.02 0.00 0.00 177.57 177.15 3bfv h GLU 207 N -0.04 -0.39 0.01 1.57 5.08 -1.05 -1.31 114.58 118.45 3bfv h GLU 207 Ca 0.02 0.03 -0.25 0.00 -1.00 0.00 0.00 59.36 58.16 3bfv h GLU 207 Cb 0.13 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.48 3bfv h GLU 207 CO -0.00 -0.26 -1.01 0.87 -1.00 0.00 0.00 179.01 177.60 3bfv h LYS 208 N -0.41 0.54 0.00 2.33 1.57 -0.76 -1.71 116.57 118.13 3bfv h LYS 208 Ca -0.03 -0.60 -0.29 0.00 -1.87 0.00 0.00 60.65 57.86 3bfv h LYS 208 Cb 0.33 0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.76 3bfv h LYS 208 CO 0.04 1.22 -1.95 0.39 -0.57 0.00 0.00 179.45 178.57 3bfv n GLU 209 N -3.79 0.65 -0.00 3.15 -0.58 0.82 -4.53 120.64 116.37 3bfv n GLU 209 Ca -0.09 0.14 0.04 0.00 -0.42 0.00 0.00 57.16 56.83 3bfv n GLU 209 Cb 0.87 -1.68 -0.06 0.00 -0.57 0.00 0.00 31.44 30.01 3bfv n GLU 209 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3bfv n LEU 210 N -2.87 0.03 -2.56 -4.62 4.77 -0.65 -4.98 117.00 106.11 3bfv n LEU 210 Ca -0.22 -0.04 -0.19 0.00 -0.03 0.00 0.00 56.01 55.53 3bfv n LEU 210 Cb 1.05 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 42.17 3bfv n LEU 210 CO 0.44 0.01 -0.01 0.61 -1.33 0.00 0.00 177.39 177.10 3bfv n GLY 211 N 2.02 -0.34 3.42 -0.72 0.00 -0.59 -4.99 105.19 103.99 3bfv n GLY 211 Ca -0.01 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 3bfv n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bfv s LEU 212 N -5.71 2.46 0.59 0.99 1.43 -1.20 -5.00 118.68 112.24 3bfv s LEU 212 Ca 0.25 -0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 52.33 3bfv s LEU 212 Cb -0.11 -1.13 -0.05 0.00 0.03 0.00 0.00 46.19 44.93 3bfv s LEU 212 CO 0.30 0.10 1.02 -2.16 0.23 0.00 0.00 176.35 175.84 3bfv s PRO 213 N -2.82 3.68 -0.29 1.29 0.04 -1.26 -3.82 135.00 131.82 3bfv s PRO 213 Ca 0.22 0.81 -0.14 0.00 0.04 0.00 0.00 61.00 61.93 3bfv s PRO 213 Cb -0.07 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 3bfv s PRO 213 CO 0.10 -0.50 0.30 0.08 0.04 0.00 0.00 177.00 177.03 3bfv s VAL 214 N -3.03 5.22 -0.02 -0.36 1.01 -1.26 -0.84 120.40 121.11 3bfv s VAL 214 Ca 0.56 0.27 0.11 0.00 0.00 0.00 0.00 61.98 62.92 3bfv s VAL 214 Cb -0.11 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 3bfv s VAL 214 CO 0.48 0.12 1.37 -0.07 0.00 0.00 0.00 175.10 176.99 3bfv h LEU 215 N 8.55 0.00 -7.04 3.92 3.38 -0.71 -3.47 115.31 119.94 3bfv h LEU 215 Ca -0.32 0.00 0.29 0.00 0.09 0.00 0.00 57.88 57.93 3bfv h LEU 215 Cb 1.17 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.74 3bfv h LEU 215 CO 0.62 0.74 0.85 -0.83 0.09 0.00 0.00 178.44 179.92 3bfv s GLY 216 N -4.58 -0.31 -0.09 0.83 0.00 -1.22 -4.37 107.32 97.59 3bfv s GLY 216 Ca 0.03 1.47 0.01 0.00 0.00 0.00 0.00 44.72 46.23 3bfv s GLY 216 CO 0.78 0.46 -0.12 -0.56 0.00 0.00 0.00 173.10 173.67 3bfv s SER 217 N -2.33 2.04 -0.27 1.64 0.01 -1.26 -1.80 113.70 111.74 3bfv s SER 217 Ca 0.11 -0.33 -0.04 0.00 1.31 0.00 0.00 55.95 57.00 3bfv s SER 217 Cb 0.00 -0.89 0.01 0.00 0.21 0.00 0.00 66.02 65.35 3bfv s SER 217 CO -0.04 -0.01 0.01 -0.63 0.41 0.00 0.00 173.24 172.97 3bfv s ILE 218 N 1.02 3.45 0.72 1.44 -1.09 0.11 -4.95 121.20 121.90 3bfv s ILE 218 Ca -0.07 -0.80 -0.14 0.00 -2.23 0.00 0.00 60.65 57.41 3bfv s ILE 218 Cb -0.15 -2.74 0.04 0.00 -1.58 0.00 0.00 42.46 38.03 3bfv s ILE 218 CO -0.01 0.17 1.14 -1.10 -1.23 0.00 0.00 174.94 173.91 3bfv s GLN 219 N 1.43 2.34 0.19 2.79 -0.21 -1.26 -0.81 119.66 124.12 3bfv s GLN 219 Ca 0.02 1.48 -0.33 0.00 0.02 0.00 0.00 55.36 56.55 3bfv s GLN 219 Cb -0.17 -1.88 -0.13 0.00 1.00 0.00 0.00 33.01 31.83 3bfv s GLN 219 CO -0.01 -1.63 1.62 1.17 -2.12 0.00 0.00 175.29 174.32 3bfv n LYS 220 N -2.86 2.39 -1.81 2.91 4.81 0.25 -4.36 118.16 119.49 3bfv n LYS 220 Ca 0.11 0.86 -0.42 0.00 -0.87 0.00 0.00 58.31 58.00 3bfv n LYS 220 Cb 0.52 -2.65 -0.02 0.00 0.02 0.00 0.00 35.03 32.89 3bfv n LYS 220 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3bfv s PHE 221 N 0.89 2.85 0.27 5.64 0.08 -1.26 -4.94 117.98 121.51 3bfv s PHE 221 Ca 0.76 0.70 0.00 0.00 0.12 0.00 0.00 56.93 58.51 3bfv s PHE 221 Cb -0.61 -4.04 -0.03 0.00 -0.57 0.00 0.00 43.02 37.78 3bfv s PHE 221 CO 0.37 -3.63 0.28 0.54 -0.10 0.00 0.00 175.22 172.68 3bfv s ASN 222 N 0.69 0.76 0.44 1.36 2.20 -1.26 -5.04 114.94 114.09 3bfv s ASN 222 Ca 0.66 -1.48 0.18 0.00 -0.94 0.00 0.00 52.86 51.28 3bfv s ASN 222 Cb -0.47 0.51 1.13 0.00 -2.00 0.00 0.00 41.25 40.41 3bfv s ASN 222 CO 0.42 -1.02 1.91 0.00 -2.94 0.00 0.00 177.10 175.47 3bfv h MET 1001N 2.33 0.33 0.00 3.55 -0.00 -1.96 -2.60 114.93 116.58 3bfv h MET 1001Ca -0.30 -0.02 -0.09 0.00 -0.00 0.00 0.00 59.70 59.29 3bfv h MET 1001Cb 1.24 -0.07 -0.01 0.00 -0.00 0.00 0.00 31.60 32.75 3bfv h MET 1001CO 0.43 0.22 -0.54 1.15 -0.00 0.00 0.00 176.91 178.17 3bfv h THR 1002N 0.34 1.07 0.00 -0.10 2.02 -1.96 -0.35 112.91 113.93 3bfv h THR 1002Ca 0.38 -1.99 0.00 0.00 0.77 0.00 0.00 66.41 65.57 3bfv h THR 1002Cb 1.00 2.21 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 3bfv h THR 1002CO -0.11 0.36 0.00 -0.55 0.37 0.00 0.00 175.52 175.59 3bfv h ASN 1003N -1.00 0.00 -0.01 4.18 7.08 -1.93 -2.63 115.58 121.27 3bfv h ASN 1003Ca -0.13 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.09 3bfv h ASN 1003Cb 0.95 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.19 3bfv h ASN 1003CO -0.08 0.00 -0.13 0.35 -2.08 0.00 0.00 177.43 175.49 3bfv n THR 1004N -2.76 0.00 -3.87 6.14 -2.24 -0.98 -1.19 114.28 109.38 3bfv n THR 1004Ca 0.02 -0.43 -0.25 0.00 -2.27 0.00 0.00 64.05 61.11 3bfv n THR 1004Cb 0.32 1.25 -0.00 0.00 -2.10 0.00 0.00 70.33 69.79 3bfv n THR 1004CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3bfv n ARG 1005N 0.39 -3.33 -3.83 -0.78 1.74 -0.96 -2.54 116.66 107.35 3bfv n ARG 1005Ca 0.07 0.45 -0.29 0.00 -0.77 0.00 0.00 57.85 57.32 3bfv n ARG 1005Cb 0.34 -4.60 0.03 0.00 -1.02 0.00 0.00 32.46 27.21 3bfv n ARG 1005CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3bfv n ARG 1006N -4.35 -5.46 -1.64 5.56 1.74 -0.18 -4.92 116.66 107.42 3bfv n ARG 1006Ca -0.28 0.61 -0.45 0.00 -0.77 0.00 0.00 57.85 56.96 3bfv n ARG 1006Cb 0.67 -5.50 -0.02 0.00 -1.02 0.00 0.00 32.46 26.59 3bfv n ARG 1006CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3bfv n SER 1007N -2.79 2.10 0.14 0.55 7.64 -1.05 -4.90 113.62 115.31 3bfv n SER 1007Ca 0.03 1.16 0.01 0.00 1.01 0.00 0.00 58.87 61.09 3bfv n SER 1007Cb 0.53 -1.36 0.14 0.00 -1.01 0.00 0.00 64.21 62.51 3bfv n SER 1007CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 3bfv h THR 1008N 2.61 1.14 -1.82 0.44 2.02 -1.92 -3.46 112.91 111.91 3bfv h THR 1008Ca -0.43 -2.19 -0.61 0.00 0.77 0.00 0.00 66.41 63.95 3bfv h THR 1008Cb 1.31 2.28 -0.13 0.00 -1.74 0.00 0.00 68.15 69.87 3bfv h THR 1008CO 0.68 0.56 -0.51 -0.94 0.37 0.00 0.00 175.52 175.69 3bfv s SER 1009N -6.57 3.29 0.00 4.18 1.04 -1.26 -5.03 113.70 109.36 3bfv s SER 1009Ca 0.01 -1.68 0.30 0.00 0.48 0.00 0.00 55.95 55.06 3bfv s SER 1009Cb 0.10 0.54 1.60 0.00 0.10 0.00 0.00 66.02 68.36 3bfv s SER 1009CO 0.74 -0.92 2.07 -1.54 0.98 0.00 0.00 173.24 174.57 3bfv n SER 1010N -1.33 0.00 -3.61 7.02 3.41 -1.26 -4.21 113.62 113.65 3bfv n SER 1010Ca -0.11 -0.41 -0.41 0.00 -0.26 0.00 0.00 58.87 57.68 3bfv n SER 1010Cb 0.66 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 64.41 3bfv n SER 1010CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3bfv n LEU 1011N -1.19 7.58 -0.30 1.04 7.94 -1.26 -4.78 117.00 126.02 3bfv n LEU 1011Ca 0.17 -4.63 -0.01 0.00 -1.11 0.00 0.00 56.01 50.43 3bfv n LEU 1011Cb 0.19 -1.47 0.12 0.00 0.53 0.00 0.00 43.42 42.79 3bfv n LEU 1011CO 0.21 1.72 1.20 0.40 -1.11 0.00 0.00 177.39 179.81 3bfv h ILE 1012N 3.22 1.10 -0.46 1.96 1.08 -1.95 -1.61 117.51 120.84 3bfv h ILE 1012Ca 0.62 -0.35 -0.02 0.00 -0.39 0.00 0.00 64.86 64.72 3bfv h ILE 1012Cb 0.45 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.18 3bfv h ILE 1012CO 1.63 0.18 0.22 0.58 -0.69 0.00 0.00 178.15 180.08 3bfv h VAL 1013N 1.01 1.16 0.01 1.67 2.07 -1.86 0.17 116.25 120.48 3bfv h VAL 1013Ca 0.35 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 3bfv h VAL 1013Cb 0.07 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 3bfv h VAL 1013CO -0.14 0.18 -0.01 -0.74 0.02 0.00 0.00 177.57 176.89 3bfv h HIS 1014N 0.64 -0.02 -0.11 1.57 -0.00 -1.84 -3.23 115.15 112.17 3bfv h HIS 1014Ca 0.16 -0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.35 3bfv h HIS 1014Cb 0.07 0.01 -0.00 0.00 -0.00 0.00 0.00 27.41 27.49 3bfv h HIS 1014CO 0.00 0.63 -0.70 0.93 -0.00 0.00 0.00 177.93 178.80 3bfv h GLU 1015N -0.98 0.48 -2.28 5.26 4.39 -1.14 -3.36 114.58 116.95 3bfv h GLU 1015Ca -0.00 -0.37 -0.58 0.00 0.34 0.00 0.00 59.36 58.75 3bfv h GLU 1015Cb 0.65 0.07 -0.40 0.00 -0.10 0.00 0.00 28.75 28.97 3bfv h GLU 1015CO 0.00 1.00 -0.90 1.04 -1.16 0.00 0.00 179.01 178.99 3bfv n GLN 1016N -3.87 1.07 0.28 2.33 1.13 0.58 -4.99 117.38 113.91 3bfv n GLN 1016Ca -0.04 -3.66 0.19 0.00 -1.94 0.00 0.00 57.00 51.55 3bfv n GLN 1016Cb 0.69 -1.68 0.97 0.00 0.11 0.00 0.00 30.24 30.32 3bfv n GLN 1016CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3bfv h PRO 1017N 4.66 0.00 -0.22 -1.09 0.13 -1.66 -1.92 132.00 131.90 3bfv h PRO 1017Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3bfv h PRO 1017Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3bfv h PRO 1017CO 0.54 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 179.94 3bfv n LYS 1018N -2.89 2.40 -1.84 0.86 5.02 -1.26 -4.64 118.16 115.81 3bfv n LYS 1018Ca -0.02 -2.07 -0.34 0.00 -2.02 0.00 0.00 58.31 53.86 3bfv n LYS 1018Cb 0.12 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.69 3bfv n LYS 1018CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3bfv s SER 1019N -1.73 5.08 0.26 4.39 1.04 -0.72 -4.88 113.70 117.13 3bfv s SER 1019Ca 0.34 2.15 -0.02 0.00 0.48 0.00 0.00 55.95 58.90 3bfv s SER 1019Cb 0.21 -2.57 0.55 0.00 0.10 0.00 0.00 66.02 64.31 3bfv s SER 1019CO 0.31 -1.65 1.68 -0.65 0.98 0.00 0.00 173.24 173.91 3bfv h PRO 1020N 0.34 0.27 -0.61 4.02 0.11 -1.82 -2.13 132.00 132.19 3bfv h PRO 1020Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3bfv h PRO 1020Cb 1.27 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3bfv h PRO 1020CO 0.54 0.18 0.38 0.82 -0.21 0.00 0.00 178.00 179.71 3bfv h ILE 1021N 0.28 1.17 -0.95 4.15 1.08 -1.52 -2.44 117.51 119.28 3bfv h ILE 1021Ca 0.46 -0.37 0.04 0.00 -0.39 0.00 0.00 64.86 64.60 3bfv h ILE 1021Cb 0.83 0.32 -0.06 0.00 -3.07 0.00 0.00 36.82 34.85 3bfv h ILE 1021CO -0.54 0.18 0.63 0.28 -0.69 0.00 0.00 178.15 178.00 3bfv h SER 1022N 0.83 1.03 -0.95 1.72 0.02 -1.65 -1.61 113.55 112.93 3bfv h SER 1022Ca 0.22 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3bfv h SER 1022Cb -0.04 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.22 3bfv h SER 1022CO -0.04 0.70 0.61 -0.33 -1.14 0.00 0.00 176.83 176.62 3bfv h GLU 1023N 1.19 1.27 -0.87 3.45 5.08 -0.96 -2.36 114.58 121.38 3bfv h GLU 1023Ca 0.38 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.66 3bfv h GLU 1023Cb 0.03 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 28.96 3bfv h GLU 1023CO -0.12 0.86 0.57 0.87 -1.00 0.00 0.00 179.01 180.19 3bfv h LYS 1024N 1.30 1.13 -0.22 2.33 1.79 -0.93 -1.63 116.57 120.35 3bfv h LYS 1024Ca 0.35 -0.07 -0.11 0.00 -2.18 0.00 0.00 60.65 58.63 3bfv h LYS 1024Cb -0.11 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.27 3bfv h LYS 1024CO -0.07 0.75 -0.35 0.74 -1.08 0.00 0.00 179.45 179.43 3bfv h PHE 1025N 1.17 0.54 -0.52 -1.35 0.04 -1.15 -1.96 116.94 113.71 3bfv h PHE 1025Ca 0.32 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.90 3bfv h PHE 1025Cb -0.11 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 37.89 3bfv h PHE 1025CO -0.01 0.76 0.12 0.00 -0.60 0.00 0.00 178.31 178.58 3bfv h ARG 1026N 0.39 0.79 -0.52 1.51 3.08 -1.03 -1.83 114.38 116.77 3bfv h ARG 1026Ca 0.04 -0.16 -0.09 0.00 0.07 0.00 0.00 59.98 59.85 3bfv h ARG 1026Cb 0.81 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.72 3bfv h ARG 1026CO 0.07 0.71 -0.04 0.78 -1.07 0.00 0.00 179.97 180.42 3bfv h GLY 1027N 0.95 0.99 0.85 0.04 0.00 -0.88 -0.82 103.07 104.18 3bfv h GLY 1027Ca 0.17 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 3bfv h GLY 1027CO -0.00 0.66 0.03 -2.22 0.00 0.00 0.00 176.54 175.01 3bfv h ILE 1028N 0.84 1.16 -0.32 2.60 2.04 -1.11 -0.44 117.51 122.27 3bfv h ILE 1028Ca 0.15 -0.48 0.07 0.00 1.00 0.00 0.00 64.86 65.59 3bfv h ILE 1028Cb 0.55 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.88 3bfv h ILE 1028CO 0.03 0.14 -0.10 -0.09 0.00 0.00 0.00 178.15 178.13 3bfv h ARG 1029N -0.02 -0.03 -0.76 2.37 2.43 -1.20 -1.33 114.38 115.84 3bfv h ARG 1029Ca 0.03 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 3bfv h ARG 1029Cb 0.19 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 3bfv h ARG 1029CO -0.00 -0.02 0.30 1.03 -1.51 0.00 0.00 179.97 179.77 3bfv h SER 1030N -0.03 1.05 0.04 -3.80 0.87 -1.05 -2.41 113.55 108.24 3bfv h SER 1030Ca 0.16 -0.18 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 3bfv h SER 1030Cb 0.27 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 3bfv h SER 1030CO -0.35 0.94 -0.11 -1.13 -0.53 0.00 0.00 176.83 175.66 3bfv h ASN 1031N 1.10 -0.30 -0.96 6.23 -0.73 -0.64 0.22 115.58 120.50 3bfv h ASN 1031Ca 0.25 0.04 0.02 0.00 1.87 0.00 0.00 56.30 58.49 3bfv h ASN 1031Cb 0.22 0.12 -0.05 0.00 0.27 0.00 0.00 38.32 38.88 3bfv h ASN 1031CO -0.02 -0.16 0.63 0.40 -0.37 0.00 0.00 177.43 177.91 3bfv h ILE 1032N -0.21 1.20 0.00 2.57 2.04 -1.11 -1.37 117.51 120.64 3bfv h ILE 1032Ca 0.03 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3bfv h ILE 1032Cb 0.23 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 3bfv h ILE 1032CO -0.08 0.23 -1.11 0.23 0.00 0.00 0.00 178.15 177.42 3bfv n MET 1033N -4.42 0.59 0.00 2.37 2.81 -0.92 -4.63 117.12 112.93 3bfv n MET 1033Ca 0.12 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 3bfv n MET 1033Cb 0.06 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.79 3bfv n MET 1033CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 3bfv n PHE 1034N -2.58 0.00 -0.19 2.03 3.72 0.05 -4.84 117.46 115.65 3bfv n PHE 1034Ca -0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.32 3bfv n PHE 1034Cb 0.54 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.14 3bfv n PHE 1034CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3bfv h ALA 1035N 0.00 0.91 -2.78 4.37 0.00 -1.31 -3.39 119.26 117.06 3bfv h ALA 1035Ca 0.00 -0.30 -0.71 0.00 0.00 0.00 0.00 54.91 53.90 3bfv h ALA 1035Cb 0.00 -0.22 -0.24 0.00 0.00 0.00 0.00 17.79 17.32 3bfv h ALA 1035CO 0.00 0.65 -0.51 -0.80 0.00 0.00 0.00 179.25 178.60 3bfv s ASN 1036N -6.58 5.77 0.36 0.00 0.01 -1.26 -5.07 114.94 108.16 3bfv s ASN 1036Ca -0.11 -1.00 -0.27 0.00 -0.71 0.00 0.00 52.86 50.77 3bfv s ASN 1036Cb 0.14 -2.04 -0.12 0.00 0.41 0.00 0.00 41.25 39.64 3bfv s ASN 1036CO 0.85 -0.40 1.18 -0.81 -1.51 0.00 0.00 177.10 176.41 3bfv n PRO 1037N 5.01 1.79 -2.81 -0.60 -0.04 -1.26 -1.94 135.00 135.15 3bfv n PRO 1037Ca -0.12 0.63 -0.08 0.00 -0.04 0.00 0.00 63.50 63.90 3bfv n PRO 1037Cb 0.46 -2.18 -0.01 0.00 -0.04 0.00 0.00 33.50 31.73 3bfv n PRO 1037CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3bfv n ASP 1038N 0.74 -1.12 -4.79 3.54 5.68 -1.26 -4.96 116.55 114.39 3bfv n ASP 1038Ca 0.07 0.17 -0.36 0.00 -0.50 0.00 0.00 54.79 54.17 3bfv n ASP 1038Cb 0.36 -1.08 -0.04 0.00 -1.14 0.00 0.00 41.12 39.23 3bfv n ASP 1038CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3bfv s SER 1039N -2.17 6.65 -0.48 -1.12 1.04 -0.82 -5.02 113.70 111.80 3bfv s SER 1039Ca 0.15 2.02 0.08 0.00 0.48 0.00 0.00 55.95 58.68 3bfv s SER 1039Cb -0.09 -2.58 0.29 0.00 0.10 0.00 0.00 66.02 63.74 3bfv s SER 1039CO 0.19 -0.56 0.71 0.00 0.98 0.00 0.00 173.24 174.55 3bfv n ALA 1040N -0.28 3.10 -2.34 5.32 0.00 -1.26 -5.01 120.51 120.04 3bfv n ALA 1040Ca 0.06 -3.95 -0.43 0.00 0.00 0.00 0.00 53.44 49.12 3bfv n ALA 1040Cb 0.50 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 19.08 3bfv n ALA 1040CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3bfv s VAL 1041N -2.41 4.00 -0.13 0.00 1.01 -1.26 -4.88 120.40 116.74 3bfv s VAL 1041Ca 0.40 1.12 0.19 0.00 0.00 0.00 0.00 61.98 63.69 3bfv s VAL 1041Cb 0.23 -4.04 -0.22 0.00 0.00 0.00 0.00 36.38 32.35 3bfv s VAL 1041CO -0.09 -0.45 0.53 0.00 0.00 0.00 0.00 175.10 175.09 3bfv n GLN 1042N 7.47 0.65 -3.46 2.72 6.02 -1.26 -4.97 117.38 124.55 3bfv n GLN 1042Ca 0.16 0.04 -0.14 0.00 -0.01 0.00 0.00 57.00 57.05 3bfv n GLN 1042Cb 0.46 -1.65 -0.03 0.00 1.02 0.00 0.00 30.24 30.04 3bfv n GLN 1042CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3bfv s SER 1043N -5.35 -0.60 0.03 1.08 1.04 -1.26 -2.04 113.70 106.60 3bfv s SER 1043Ca -0.06 0.27 0.01 0.00 0.48 0.00 0.00 55.95 56.64 3bfv s SER 1043Cb 0.09 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.76 3bfv s SER 1043CO 0.84 -0.83 -0.05 0.27 0.98 0.00 0.00 173.24 174.46 3bfv s ILE 1044N -2.78 0.25 -0.08 -1.02 -4.36 -0.47 -4.53 121.20 108.21 3bfv s ILE 1044Ca -0.03 -0.94 -0.15 0.00 -0.26 0.00 0.00 60.65 59.26 3bfv s ILE 1044Cb -0.01 -0.37 -0.05 0.00 1.25 0.00 0.00 42.46 43.29 3bfv s ILE 1044CO -0.04 -0.45 0.39 -0.69 0.24 0.00 0.00 174.94 174.39 3bfv s VAL 1045N -1.39 5.15 -0.27 8.37 1.01 -0.48 -0.82 120.40 131.96 3bfv s VAL 1045Ca -0.14 0.79 -0.08 0.00 0.00 0.00 0.00 61.98 62.55 3bfv s VAL 1045Cb -0.10 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 3bfv s VAL 1045CO -0.01 0.46 0.10 -0.63 0.00 0.00 0.00 175.10 175.03 3bfv s ILE 1046N -0.22 4.42 0.33 2.22 -1.09 -0.22 -0.49 121.20 126.15 3bfv s ILE 1046Ca 0.22 -0.28 0.04 0.00 -2.23 0.00 0.00 60.65 58.40 3bfv s ILE 1046Cb -0.15 -3.15 -0.02 0.00 -1.58 0.00 0.00 42.46 37.56 3bfv s ILE 1046CO 0.10 0.22 0.32 0.28 -1.23 0.00 0.00 174.94 174.64 3bfv s THR 1047N 1.61 0.00 0.29 2.92 -1.32 -0.74 -2.89 115.64 115.51 3bfv s THR 1047Ca 0.05 -1.89 -0.14 0.00 -1.21 0.00 0.00 61.69 58.50 3bfv s THR 1047Cb -0.16 -2.54 0.01 0.00 -1.51 0.00 0.00 72.50 68.31 3bfv s THR 1047CO 0.05 0.00 0.60 -0.94 -2.21 0.00 0.00 174.62 172.12 3bfv s SER 1048N -3.33 0.00 0.08 8.08 1.04 -1.26 -0.52 113.70 117.79 3bfv s SER 1048Ca 0.38 -0.94 -0.14 0.00 0.48 0.00 0.00 55.95 55.73 3bfv s SER 1048Cb 0.02 0.69 -0.21 0.00 0.10 0.00 0.00 66.02 66.62 3bfv s SER 1048CO 0.25 -1.32 1.22 1.05 0.98 0.00 0.00 173.24 175.42 3bfv h GLU 1049N 2.12 0.71 -4.83 4.02 9.09 -1.90 0.44 114.58 124.22 3bfv h GLU 1049Ca -0.25 -0.68 -0.30 0.00 0.05 0.00 0.00 59.36 58.18 3bfv h GLU 1049Cb 1.25 0.18 -0.15 0.00 -1.65 0.00 0.00 28.75 28.38 3bfv h GLU 1049CO 0.33 1.28 -0.66 0.00 0.05 0.00 0.00 179.01 180.00 3bfv s ALA 1050N -3.47 1.39 0.67 1.06 0.00 -1.26 -2.40 121.76 117.75 3bfv s ALA 1050Ca -0.10 -1.60 -0.17 0.00 0.00 0.00 0.00 51.96 50.08 3bfv s ALA 1050Cb 0.07 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.72 3bfv s ALA 1050CO 0.90 -0.31 1.28 -2.14 0.00 0.00 0.00 175.76 175.50 3bfv s PRO 1051N -3.90 2.42 0.00 0.00 0.02 -1.26 -3.65 135.00 128.63 3bfv s PRO 1051Ca 0.24 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.27 3bfv s PRO 1051Cb 0.06 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.74 3bfv s PRO 1051CO 0.04 -1.68 0.00 0.41 -0.33 0.00 0.00 177.00 175.44 3bfv n GLY 1052N 0.82 0.54 0.20 0.52 0.00 -1.26 -4.91 105.19 101.09 3bfv n GLY 1052Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3bfv n GLY 1052CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bfv h ALA 1053N 0.00 1.26 0.00 4.61 0.00 -1.93 -3.47 119.26 119.73 3bfv h ALA 1053Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3bfv h ALA 1053Cb 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3bfv h ALA 1053CO 0.00 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.17 3bfv n GLY 1054N -0.39 1.78 0.31 0.00 0.00 -1.26 -4.18 105.19 101.45 3bfv n GLY 1054Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 3bfv n GLY 1054CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bfv h LYS 1055N 0.07 -0.40 -0.63 1.61 1.57 -1.90 0.47 116.57 117.36 3bfv h LYS 1055Ca 0.00 0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 3bfv h LYS 1055Cb 0.00 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 3bfv h LYS 1055CO 0.00 -0.27 0.24 0.77 -0.57 0.00 0.00 179.45 179.62 3bfv h SER 1056N -0.41 0.88 -0.32 0.86 0.02 -1.93 0.63 113.55 113.28 3bfv h SER 1056Ca 0.07 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 3bfv h SER 1056Cb 0.52 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 3bfv h SER 1056CO -0.27 0.83 0.02 0.74 -1.14 0.00 0.00 176.83 177.01 3bfv h THR 1057N 0.89 1.25 -0.38 -2.27 2.02 -1.93 -0.93 112.91 111.56 3bfv h THR 1057Ca 0.21 -0.89 -0.04 0.00 0.77 0.00 0.00 66.41 66.46 3bfv h THR 1057Cb 0.23 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3bfv h THR 1057CO -0.01 0.29 0.09 0.40 0.37 0.00 0.00 175.52 176.66 3bfv h ILE 1058N 0.35 1.23 -0.25 3.11 1.08 -0.76 -2.12 117.51 120.14 3bfv h ILE 1058Ca 0.09 -0.77 0.02 0.00 -0.39 0.00 0.00 64.86 63.81 3bfv h ILE 1058Cb 0.40 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.13 3bfv h ILE 1058CO 0.01 0.27 0.12 0.00 -0.69 0.00 0.00 178.15 177.86 3bfv h ALA 1059N 0.94 0.30 -0.15 1.87 0.00 -0.75 -0.37 119.26 121.10 3bfv h ALA 1059Ca 0.12 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3bfv h ALA 1059Cb 0.31 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3bfv h ALA 1059CO 0.00 -0.27 0.03 0.00 0.00 0.00 0.00 179.25 179.01 3bfv h ALA 1060N 1.13 0.20 -0.71 0.00 0.00 -1.12 -0.69 119.26 118.06 3bfv h ALA 1060Ca 0.10 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3bfv h ALA 1060Cb 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3bfv h ALA 1060CO -0.07 -0.15 0.18 -0.91 0.00 0.00 0.00 179.25 178.30 3bfv h ASN 1061N 0.04 1.07 -0.61 0.00 4.21 -1.31 -1.92 115.58 117.06 3bfv h ASN 1061Ca 0.05 -0.23 -0.03 0.00 1.21 0.00 0.00 56.30 57.30 3bfv h ASN 1061Cb 0.29 -0.28 -0.03 0.00 -1.12 0.00 0.00 38.32 37.17 3bfv h ASN 1061CO 0.00 1.02 0.27 0.25 -1.29 0.00 0.00 177.43 177.69 3bfv h LEU 1062N 1.07 0.82 -0.45 1.61 5.85 -0.96 -1.56 115.31 121.69 3bfv h LEU 1062Ca 0.23 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.84 3bfv h LEU 1062Cb 0.36 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.13 3bfv h LEU 1062CO 0.00 0.75 0.19 0.00 -0.34 0.00 0.00 178.44 179.04 3bfv h ALA 1063N 1.11 0.55 -0.62 1.25 0.00 -0.76 -0.26 119.26 120.53 3bfv h ALA 1063Ca 0.21 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.17 3bfv h ALA 1063Cb 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3bfv h ALA 1063CO -0.02 -0.19 0.40 0.28 0.00 0.00 0.00 179.25 179.72 3bfv h VAL 1064N 0.38 1.14 -0.59 0.00 2.07 -1.13 -1.00 116.25 117.12 3bfv h VAL 1064Ca 0.20 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.47 3bfv h VAL 1064Cb 0.16 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 3bfv h VAL 1064CO -0.18 0.15 0.35 0.00 0.02 0.00 0.00 177.57 177.91 3bfv h ALA 1065N 1.24 0.76 -0.15 1.67 0.00 -0.60 0.96 119.26 123.14 3bfv h ALA 1065Ca 0.23 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.14 3bfv h ALA 1065Cb -0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3bfv h ALA 1065CO -0.06 0.08 0.08 1.88 0.00 0.00 0.00 179.25 181.22 3bfv h TYR 1066N 0.69 0.15 -0.77 0.00 0.05 -0.76 -2.48 116.97 113.85 3bfv h TYR 1066Ca 0.24 0.01 0.01 0.00 0.05 0.00 0.00 58.73 59.03 3bfv h TYR 1066Cb 0.04 -0.04 -0.04 0.00 1.01 0.00 0.00 36.73 37.70 3bfv h TYR 1066CO -0.06 0.09 0.51 0.00 -1.05 0.00 0.00 178.16 177.65 3bfv h ALA 1067N 1.07 0.98 -0.23 3.88 0.00 -0.69 -2.24 119.26 122.03 3bfv h ALA 1067Ca 0.06 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3bfv h ALA 1067Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3bfv h ALA 1067CO -0.03 0.40 -0.06 1.96 0.00 0.00 0.00 179.25 181.52 3bfv h GLN 1068N 1.05 0.35 0.00 0.00 4.20 -0.74 -1.67 115.11 118.31 3bfv h GLN 1068Ca 0.28 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.92 3bfv h GLN 1068Cb -0.12 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.61 3bfv h GLN 1068CO -0.06 0.43 0.00 0.00 -0.67 0.00 0.00 178.83 178.53 3bfv n ALA 1069N -2.49 2.06 0.00 3.87 0.00 -0.93 -4.90 120.51 118.12 3bfv n ALA 1069Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3bfv n ALA 1069Cb 0.24 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.31 3bfv n ALA 1069CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bfv n GLY 1070N 0.89 0.98 3.71 0.00 0.00 -0.63 -5.08 105.19 105.07 3bfv n GLY 1070Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3bfv n GLY 1070CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3bfv s TYR 1071N -2.00 3.63 -0.34 1.61 2.02 -0.89 -4.99 117.35 116.39 3bfv s TYR 1071Ca 0.00 1.65 -0.29 0.00 -0.37 0.00 0.00 57.07 58.06 3bfv s TYR 1071Cb 0.00 -3.16 -0.01 0.00 -0.40 0.00 0.00 41.96 38.39 3bfv s TYR 1071CO 0.00 -0.18 1.59 0.21 -1.57 0.00 0.00 175.55 175.59 3bfv s LYS 1072N 0.98 3.53 -0.03 -0.62 2.20 -1.26 -4.00 119.74 120.54 3bfv s LYS 1072Ca 0.53 1.26 0.07 0.00 -0.36 0.00 0.00 55.97 57.46 3bfv s LYS 1072Cb -0.22 -4.09 -0.02 0.00 -1.51 0.00 0.00 37.83 31.99 3bfv s LYS 1072CO 0.28 -1.61 -0.24 0.99 -0.36 0.00 0.00 175.35 174.41 3bfv s THR 1073N 5.90 2.25 -0.10 3.43 2.01 0.17 -0.89 115.64 128.41 3bfv s THR 1073Ca 0.70 -1.03 0.04 0.00 0.31 0.00 0.00 61.69 61.71 3bfv s THR 1073Cb -0.19 -1.80 -0.00 0.00 0.01 0.00 0.00 72.50 70.52 3bfv s THR 1073CO 0.32 0.58 -0.24 -0.22 -0.69 0.00 0.00 174.62 174.38 3bfv s LEU 1074N -0.61 2.12 -0.21 4.42 2.96 -0.54 -0.88 118.68 125.93 3bfv s LEU 1074Ca 0.10 -0.54 -0.08 0.00 -0.22 0.00 0.00 54.13 53.38 3bfv s LEU 1074Cb -0.10 -1.42 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 3bfv s LEU 1074CO -0.00 0.17 0.10 -0.51 -1.32 0.00 0.00 176.35 174.78 3bfv s ILE 1075N 0.30 4.92 -0.22 6.68 2.07 -0.65 -0.83 121.20 133.46 3bfv s ILE 1075Ca -0.17 0.02 -0.08 0.00 -1.41 0.00 0.00 60.65 59.01 3bfv s ILE 1075Cb -0.18 -3.25 -0.04 0.00 0.13 0.00 0.00 42.46 39.13 3bfv s ILE 1075CO 0.08 0.41 0.08 -0.69 -1.91 0.00 0.00 174.94 172.91 3bfv s VAL 1076N 0.75 4.62 -1.04 4.00 1.01 0.68 -0.84 120.40 129.58 3bfv s VAL 1076Ca 0.05 -0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.74 3bfv s VAL 1076Cb -0.13 -3.13 0.08 0.00 0.00 0.00 0.00 36.38 33.20 3bfv s VAL 1076CO 0.02 0.38 1.40 -0.62 0.00 0.00 0.00 175.10 176.29 3bfv s ASP 1077N 1.08 6.61 -0.01 3.32 -1.08 0.33 -1.21 116.67 125.71 3bfv s ASP 1077Ca 0.05 -1.82 0.10 0.00 -0.52 0.00 0.00 52.55 50.35 3bfv s ASP 1077Cb -0.14 -2.52 0.31 0.00 -1.46 0.00 0.00 42.92 39.11 3bfv s ASP 1077CO 0.03 -1.31 1.23 0.61 0.52 0.00 0.00 175.17 176.25 3bfv n GLY 1078N 6.18 0.79 3.40 2.66 0.00 -0.20 -3.94 105.19 114.08 3bfv n GLY 1078Ca 0.33 -0.37 -0.45 0.00 0.00 0.00 0.00 46.02 45.53 3bfv n GLY 1078CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3bfv s ASP 1079N -0.92 6.64 -0.08 1.61 -1.08 -1.13 -4.41 116.67 117.30 3bfv s ASP 1079Ca 0.23 -2.22 0.09 0.00 -0.52 0.00 0.00 52.55 50.13 3bfv s ASP 1079Cb 0.13 -2.33 0.39 0.00 -1.46 0.00 0.00 42.92 39.65 3bfv s ASP 1079CO 0.14 -0.90 1.19 0.23 0.52 0.00 0.00 175.17 176.35 3bfv n MET 1080N 5.64 2.63 -0.05 4.34 2.81 -1.26 -2.59 117.12 128.63 3bfv n MET 1080Ca 0.18 -1.54 -0.11 0.00 -1.81 0.00 0.00 57.70 54.42 3bfv n MET 1080Cb 0.48 -1.69 -0.04 0.00 -0.71 0.00 0.00 33.22 31.26 3bfv n MET 1080CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3bfv n ARG 1081N 0.42 0.25 -3.19 0.03 1.74 -1.26 -4.23 116.66 110.42 3bfv n ARG 1081Ca 0.14 0.11 -0.23 0.00 -0.77 0.00 0.00 57.85 57.09 3bfv n ARG 1081Cb 0.60 -0.93 -0.05 0.00 -1.02 0.00 0.00 32.46 31.06 3bfv n ARG 1081CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3bfv n LYS 1082N -3.64 1.60 -2.07 5.56 5.02 -1.26 -5.05 118.16 118.31 3bfv n LYS 1082Ca -0.19 -3.84 -0.38 0.00 -2.02 0.00 0.00 58.31 51.88 3bfv n LYS 1082Cb 0.55 -1.75 0.01 0.00 -0.02 0.00 0.00 35.03 33.82 3bfv n LYS 1082CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3bfv s PRO 1083N -2.24 3.57 0.00 1.97 0.04 -1.07 -4.96 135.00 132.31 3bfv s PRO 1083Ca 0.40 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.42 3bfv s PRO 1083Cb 0.24 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 32.39 3bfv s PRO 1083CO -0.09 -0.77 0.09 0.25 0.04 0.00 0.00 177.00 176.53 3bfv n THR 1084N -0.61 0.00 0.09 1.26 -2.24 -1.26 -4.87 114.28 106.65 3bfv n THR 1084Ca 0.08 -0.11 0.03 0.00 -2.27 0.00 0.00 64.05 61.77 3bfv n THR 1084Cb 0.46 1.63 0.41 0.00 -2.10 0.00 0.00 70.33 70.74 3bfv n THR 1084CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3bfv h GLN 1085N 0.00 0.31 -0.15 -0.78 1.08 -1.94 -0.88 115.11 112.76 3bfv h GLN 1085Ca 0.00 -0.05 -0.07 0.00 -1.45 0.00 0.00 58.65 57.08 3bfv h GLN 1085Cb 0.32 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 3bfv h GLN 1085CO 0.00 0.36 -0.22 1.12 -0.95 0.00 0.00 178.83 179.14 3bfv h HIS 1086N 0.31 0.28 -0.08 2.96 2.07 -1.89 -1.19 115.15 117.61 3bfv h HIS 1086Ca 0.07 -0.05 -0.03 0.00 -2.85 0.00 0.00 60.37 57.52 3bfv h HIS 1086Cb 0.24 -0.07 -0.00 0.00 2.57 0.00 0.00 27.41 30.15 3bfv h HIS 1086CO 0.00 0.47 -0.05 1.88 -3.07 0.00 0.00 177.93 177.16 3bfv h TYR 1087N 0.23 0.20 -0.48 6.12 0.05 -1.58 0.91 116.97 122.43 3bfv h TYR 1087Ca 0.04 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 3bfv h TYR 1087Cb 0.53 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.20 3bfv h TYR 1087CO 0.01 0.57 0.27 0.82 -1.05 0.00 0.00 178.16 178.78 3bfv h ILE 1088N -0.22 1.17 -0.24 -2.88 2.04 -0.98 -2.76 117.51 113.64 3bfv h ILE 1088Ca 0.02 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.45 3bfv h ILE 1088Cb 0.52 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 3bfv h ILE 1088CO 0.01 0.18 0.00 0.49 0.00 0.00 0.00 178.15 178.83 3bfv n PHE 1089N -4.67 0.30 -3.58 1.37 3.72 -0.47 -4.88 117.46 109.25 3bfv n PHE 1089Ca 0.02 -0.15 -0.23 0.00 -0.05 0.00 0.00 57.45 57.04 3bfv n PHE 1089Cb 0.08 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.67 3bfv n PHE 1089CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3bfv n ASN 1090N 0.81 -4.03 -4.39 4.37 5.15 -0.60 -5.01 115.26 111.56 3bfv n ASN 1090Ca 0.17 -0.86 -0.25 0.00 -0.60 0.00 0.00 54.58 53.04 3bfv n ASN 1090Cb 0.45 -4.13 -0.11 0.00 -0.53 0.00 0.00 39.78 35.46 3bfv n ASN 1090CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3bfv s LEU 1091N -6.27 2.44 0.67 1.20 1.43 0.21 -5.04 118.68 113.32 3bfv s LEU 1091Ca 0.29 -0.87 -0.15 0.00 -1.03 0.00 0.00 54.13 52.36 3bfv s LEU 1091Cb -0.08 -1.04 0.01 0.00 0.03 0.00 0.00 46.19 45.11 3bfv s LEU 1091CO 0.81 0.06 1.14 -2.84 0.23 0.00 0.00 176.35 175.75 3bfv s PRO 1092N -2.74 2.64 -0.19 1.29 0.02 -1.26 -4.68 135.00 130.08 3bfv s PRO 1092Ca 0.19 1.52 0.16 0.00 0.02 0.00 0.00 61.00 62.90 3bfv s PRO 1092Cb -0.07 -1.92 0.46 0.00 0.02 0.00 0.00 34.50 32.99 3bfv s PRO 1092CO 0.09 -1.40 1.17 -1.71 -0.33 0.00 0.00 177.00 174.82 3bfv n ASN 1093N -2.42 2.36 0.08 2.53 5.15 -1.26 -4.79 115.26 116.92 3bfv n ASN 1093Ca 0.11 -2.94 -0.09 0.00 -0.60 0.00 0.00 54.58 51.06 3bfv n ASN 1093Cb 0.51 -0.41 -0.05 0.00 -0.53 0.00 0.00 39.78 39.30 3bfv n ASN 1093CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 3bfv h ASN 1094N 1.72 0.17 -4.20 1.20 2.35 -1.94 -3.31 115.58 111.57 3bfv h ASN 1094Ca 0.01 -0.15 -0.45 0.00 -0.55 0.00 0.00 56.30 55.15 3bfv h ASN 1094Cb 1.42 -0.05 -0.20 0.00 0.05 0.00 0.00 38.32 39.54 3bfv h ASN 1094CO 0.27 1.02 -0.78 -1.61 -1.65 0.00 0.00 177.43 174.68 3bfv s GLU 1095N -2.98 0.99 0.00 0.81 2.02 -1.26 -4.46 118.70 113.82 3bfv s GLU 1095Ca -0.02 -1.13 0.00 0.00 0.02 0.00 0.00 54.97 53.84 3bfv s GLU 1095Cb 0.10 -1.02 0.00 0.00 0.10 0.00 0.00 34.13 33.31 3bfv s GLU 1095CO 0.83 0.22 0.00 0.41 0.02 0.00 0.00 175.26 176.74 3bfv n GLY 1096N 0.91 -0.65 0.22 -1.39 0.00 -1.26 -4.29 105.19 98.73 3bfv n GLY 1096Ca -0.18 -0.55 -0.07 0.00 0.00 0.00 0.00 46.02 45.21 3bfv n GLY 1096CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3bfv h LEU 1097N 0.00 -0.57 -0.34 0.99 5.85 -0.01 -0.73 115.31 120.51 3bfv h LEU 1097Ca 0.00 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3bfv h LEU 1097Cb 0.00 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3bfv h LEU 1097CO 0.00 -0.21 0.19 0.77 -0.34 0.00 0.00 178.44 178.85 3bfv h SER 1098N -0.16 0.42 -0.33 1.25 4.64 -1.16 -1.15 113.55 117.06 3bfv h SER 1098Ca 0.14 -0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 61.24 3bfv h SER 1098Cb 0.37 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 3bfv h SER 1098CO -0.35 0.38 -0.30 0.77 -0.87 0.00 0.00 176.83 176.46 3bfv h SER 1099N 0.43 0.89 -0.14 4.97 4.64 -1.76 -1.78 113.55 120.79 3bfv h SER 1099Ca 0.12 -0.36 0.01 0.00 -0.47 0.00 0.00 61.79 61.09 3bfv h SER 1099Cb 0.05 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 3bfv h SER 1099CO -0.02 1.12 0.08 0.25 -0.87 0.00 0.00 176.83 177.38 3bfv h LEU 1100N 0.72 0.12 -1.67 5.97 5.85 -0.95 0.15 115.31 125.49 3bfv h LEU 1100Ca 0.08 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 3bfv h LEU 1100Cb 0.85 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3bfv h LEU 1100CO 0.08 0.09 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.01 3bfv h LEU 1101N 0.16 0.00 -1.24 2.25 3.38 -1.06 -1.64 115.31 117.16 3bfv h LEU 1101Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3bfv h LEU 1101Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3bfv h LEU 1101CO -0.03 0.19 0.00 0.18 0.09 0.00 0.00 178.44 178.87 3bfv n LEU 1102N -3.85 1.86 -2.77 1.67 4.77 -0.68 -4.89 117.00 113.11 3bfv n LEU 1102Ca -0.02 -0.81 -0.19 0.00 -0.03 0.00 0.00 56.01 54.97 3bfv n LEU 1102Cb 0.29 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3bfv n LEU 1102CO 0.33 0.40 -0.12 -3.20 -1.33 0.00 0.00 177.39 173.48 3bfv n ASN 1103N 0.46 -4.89 0.05 -1.43 5.15 -0.62 -4.88 115.26 109.10 3bfv n ASN 1103Ca 0.16 -0.09 -0.01 0.00 -0.60 0.00 0.00 54.58 54.04 3bfv n ASN 1103Cb 0.35 -4.05 -0.07 0.00 -0.53 0.00 0.00 39.78 35.47 3bfv n ASN 1103CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 3bfv h TRP 1104N -0.55 0.00 -3.67 1.20 6.55 -0.97 -3.47 115.95 115.04 3bfv h TRP 1104Ca -0.43 0.00 -0.39 0.00 0.95 0.00 0.00 58.89 59.02 3bfv h TRP 1104Cb 1.30 0.00 -0.19 0.00 -0.86 0.00 0.00 29.16 29.42 3bfv h TRP 1104CO 0.62 0.64 -0.75 -1.54 -1.05 0.00 0.00 178.44 176.35 3bfv s SER 1105N -5.99 1.81 0.48 -3.49 1.04 -1.07 -4.97 113.70 101.51 3bfv s SER 1105Ca -0.02 -0.78 -0.08 0.00 0.48 0.00 0.00 55.95 55.55 3bfv s SER 1105Cb 0.08 -0.05 -0.05 0.00 0.10 0.00 0.00 66.02 66.11 3bfv s SER 1105CO 0.80 -0.17 0.82 0.42 0.98 0.00 0.00 173.24 176.10 3bfv s THR 1106N -2.10 4.83 0.16 2.02 -4.23 -1.26 -4.29 115.64 110.77 3bfv s THR 1106Ca 0.06 0.45 -0.23 0.00 -1.18 0.00 0.00 61.69 60.80 3bfv s THR 1106Cb -0.05 -3.82 0.05 0.00 1.34 0.00 0.00 72.50 70.01 3bfv s THR 1106CO 0.02 -0.80 1.61 0.22 -0.54 0.00 0.00 174.62 175.14 3bfv h TYR 1107N 0.46 -0.78 0.00 3.99 3.20 -1.99 -1.30 116.97 120.55 3bfv h TYR 1107Ca -0.47 0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.42 3bfv h TYR 1107Cb 1.20 0.39 -0.01 0.00 1.54 0.00 0.00 36.73 39.85 3bfv h TYR 1107CO 0.60 -0.36 -0.17 -0.56 -1.64 0.00 0.00 178.16 176.04 3bfv h GLN 1108N -0.25 0.00 0.00 1.82 -0.00 -1.94 -2.22 115.11 112.51 3bfv h GLN 1108Ca 0.16 0.00 -0.09 0.00 -0.00 0.00 0.00 58.65 58.72 3bfv h GLN 1108Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.97 3bfv h GLN 1108CO -0.47 0.17 -0.84 -0.44 -0.00 0.00 0.00 178.83 177.26 3bfv h ASP 1109N 0.00 0.00 0.59 0.06 3.32 -1.85 -3.39 116.42 115.15 3bfv h ASP 1109Ca -0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 3bfv h ASP 1109Cb 0.38 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 3bfv h ASP 1109CO 0.02 0.36 -1.58 0.28 -1.72 0.00 0.00 179.24 176.60 3bfv h SER 1110N 0.00 0.00 -3.26 6.45 0.02 -0.64 -3.45 113.55 112.68 3bfv h SER 1110Ca -0.06 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.31 3bfv h SER 1110Cb 1.32 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.78 3bfv h SER 1110CO 0.04 0.93 -0.20 -0.63 -1.14 0.00 0.00 176.83 175.82 3bfv s ILE 1111N -2.67 5.19 -0.18 3.27 1.01 -1.07 -4.41 121.20 122.35 3bfv s ILE 1111Ca -0.04 0.82 -0.05 0.00 0.00 0.00 0.00 60.65 61.38 3bfv s ILE 1111Cb 0.08 -3.75 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 3bfv s ILE 1111CO 0.82 0.39 0.00 -0.63 0.00 0.00 0.00 174.94 175.52 3bfv s ILE 1112N 0.26 4.16 -0.38 2.92 1.01 0.15 -4.92 121.20 124.39 3bfv s ILE 1112Ca 0.23 -0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.36 3bfv s ILE 1112Cb -0.15 -2.86 0.02 0.00 0.01 0.00 0.00 42.46 39.48 3bfv s ILE 1112CO 0.09 0.46 0.95 -0.44 0.00 0.00 0.00 174.94 176.00 3bfv s SER 1113N 0.56 6.68 0.92 3.58 0.01 -1.26 -0.43 113.70 123.75 3bfv s SER 1113Ca -0.01 0.56 -0.12 0.00 1.31 0.00 0.00 55.95 57.69 3bfv s SER 1113Cb -0.14 -2.47 0.14 0.00 0.21 0.00 0.00 66.02 63.76 3bfv s SER 1113CO 0.02 -0.90 1.14 0.42 0.41 0.00 0.00 173.24 174.33 3bfv s THR 1114N 3.58 1.99 -1.83 1.44 -4.23 -0.86 -4.92 115.64 110.81 3bfv s THR 1114Ca 0.39 0.00 0.22 0.00 -1.18 0.00 0.00 61.69 61.13 3bfv s THR 1114Cb -0.11 -2.75 0.57 0.00 1.34 0.00 0.00 72.50 71.55 3bfv s THR 1114CO 0.20 0.00 1.72 -1.84 -0.54 0.00 0.00 174.62 174.16 3bfv n GLU 1115N -3.79 0.59 -3.20 3.99 0.28 -1.26 -4.56 120.64 112.69 3bfv n GLU 1115Ca 0.07 0.02 -0.41 0.00 -0.16 0.00 0.00 57.16 56.68 3bfv n GLU 1115Cb 0.59 -1.50 -0.07 0.00 1.43 0.00 0.00 31.44 31.89 3bfv n GLU 1115CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3bfv s ILE 1116N -2.17 4.99 0.47 3.84 1.01 -1.26 -5.04 121.20 123.04 3bfv s ILE 1116Ca 0.30 0.52 -0.24 0.00 0.00 0.00 0.00 60.65 61.23 3bfv s ILE 1116Cb 0.15 -3.97 -0.07 0.00 0.01 0.00 0.00 42.46 38.58 3bfv s ILE 1116CO 0.28 -0.19 1.40 -0.70 0.00 0.00 0.00 174.94 175.74 3bfv s GLU 1117N 2.48 3.55 -0.12 2.79 2.12 -1.26 -1.62 118.70 126.64 3bfv s GLU 1117Ca 0.21 2.36 0.00 0.00 0.36 0.00 0.00 54.97 57.90 3bfv s GLU 1117Cb -0.15 -2.55 0.00 0.00 0.26 0.00 0.00 34.13 31.69 3bfv s GLU 1117CO 0.13 -0.90 0.00 -0.25 -0.54 0.00 0.00 175.26 173.69 3bfv n ASP 1118N -0.41 -4.60 -4.08 -1.70 8.00 -1.26 -4.64 116.55 107.85 3bfv n ASP 1118Ca 0.06 0.03 -0.32 0.00 0.71 0.00 0.00 54.79 55.27 3bfv n ASP 1118Cb 0.43 -2.20 -0.16 0.00 -0.02 0.00 0.00 41.12 39.17 3bfv n ASP 1118CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3bfv s LEU 1119N -0.26 2.49 0.12 0.64 2.96 -0.64 -0.66 118.68 123.34 3bfv s LEU 1119Ca 0.00 -0.88 0.04 0.00 -0.22 0.00 0.00 54.13 53.07 3bfv s LEU 1119Cb 0.00 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.20 3bfv s LEU 1119CO 0.00 -0.08 0.11 -1.81 -1.32 0.00 0.00 176.35 173.25 3bfv s ASP 1120N 1.26 5.52 -0.06 3.68 1.01 -0.06 -2.03 116.67 125.99 3bfv s ASP 1120Ca 0.00 -0.07 0.03 0.00 0.71 0.00 0.00 52.55 53.22 3bfv s ASP 1120Cb -0.15 -1.46 0.01 0.00 1.01 0.00 0.00 42.92 42.32 3bfv s ASP 1120CO -0.10 0.12 -0.15 -0.69 0.21 0.00 0.00 175.17 174.56 3bfv s VAL 1121N -1.56 1.35 -0.45 -1.27 1.01 0.42 -1.64 120.40 118.26 3bfv s VAL 1121Ca 0.30 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.55 3bfv s VAL 1121Cb -0.11 -1.20 0.09 0.00 0.00 0.00 0.00 36.38 35.16 3bfv s VAL 1121CO 0.23 0.40 0.31 -0.22 0.00 0.00 0.00 175.10 175.82 3bfv s LEU 1122N 0.45 5.42 0.99 3.92 2.96 -0.02 -0.68 118.68 131.72 3bfv s LEU 1122Ca -0.12 -1.59 -0.12 0.00 -0.22 0.00 0.00 54.13 52.07 3bfv s LEU 1122Cb -0.15 -2.04 0.18 0.00 0.50 0.00 0.00 46.19 44.69 3bfv s LEU 1122CO 0.04 -0.61 1.10 0.42 -1.32 0.00 0.00 176.35 175.98 3bfv s THR 1123N 1.45 2.08 0.41 3.68 -4.23 -1.26 -0.51 115.64 117.27 3bfv s THR 1123Ca 0.04 0.03 0.15 0.00 -1.18 0.00 0.00 61.69 60.73 3bfv s THR 1123Cb -0.24 -2.54 0.16 0.00 1.34 0.00 0.00 72.50 71.22 3bfv s THR 1123CO 0.02 -0.04 1.93 0.77 -0.54 0.00 0.00 174.62 176.77 3bfv h SER 1124N -1.86 0.00 -3.81 3.99 4.64 -1.88 0.37 113.55 115.00 3bfv h SER 1124Ca -0.54 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.82 3bfv h SER 1124Cb 1.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 3bfv h SER 1124CO 0.58 0.25 -0.05 0.61 -0.87 0.00 0.00 176.83 177.35 3bfv n GLY 1125N -0.75 -2.14 3.65 -0.77 0.00 -1.26 -0.67 105.19 103.25 3bfv n GLY 1125Ca -0.02 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 3bfv n GLY 1125CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3bfv n PRO 1126N -1.10 1.14 -1.89 1.61 -0.02 -1.25 -4.82 135.00 128.67 3bfv n PRO 1126Ca 0.00 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 3bfv n PRO 1126Cb 0.06 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.26 3bfv n PRO 1126CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3bfv s ILE 1127N -1.43 3.37 0.50 4.25 -1.09 -1.26 -4.69 121.20 120.84 3bfv s ILE 1127Ca 0.74 0.41 -0.14 0.00 -2.23 0.00 0.00 60.65 59.43 3bfv s ILE 1127Cb -0.43 -3.39 -0.07 0.00 -1.58 0.00 0.00 42.46 36.99 3bfv s ILE 1127CO 0.48 -0.17 0.93 -2.16 -1.23 0.00 0.00 174.94 172.79 3bfv s PRO 1128N 5.15 3.84 0.37 2.79 0.04 -1.26 -4.99 135.00 140.93 3bfv s PRO 1128Ca 0.83 0.78 0.04 0.00 0.04 0.00 0.00 61.00 62.69 3bfv s PRO 1128Cb -0.30 -2.20 0.71 0.00 0.04 0.00 0.00 34.50 32.74 3bfv s PRO 1128CO 0.34 -0.25 1.99 -1.00 0.04 0.00 0.00 177.00 178.11 3bfv h PRO 1129N 0.79 0.64 -2.30 0.56 0.13 -1.96 -3.40 132.00 126.47 3bfv h PRO 1129Ca -0.46 -0.06 -0.47 0.00 -0.87 0.00 0.00 66.00 64.13 3bfv h PRO 1129Cb 1.19 -0.13 -0.35 0.00 0.13 0.00 0.00 31.00 31.83 3bfv h PRO 1129CO 0.62 0.48 -0.76 1.21 -0.23 0.00 0.00 178.00 179.32 3bfv s ASN 1130N -6.63 2.17 0.28 1.44 2.47 -1.26 -5.02 114.94 108.39 3bfv s ASN 1130Ca -0.09 -1.80 0.00 0.00 0.42 0.00 0.00 52.86 51.40 3bfv s ASN 1130Cb 0.17 0.06 0.52 0.00 -1.45 0.00 0.00 41.25 40.55 3bfv s ASN 1130CO 0.75 -0.30 1.86 -0.65 -3.72 0.00 0.00 177.10 175.04 3bfv h PRO 1131N 7.19 1.02 -0.68 0.43 0.11 -1.93 -2.57 132.00 135.57 3bfv h PRO 1131Ca 0.03 -0.06 0.09 0.00 0.11 0.00 0.00 66.00 66.16 3bfv h PRO 1131Cb 1.01 -0.23 -0.07 0.00 0.11 0.00 0.00 31.00 31.83 3bfv h PRO 1131CO 0.25 0.67 0.34 0.77 -0.21 0.00 0.00 178.00 179.82 3bfv h SER 1132N 1.05 0.44 -0.84 -2.05 0.02 -1.98 -0.92 113.55 109.27 3bfv h SER 1132Ca 0.47 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.49 3bfv h SER 1132Cb 0.38 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.86 3bfv h SER 1132CO -0.23 0.26 0.56 -0.08 -1.14 0.00 0.00 176.83 176.20 3bfv h GLU 1133N 0.59 1.11 -0.23 3.45 4.81 -1.88 -1.52 114.58 120.91 3bfv h GLU 1133Ca 0.33 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.37 3bfv h GLU 1133Cb 0.34 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 3bfv h GLU 1133CO -0.26 0.74 -0.34 -0.07 -0.73 0.00 0.00 179.01 178.35 3bfv h LEU 1134N 1.14 0.70 -0.98 1.64 3.38 -1.26 -2.61 115.31 117.33 3bfv h LEU 1134Ca 0.31 -0.52 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 3bfv h LEU 1134Cb -0.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 3bfv h LEU 1134CO -0.07 1.08 0.11 0.40 0.09 0.00 0.00 178.44 180.05 3bfv h ILE 1135N 0.34 1.23 -0.08 1.22 2.04 -0.84 -2.60 117.51 118.83 3bfv h ILE 1135Ca 0.02 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.02 3bfv h ILE 1135Cb 0.93 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 3bfv h ILE 1135CO 0.08 0.32 0.00 0.35 0.00 0.00 0.00 178.15 178.90 3bfv n THR 1136N -4.26 0.09 -2.05 -0.27 -2.24 -0.60 -4.63 114.28 100.32 3bfv n THR 1136Ca 0.04 -0.29 -0.33 0.00 -2.27 0.00 0.00 64.05 61.20 3bfv n THR 1136Cb 0.24 0.42 0.01 0.00 -2.10 0.00 0.00 70.33 68.91 3bfv n THR 1136CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3bfv s SER 1137N -1.81 5.75 0.39 3.42 1.04 -0.98 -4.95 113.70 116.57 3bfv s SER 1137Ca 0.36 1.84 0.07 0.00 0.48 0.00 0.00 55.95 58.70 3bfv s SER 1137Cb 0.19 -2.54 0.79 0.00 0.10 0.00 0.00 66.02 64.57 3bfv s SER 1137CO 0.30 -1.19 1.99 0.03 0.98 0.00 0.00 173.24 175.36 3bfv h ARG 1138N 0.47 0.48 -0.76 4.02 2.47 -1.91 -2.43 114.38 116.72 3bfv h ARG 1138Ca -0.47 -0.06 0.15 0.00 -1.26 0.00 0.00 59.98 58.34 3bfv h ARG 1138Cb 1.22 -0.09 -0.10 0.00 -1.65 0.00 0.00 29.97 29.35 3bfv h ARG 1138CO 0.57 0.41 0.29 0.00 0.56 0.00 0.00 179.97 181.80 3bfv h ALA 1139N 1.67 1.07 -0.14 0.04 0.00 -1.90 -0.11 119.26 119.88 3bfv h ALA 1139Ca 0.12 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 3bfv h ALA 1139Cb 0.11 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3bfv h ALA 1139CO -0.01 -0.23 -0.33 0.35 0.00 0.00 0.00 179.25 179.03 3bfv h PHE 1140N 0.43 0.61 -0.78 0.00 3.57 -1.62 -0.45 116.94 118.69 3bfv h PHE 1140Ca 0.42 -0.23 0.09 0.00 3.53 0.00 0.00 57.97 61.78 3bfv h PHE 1140Cb 0.65 -0.11 -0.07 0.00 2.79 0.00 0.00 35.95 39.21 3bfv h PHE 1140CO -0.17 0.95 0.43 0.00 -2.23 0.00 0.00 178.31 177.29 3bfv h ALA 1141N 0.54 1.09 -0.32 2.41 0.00 -1.24 0.18 119.26 121.92 3bfv h ALA 1141Ca -0.00 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 3bfv h ALA 1141Cb 0.93 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3bfv h ALA 1141CO 0.07 0.04 -0.33 -0.91 0.00 0.00 0.00 179.25 178.12 3bfv h ASN 1142N 0.72 0.85 -0.28 0.00 2.35 -0.98 -2.48 115.58 115.75 3bfv h ASN 1142Ca 0.38 -0.47 0.03 0.00 -0.55 0.00 0.00 56.30 55.68 3bfv h ASN 1142Cb 0.36 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 3bfv h ASN 1142CO -0.25 1.15 0.09 0.25 -1.65 0.00 0.00 177.43 177.02 3bfv h LEU 1143N 0.56 0.10 -0.75 1.61 5.85 -0.44 -2.21 115.31 120.04 3bfv h LEU 1143Ca 0.05 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3bfv h LEU 1143Cb 0.91 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 3bfv h LEU 1143CO 0.08 0.09 0.45 0.22 -0.34 0.00 0.00 178.44 178.95 3bfv h TYR 1144N 0.22 0.84 -0.55 1.25 3.20 -0.54 0.10 116.97 121.49 3bfv h TYR 1144Ca 0.12 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.03 3bfv h TYR 1144Cb 0.09 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.06 3bfv h TYR 1144CO -0.13 0.44 0.35 -0.44 -1.64 0.00 0.00 178.16 176.74 3bfv h ASP 1145N 0.85 0.59 -0.77 -2.11 3.32 -1.26 -1.81 116.42 115.25 3bfv h ASP 1145Ca 0.32 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 3bfv h ASP 1145Cb 0.12 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 3bfv h ASP 1145CO -0.15 0.42 0.45 0.74 -1.72 0.00 0.00 179.24 178.98 3bfv h THR 1146N 0.71 1.22 -0.50 0.35 2.02 -0.60 -2.78 112.91 113.33 3bfv h THR 1146Ca 0.21 -0.51 -0.04 0.00 0.77 0.00 0.00 66.41 66.84 3bfv h THR 1146Cb -0.04 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.52 3bfv h THR 1146CO -0.07 0.24 0.15 -0.07 0.37 0.00 0.00 175.52 176.14 3bfv h LEU 1147N 1.05 0.73 -1.68 2.58 3.38 -0.47 -1.66 115.31 119.24 3bfv h LEU 1147Ca 0.27 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 58.08 3bfv h LEU 1147Cb -0.01 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3bfv h LEU 1147CO -0.05 0.74 0.29 -0.07 0.09 0.00 0.00 178.44 179.45 3bfv h LEU 1148N 0.67 0.35 0.00 1.67 3.38 -1.17 -0.98 115.31 119.23 3bfv h LEU 1148Ca 0.16 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 3bfv h LEU 1148Cb 0.28 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3bfv h LEU 1148CO -0.00 0.24 -0.43 0.24 0.09 0.00 0.00 178.44 178.57 3bfv h MET 1149N 0.41 0.00 0.00 1.13 2.86 -1.19 -3.35 114.93 114.79 3bfv h MET 1149Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 3bfv h MET 1149Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3bfv h MET 1149CO -0.04 0.09 -1.60 0.09 1.06 0.00 0.00 176.91 176.51 3bfv n ASN 1150N -2.99 0.37 -4.14 1.22 3.02 -0.66 -4.97 115.26 107.10 3bfv n ASN 1150Ca 0.02 -0.31 -0.22 0.00 -0.03 0.00 0.00 54.58 54.04 3bfv n ASN 1150Cb 0.58 1.57 -0.14 0.00 -0.61 0.00 0.00 39.78 41.18 3bfv n ASN 1150CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3bfv s TYR 1151N -3.33 1.32 0.35 3.10 2.02 -0.44 -5.01 117.35 115.35 3bfv s TYR 1151Ca -0.02 -0.30 0.11 0.00 -0.37 0.00 0.00 57.07 56.49 3bfv s TYR 1151Cb 0.15 -0.81 0.65 0.00 -0.40 0.00 0.00 41.96 41.54 3bfv s TYR 1151CO 0.89 0.01 1.79 -0.91 -1.57 0.00 0.00 175.55 175.76 3bfv h ASN 1152N 5.33 0.04 -3.45 2.29 -0.26 -1.32 -3.44 115.58 114.77 3bfv h ASN 1152Ca -0.37 -0.02 -0.12 0.00 -0.56 0.00 0.00 56.30 55.24 3bfv h ASN 1152Cb 1.17 -0.01 -0.26 0.00 -1.06 0.00 0.00 38.32 38.16 3bfv h ASN 1152CO 0.46 0.43 -0.27 0.12 -1.06 0.00 0.00 177.43 177.11 3bfv s PHE 1153N -4.14 -0.56 -0.10 1.19 5.36 -0.98 -4.81 117.98 113.94 3bfv s PHE 1153Ca -0.03 1.24 0.03 0.00 -0.96 0.00 0.00 56.93 57.21 3bfv s PHE 1153Cb 0.14 0.23 0.01 0.00 -0.34 0.00 0.00 43.02 43.06 3bfv s PHE 1153CO 0.74 -0.30 -0.20 0.08 -1.46 0.00 0.00 175.22 174.08 3bfv s VAL 1154N 1.00 1.76 -0.15 3.12 1.01 -0.87 -1.47 120.40 124.80 3bfv s VAL 1154Ca -0.06 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 3bfv s VAL 1154Cb -0.06 -1.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.76 3bfv s VAL 1154CO -0.08 0.49 -0.14 -0.63 0.00 0.00 0.00 175.10 174.74 3bfv s ILE 1155N 0.58 2.78 -0.29 2.22 1.01 -0.01 -1.37 121.20 126.11 3bfv s ILE 1155Ca -0.15 -0.74 -0.05 0.00 0.00 0.00 0.00 60.65 59.72 3bfv s ILE 1155Cb -0.17 -2.17 0.02 0.00 0.01 0.00 0.00 42.46 40.15 3bfv s ILE 1155CO 0.05 0.51 0.04 -0.63 0.00 0.00 0.00 174.94 174.91 3bfv s ILE 1156N 0.75 3.63 0.36 2.92 1.01 -0.00 -0.23 121.20 129.64 3bfv s ILE 1156Ca -0.06 -0.86 -0.25 0.00 0.00 0.00 0.00 60.65 59.48 3bfv s ILE 1156Cb -0.15 -2.90 -0.10 0.00 0.01 0.00 0.00 42.46 39.32 3bfv s ILE 1156CO 0.01 0.07 1.00 -0.62 0.00 0.00 0.00 174.94 175.40 3bfv s ASP 1157N 1.43 7.08 0.15 3.58 2.15 -0.35 -1.06 116.67 129.66 3bfv s ASP 1157Ca 0.01 1.94 -0.01 0.00 0.43 0.00 0.00 52.55 54.93 3bfv s ASP 1157Cb -0.17 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 39.82 3bfv s ASP 1157CO 0.01 -0.26 0.07 0.42 -0.17 0.00 0.00 175.17 175.23 3bfv s THR 1158N -1.63 0.15 0.86 1.71 -4.23 -1.14 -1.03 115.64 110.32 3bfv s THR 1158Ca 0.53 -1.94 -0.12 0.00 -1.18 0.00 0.00 61.69 58.98 3bfv s THR 1158Cb -0.20 -2.17 0.11 0.00 1.34 0.00 0.00 72.50 71.57 3bfv s THR 1158CO 0.26 -0.34 1.13 -2.84 -0.54 0.00 0.00 174.62 172.28 3bfv s PRO 1159N -4.06 1.59 0.53 3.99 0.02 -1.26 -4.72 135.00 131.09 3bfv s PRO 1159Ca 0.28 0.38 -0.20 0.00 0.02 0.00 0.00 61.00 61.48 3bfv s PRO 1159Cb 0.07 -1.88 -0.06 0.00 0.02 0.00 0.00 34.50 32.65 3bfv s PRO 1159CO 0.05 -1.90 1.17 -1.25 -0.33 0.00 0.00 177.00 174.74 3bfv s PRO 1160N -5.28 3.36 0.14 5.54 0.04 -1.26 -4.50 135.00 133.04 3bfv s PRO 1160Ca 0.62 1.75 -0.12 0.00 0.04 0.00 0.00 61.00 63.30 3bfv s PRO 1160Cb -0.14 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 3bfv s PRO 1160CO 0.53 -0.88 1.49 0.28 0.04 0.00 0.00 177.00 178.46 3bfv h VAL 1161N 1.33 1.28 0.00 -0.36 2.07 -0.96 -3.20 116.25 116.40 3bfv h VAL 1161Ca -0.50 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 65.55 3bfv h VAL 1161Cb 1.27 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 3bfv h VAL 1161CO 0.57 0.49 0.00 0.78 0.02 0.00 0.00 177.57 179.44 3bfv h ASN 1162N 0.73 0.00 0.00 0.57 2.35 -1.70 -3.29 115.58 114.24 3bfv h ASN 1162Ca 0.08 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.60 3bfv h ASN 1162Cb 0.88 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.21 3bfv h ASN 1162CO 0.08 0.00 -1.85 0.35 -1.65 0.00 0.00 177.43 174.36 3bfv n THR 1163N -2.39 0.85 -4.06 2.81 -2.24 -1.24 -5.04 114.28 102.97 3bfv n THR 1163Ca 0.02 -0.42 -0.09 0.00 -2.27 0.00 0.00 64.05 61.29 3bfv n THR 1163Cb 0.25 -0.86 -0.10 0.00 -2.10 0.00 0.00 70.33 67.51 3bfv n THR 1163CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3bfv s VAL 1164N -2.30 0.27 -2.19 2.28 -7.23 -1.21 -5.06 120.40 104.97 3bfv s VAL 1164Ca -0.13 -1.48 0.18 0.00 -1.81 0.00 0.00 61.98 58.74 3bfv s VAL 1164Cb 0.04 -1.06 0.42 0.00 0.56 0.00 0.00 36.38 36.34 3bfv s VAL 1164CO 0.42 -0.77 1.47 0.35 -0.31 0.00 0.00 175.10 176.26 3bfv n THR 1165N 0.68 0.27 -0.15 5.32 -2.24 -1.26 -4.43 114.28 112.47 3bfv n THR 1165Ca -0.18 -0.36 -0.03 0.00 -2.27 0.00 0.00 64.05 61.21 3bfv n THR 1165Cb 0.59 0.31 0.05 0.00 -2.10 0.00 0.00 70.33 69.17 3bfv n THR 1165CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3bfv h ASP 1166N 2.07 -0.23 -0.78 3.42 5.19 -1.91 -1.66 116.42 122.51 3bfv h ASP 1166Ca 0.00 0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.49 3bfv h ASP 1166Cb 0.46 0.21 -0.04 0.00 0.18 0.00 0.00 39.33 40.14 3bfv h ASP 1166CO 0.00 -0.08 0.37 0.00 -3.12 0.00 0.00 179.24 176.41 3bfv h ALA 1167N 1.42 1.00 -0.86 3.45 0.00 -1.79 -1.31 119.26 121.17 3bfv h ALA 1167Ca 0.23 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3bfv h ALA 1167Cb 0.35 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3bfv h ALA 1167CO -0.40 0.57 0.56 1.96 0.00 0.00 0.00 179.25 181.94 3bfv h GLN 1168N 1.10 1.07 -0.29 0.00 4.20 -1.64 -0.14 115.11 119.41 3bfv h GLN 1168Ca 0.27 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.86 3bfv h GLN 1168Cb 0.13 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 3bfv h GLN 1168CO -0.03 0.71 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.74 3bfv h LEU 1169N 1.10 0.52 -1.28 1.46 3.38 -0.89 -2.72 115.31 116.89 3bfv h LEU 1169Ca 0.34 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3bfv h LEU 1169Cb -0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3bfv h LEU 1169CO -0.10 0.73 0.32 -0.26 0.09 0.00 0.00 178.44 179.21 3bfv h PHE 1170N 0.31 0.79 -0.09 1.13 0.04 -1.02 -2.76 116.94 115.34 3bfv h PHE 1170Ca 0.08 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 3bfv h PHE 1170Cb 0.47 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 3bfv h PHE 1170CO 0.04 0.56 -0.06 0.77 -0.60 0.00 0.00 178.31 179.02 3bfv h SER 1171N 0.82 0.12 -0.07 2.17 0.02 -0.73 -1.30 113.55 114.58 3bfv h SER 1171Ca 0.21 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 3bfv h SER 1171Cb 0.03 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3bfv h SER 1171CO -0.03 0.20 0.01 0.11 -1.14 0.00 0.00 176.83 175.97 3bfv h LYS 1172N 0.13 0.20 0.02 3.45 1.79 -1.21 -0.37 116.57 120.57 3bfv h LYS 1172Ca 0.03 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 3bfv h LYS 1172Cb 0.19 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 3bfv h LYS 1172CO 0.01 0.21 -0.01 0.74 -1.08 0.00 0.00 179.45 179.32 3bfv h PHE 1173N 0.20 -0.03 -0.10 -1.35 0.04 -1.33 -3.38 116.94 110.99 3bfv h PHE 1173Ca 0.05 -0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.64 3bfv h PHE 1173Cb 0.13 0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.28 3bfv h PHE 1173CO 0.00 0.64 -0.69 1.79 -0.60 0.00 0.00 178.31 179.45 3bfv h THR 1174N -0.96 1.37 0.00 -1.55 1.35 -1.41 -3.47 112.91 108.24 3bfv h THR 1174Ca -0.00 -2.06 0.00 0.00 -0.55 0.00 0.00 66.41 63.79 3bfv h THR 1174Cb 0.68 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 3bfv h THR 1174CO 0.00 0.62 0.00 0.61 -0.25 0.00 0.00 175.52 176.51 3bfv n GLY 1175N 0.48 0.24 2.92 5.82 0.00 -0.15 -4.77 105.19 109.73 3bfv n GLY 1175Ca -0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 3bfv n GLY 1175CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3bfv s ASN 1176N -2.07 -0.10 -0.02 1.61 0.01 -1.26 -0.91 114.94 112.19 3bfv s ASN 1176Ca 0.00 0.29 0.02 0.00 -0.71 0.00 0.00 52.86 52.46 3bfv s ASN 1176Cb 0.00 0.18 0.00 0.00 0.41 0.00 0.00 41.25 41.84 3bfv s ASN 1176CO 0.00 -0.15 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.68 3bfv s VAL 1177N 1.15 0.65 -0.19 1.60 1.01 0.13 -1.39 120.40 123.36 3bfv s VAL 1177Ca -0.09 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.56 3bfv s VAL 1177Cb -0.11 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 3bfv s VAL 1177CO -0.06 0.21 -0.00 -0.69 0.00 0.00 0.00 175.10 174.56 3bfv s VAL 1178N 0.23 3.95 -0.29 2.92 1.01 0.36 -0.93 120.40 127.65 3bfv s VAL 1178Ca -0.03 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 3bfv s VAL 1178Cb -0.08 -2.78 0.00 0.00 0.00 0.00 0.00 36.38 33.53 3bfv s VAL 1178CO 0.00 0.44 0.09 -0.47 0.00 0.00 0.00 175.10 175.16 3bfv s TYR 1179N 0.90 3.14 -0.10 5.22 5.04 -0.70 -1.79 117.35 129.06 3bfv s TYR 1179Ca 0.01 -0.87 -0.17 0.00 -2.44 0.00 0.00 57.07 53.60 3bfv s TYR 1179Cb -0.14 -2.27 -0.05 0.00 0.35 0.00 0.00 41.96 39.85 3bfv s TYR 1179CO 0.02 -0.54 0.43 0.08 -1.34 0.00 0.00 175.55 174.20 3bfv s VAL 1180N 1.53 5.17 -0.17 3.14 1.01 0.33 -1.21 120.40 130.19 3bfv s VAL 1180Ca 0.03 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.88 3bfv s VAL 1180Cb -0.17 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.48 3bfv s VAL 1180CO 0.03 0.39 -0.11 -0.69 0.00 0.00 0.00 175.10 174.72 3bfv s VAL 1181N 0.24 1.49 -0.63 2.92 1.01 -0.56 -4.42 120.40 120.45 3bfv s VAL 1181Ca 0.24 -0.76 -0.27 0.00 0.00 0.00 0.00 61.98 61.19 3bfv s VAL 1181Cb -0.15 -1.52 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 3bfv s VAL 1181CO 0.10 0.28 1.62 0.21 0.00 0.00 0.00 175.10 177.30 3bfv s ASN 1182N 1.49 5.70 0.57 3.32 2.47 -1.26 -0.80 114.94 126.43 3bfv s ASN 1182Ca 0.02 0.15 0.29 0.00 0.42 0.00 0.00 52.86 53.74 3bfv s ASN 1182Cb -0.15 -2.54 1.69 0.00 -1.45 0.00 0.00 41.25 38.81 3bfv s ASN 1182CO -0.09 -2.08 2.18 0.77 -3.72 0.00 0.00 177.10 174.16 3bfv h SER 1183N 12.80 0.00 0.72 -4.21 4.64 -1.39 -2.57 113.55 123.54 3bfv h SER 1183Ca -0.27 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.90 3bfv h SER 1183Cb 1.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.19 3bfv h SER 1183CO 1.22 0.05 -0.70 -0.33 -0.87 0.00 0.00 176.83 176.20 3bfv h GLU 1184N 0.00 0.00 -1.28 4.77 5.08 -1.76 -3.42 114.58 117.96 3bfv h GLU 1184Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3bfv h GLU 1184Cb 0.14 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.15 3bfv h GLU 1184CO 0.01 0.70 -0.42 1.21 -1.00 0.00 0.00 179.01 179.51 3bfv s ASN 1185N -6.80 -0.84 0.06 1.42 2.47 -0.97 -5.11 114.94 105.17 3bfv s ASN 1185Ca -0.01 0.14 -0.26 0.00 0.42 0.00 0.00 52.86 53.15 3bfv s ASN 1185Cb 0.12 1.71 0.09 0.00 -1.45 0.00 0.00 41.25 41.72 3bfv s ASN 1185CO 0.77 -0.31 0.75 0.54 -3.72 0.00 0.00 177.10 175.14 3bfv s ASN 1186N 2.73 -0.47 -0.18 -4.21 2.20 -1.25 -4.66 114.94 109.10 3bfv s ASN 1186Ca 0.12 0.03 -0.02 0.00 -0.94 0.00 0.00 52.86 52.05 3bfv s ASN 1186Cb -0.12 0.48 -0.01 0.00 -2.00 0.00 0.00 41.25 39.60 3bfv s ASN 1186CO -0.26 -0.77 -0.08 0.21 -2.94 0.00 0.00 177.10 173.27 3bfv s ASN 1187N -2.52 4.22 0.36 3.54 3.84 -1.26 -3.56 114.94 119.56 3bfv s ASN 1187Ca 0.02 -0.34 0.04 0.00 0.21 0.00 0.00 52.86 52.79 3bfv s ASN 1187Cb -0.01 -1.69 0.69 0.00 -0.55 0.00 0.00 41.25 39.69 3bfv s ASN 1187CO -0.10 0.07 1.99 0.07 -2.79 0.00 0.00 177.10 176.34 3bfv h LYS 1188N 7.42 0.78 -0.62 0.43 2.10 -0.65 -0.73 116.57 125.30 3bfv h LYS 1188Ca -0.35 -0.05 -0.09 0.00 -2.00 0.00 0.00 60.65 58.16 3bfv h LYS 1188Cb 1.18 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 32.31 3bfv h LYS 1188CO 0.59 0.52 0.03 -0.44 -2.00 0.00 0.00 179.45 178.15 3bfv h ASP 1189N 0.81 1.06 -0.42 7.07 3.32 -1.96 0.98 116.42 127.28 3bfv h ASP 1189Ca 0.27 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.94 3bfv h ASP 1189Cb 0.07 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 3bfv h ASP 1189CO -0.08 1.09 -0.06 -0.33 -1.72 0.00 0.00 179.24 178.15 3bfv h GLU 1190N 0.99 0.78 -0.60 3.56 5.08 -1.74 -1.06 114.58 121.58 3bfv h GLU 1190Ca 0.18 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 3bfv h GLU 1190Cb 0.53 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 3bfv h GLU 1190CO 0.03 0.88 0.20 0.28 -1.00 0.00 0.00 179.01 179.40 3bfv h VAL 1191N 0.60 1.24 -0.66 3.13 2.07 -1.04 -1.95 116.25 119.64 3bfv h VAL 1191Ca 0.11 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 3bfv h VAL 1191Cb 0.57 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 3bfv h VAL 1191CO 0.03 0.30 0.19 0.50 0.02 0.00 0.00 177.57 178.62 3bfv h LYS 1192N 0.85 1.03 -0.58 1.57 3.64 -0.73 -1.97 116.57 120.39 3bfv h LYS 1192Ca 0.20 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 3bfv h LYS 1192Cb 0.26 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 3bfv h LYS 1192CO -0.01 0.91 0.33 -0.22 -2.27 0.00 0.00 179.45 178.19 3bfv h LYS 1193N 0.96 0.80 -0.67 1.90 1.63 -0.97 -1.84 116.57 118.38 3bfv h LYS 1193Ca 0.21 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 3bfv h LYS 1193Cb 0.32 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 3bfv h LYS 1193CO -0.00 0.60 0.43 0.78 -3.45 0.00 0.00 179.45 177.81 3bfv h GLY 1194N 0.78 0.96 0.69 5.01 0.00 -1.16 -1.41 103.07 107.94 3bfv h GLY 1194Ca 0.20 -0.37 0.04 0.00 0.00 0.00 0.00 47.33 47.20 3bfv h GLY 1194CO -0.03 0.36 0.04 1.70 0.00 0.00 0.00 176.54 178.61 3bfv h LYS 1195N 0.91 0.13 -0.82 4.80 3.64 -1.07 -1.79 116.57 122.37 3bfv h LYS 1195Ca 0.24 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.59 3bfv h LYS 1195Cb -0.08 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 3bfv h LYS 1195CO -0.05 0.08 0.40 0.93 -2.27 0.00 0.00 179.45 178.54 3bfv h GLU 1196N 0.13 1.18 -0.74 1.90 5.08 -1.13 -0.40 114.58 120.59 3bfv h GLU 1196Ca 0.12 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3bfv h GLU 1196Cb 0.12 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 3bfv h GLU 1196CO -0.16 0.90 0.39 -0.07 -1.00 0.00 0.00 179.01 179.07 3bfv h LEU 1197N 1.16 0.95 -0.13 1.33 3.38 -1.04 -1.09 115.31 119.87 3bfv h LEU 1197Ca 0.28 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 3bfv h LEU 1197Cb 0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3bfv h LEU 1197CO -0.04 0.79 0.03 0.40 0.09 0.00 0.00 178.44 179.72 3bfv h ILE 1198N 1.03 1.19 -0.08 1.22 1.08 -0.89 -3.02 117.51 118.05 3bfv h ILE 1198Ca 0.26 -0.61 -0.04 0.00 -0.39 0.00 0.00 64.86 64.09 3bfv h ILE 1198Cb 0.07 1.35 -0.01 0.00 -3.07 0.00 0.00 36.82 35.16 3bfv h ILE 1198CO -0.04 0.18 -0.12 -0.33 -0.69 0.00 0.00 178.15 177.15 3bfv h GLU 1199N 0.02 0.12 0.00 2.37 5.08 -0.94 -1.73 114.58 119.49 3bfv h GLU 1199Ca 0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3bfv h GLU 1199Cb 0.25 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3bfv h GLU 1199CO 0.00 0.25 0.00 0.00 -1.00 0.00 0.00 179.01 178.26 3bfv n ALA 1200N -2.50 1.50 0.61 3.43 0.00 -0.43 -1.77 120.51 121.35 3bfv n ALA 1200Ca -0.02 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.59 3bfv n ALA 1200Cb 0.23 -1.27 0.42 0.00 0.00 0.00 0.00 19.45 18.83 3bfv n ALA 1200CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3bfv n THR 1201N -1.85 0.61 -0.02 0.00 -2.24 -0.65 -4.92 114.28 105.21 3bfv n THR 1201Ca 0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 3bfv n THR 1201Cb 0.15 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 3bfv n THR 1201CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bfv n GLY 1202N 1.19 1.24 3.77 3.38 0.00 -0.73 -4.79 105.19 109.25 3bfv n GLY 1202Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3bfv n GLY 1202CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bfv s ALA 1203N -2.45 2.55 -0.11 4.61 0.00 -1.26 -5.00 121.76 120.10 3bfv s ALA 1203Ca 0.00 0.76 -0.27 0.00 0.00 0.00 0.00 51.96 52.45 3bfv s ALA 1203Cb 0.00 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 3bfv s ALA 1203CO 0.00 -1.09 0.90 0.21 0.00 0.00 0.00 175.76 175.78 3bfv s LYS 1204N -3.63 4.40 -0.70 0.00 2.20 -0.09 -4.65 119.74 117.27 3bfv s LYS 1204Ca 0.71 1.19 -0.22 0.00 -0.36 0.00 0.00 55.97 57.29 3bfv s LYS 1204Cb -0.24 -3.53 0.08 0.00 -1.51 0.00 0.00 37.83 32.63 3bfv s LYS 1204CO 0.34 -0.23 1.00 -1.17 -0.36 0.00 0.00 175.35 174.93 3bfv s LEU 1205N 1.77 4.45 0.26 5.43 0.20 -1.26 -0.69 118.68 128.83 3bfv s LEU 1205Ca 0.44 -1.13 -0.03 0.00 0.69 0.00 0.00 54.13 54.09 3bfv s LEU 1205Cb -0.18 -2.42 0.38 0.00 -0.43 0.00 0.00 46.19 43.54 3bfv s LEU 1205CO 0.17 -1.40 1.88 -0.07 -0.29 0.00 0.00 176.35 176.64 3bfv h LEU 1206N 11.27 0.99 0.00 -0.68 3.38 -1.41 -3.48 115.31 125.38 3bfv h LEU 1206Ca -0.22 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3bfv h LEU 1206Cb 1.06 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3bfv h LEU 1206CO 1.18 0.64 0.00 0.61 0.09 0.00 0.00 178.44 180.95 3bfv n GLY 1207N -1.35 -2.00 3.72 0.83 0.00 -1.25 -4.69 105.19 100.45 3bfv n GLY 1207Ca 0.15 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.61 3bfv n GLY 1207CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bfv s VAL 1208N -2.49 4.52 -0.33 1.61 1.01 -0.02 -1.73 120.40 122.97 3bfv s VAL 1208Ca 0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 61.98 61.68 3bfv s VAL 1208Cb 0.00 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.46 3bfv s VAL 1208CO 0.00 0.57 0.15 -0.69 0.00 0.00 0.00 175.10 175.14 3bfv s VAL 1209N -0.94 4.41 0.07 2.92 1.01 -0.35 0.04 120.40 127.56 3bfv s VAL 1209Ca 0.15 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 61.16 3bfv s VAL 1209Cb -0.11 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 3bfv s VAL 1209CO 0.04 -0.05 1.05 -0.76 0.00 0.00 0.00 175.10 175.38 3bfv s LEU 1210N 1.56 4.42 0.23 3.92 1.43 -0.74 -1.50 118.68 128.00 3bfv s LEU 1210Ca 0.03 1.85 0.11 0.00 -1.03 0.00 0.00 54.13 55.09 3bfv s LEU 1210Cb -0.18 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 3bfv s LEU 1210CO 0.05 -0.25 -0.20 0.21 0.23 0.00 0.00 176.35 176.39 3bfv s ASN 1211N 0.58 3.30 -1.62 2.29 2.47 0.02 0.09 114.94 122.08 3bfv s ASN 1211Ca 0.52 -0.96 -0.03 0.00 0.42 0.00 0.00 52.86 52.81 3bfv s ASN 1211Cb -0.25 -0.25 0.01 0.00 -1.45 0.00 0.00 41.25 39.31 3bfv s ASN 1211CO 0.30 0.03 0.38 0.54 -3.72 0.00 0.00 177.10 174.63 3bfv n ARG 1212N -0.21 -3.71 -2.03 0.43 1.74 0.01 -1.25 116.66 111.64 3bfv n ARG 1212Ca -0.09 0.93 -0.37 0.00 -0.77 0.00 0.00 57.85 57.55 3bfv n ARG 1212Cb 0.58 -5.72 0.02 0.00 -1.02 0.00 0.00 32.46 26.33 3bfv n ARG 1212CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3bfv s MET 1213N -5.47 3.36 0.19 5.56 -1.94 -0.60 -4.13 119.30 116.26 3bfv s MET 1213Ca 0.20 1.95 -0.09 0.00 -1.71 0.00 0.00 55.69 56.04 3bfv s MET 1213Cb -0.09 -2.25 0.09 0.00 2.01 0.00 0.00 34.83 34.59 3bfv s MET 1213CO 0.24 -0.93 1.68 -1.35 -0.01 0.00 0.00 175.02 174.65 3bfv h PRO 1214N 1.58 1.08 0.00 2.03 0.11 -1.93 0.73 132.00 135.61 3bfv h PRO 1214Ca -0.50 -0.29 0.00 0.00 0.11 0.00 0.00 66.00 65.31 3bfv h PRO 1214Cb 1.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3bfv h PRO 1214CO 0.58 1.00 0.00 1.63 -0.21 0.00 0.00 178.00 181.00