#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u6r n PHE 2 N 0.00 -0.36 0.16 0.54 3.01 -1.26 -2.99 117.46 116.56 1u6r n PHE 2 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.51 1u6r n PHE 2 Cb 0.00 0.11 0.52 0.00 -0.01 0.00 0.00 39.48 40.10 1u6r n PHE 2 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1u6r h GLY 3 N 0.00 0.21 2.00 1.37 0.00 -2.05 -2.96 103.07 101.63 1u6r h GLY 3 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1u6r h GLY 3 CO 0.00 0.09 -0.01 -0.57 0.00 0.00 0.00 176.54 176.04 1u6r h ASN 4 N 0.19 0.00 -0.93 0.19 -0.73 -1.96 -0.68 115.58 111.66 1u6r h ASN 4 Ca 0.05 0.00 0.27 0.00 1.87 0.00 0.00 56.30 58.49 1u6r h ASN 4 Cb 0.10 0.00 -0.15 0.00 0.27 0.00 0.00 38.32 38.54 1u6r h ASN 4 CO -0.00 0.01 0.34 0.74 -0.37 0.00 0.00 177.43 178.15 1u6r h THR 5 N 0.00 0.27 -0.54 -3.57 2.02 -1.42 -2.33 112.91 107.35 1u6r h THR 5 Ca -0.00 -0.08 -0.39 0.00 0.77 0.00 0.00 66.41 66.71 1u6r h THR 5 Cb 0.02 0.03 -0.33 0.00 -1.74 0.00 0.00 68.15 66.14 1u6r h THR 5 CO 0.00 0.04 -0.78 0.00 0.37 0.00 0.00 175.52 175.16 1u6r n HIS 6 N -5.19 1.95 -2.37 3.16 1.44 -0.28 -4.85 115.22 109.07 1u6r n HIS 6 Ca 0.26 -2.01 -0.42 0.00 -2.01 0.00 0.00 57.72 53.53 1u6r n HIS 6 Cb 0.82 -0.31 -0.02 0.00 0.12 0.00 0.00 29.99 30.60 1u6r n HIS 6 CO 0.00 0.00 0.00 1.21 -2.81 0.00 0.00 176.34 174.74 1u6r s ASN 7 N -3.49 6.26 0.32 4.39 3.84 -0.88 -4.88 114.94 120.50 1u6r s ASN 7 Ca 0.46 0.60 0.26 0.00 0.21 0.00 0.00 52.86 54.39 1u6r s ASN 7 Cb 0.39 -2.54 1.02 0.00 -0.55 0.00 0.00 41.25 39.57 1u6r s ASN 7 CO 0.00 -1.54 1.78 0.11 -2.79 0.00 0.00 177.10 174.66 1u6r h LYS 8 N 10.82 0.00 0.00 0.43 1.57 -1.92 -3.04 116.57 124.43 1u6r h LYS 8 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1u6r h LYS 8 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1u6r h LYS 8 CO 1.12 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 180.66 1u6r n TYR 9 N -2.46 0.00 0.01 -1.35 4.01 -1.26 -3.41 117.16 112.70 1u6r n TYR 9 Ca 0.02 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.90 1u6r n TYR 9 Cb 0.28 -0.46 0.59 0.00 -0.31 0.00 0.00 39.34 39.44 1u6r n TYR 9 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1u6r h LYS 10 N 0.00 0.19 -1.02 -0.72 1.57 -1.93 0.62 116.57 115.28 1u6r h LYS 10 Ca 0.00 -0.01 0.25 0.00 -1.87 0.00 0.00 60.65 59.02 1u6r h LYS 10 Cb 0.44 -0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.61 1u6r h LYS 10 CO 0.00 0.13 0.65 1.25 -0.57 0.00 0.00 179.45 180.90 1u6r h LEU 11 N 0.20 0.52 0.00 2.94 5.85 -1.83 -2.54 115.31 120.45 1u6r h LEU 11 Ca 0.21 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1u6r h LEU 11 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1u6r h LEU 11 CO -0.04 0.12 0.00 0.59 -0.34 0.00 0.00 178.44 178.77 1u6r n ASN 12 N -4.67 0.00 -4.64 1.25 3.02 0.21 -4.80 115.26 105.63 1u6r n ASN 12 Ca 0.25 0.07 -0.30 0.00 -0.03 0.00 0.00 54.58 54.57 1u6r n ASN 12 Cb 0.81 -0.35 -0.09 0.00 -0.61 0.00 0.00 39.78 39.54 1u6r n ASN 12 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1u6r s TYR 13 N -2.71 2.87 0.63 3.10 2.02 -0.96 -5.11 117.35 117.20 1u6r s TYR 13 Ca 0.23 -0.09 -0.16 0.00 -0.37 0.00 0.00 57.07 56.68 1u6r s TYR 13 Cb 0.19 -1.49 -0.01 0.00 -0.40 0.00 0.00 41.96 40.25 1u6r s TYR 13 CO 0.46 0.46 1.11 0.15 -1.57 0.00 0.00 175.55 176.16 1u6r s LYS 14 N -2.26 2.95 0.20 -0.62 1.02 -1.26 -4.89 119.74 114.87 1u6r s LYS 14 Ca 0.24 1.43 -0.13 0.00 0.02 0.00 0.00 55.97 57.53 1u6r s LYS 14 Cb -0.11 -1.97 0.23 0.00 -0.52 0.00 0.00 37.83 35.46 1u6r s LYS 14 CO 0.16 -1.14 1.66 1.03 -0.92 0.00 0.00 175.35 176.14 1u6r h SER 15 N 0.31 -0.34 0.45 2.83 0.87 -1.97 -0.63 113.55 115.07 1u6r h SER 15 Ca -0.47 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.23 1u6r h SER 15 Cb 1.25 0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1u6r h SER 15 CO 0.55 -0.13 -0.04 1.05 -0.53 0.00 0.00 176.83 177.73 1u6r h GLU 16 N 0.07 0.00 0.00 2.24 9.09 -1.95 0.28 114.58 124.31 1u6r h GLU 16 Ca 0.29 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.54 1u6r h GLU 16 Cb 0.45 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.53 1u6r h GLU 16 CO -0.52 0.04 -0.72 0.93 0.05 0.00 0.00 179.01 178.80 1u6r h GLU 17 N 0.00 0.00 0.00 1.06 5.08 -1.48 -3.28 114.58 115.96 1u6r h GLU 17 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1u6r h GLU 17 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1u6r h GLU 17 CO 0.01 0.72 -1.18 0.39 -1.00 0.00 0.00 179.01 177.95 1u6r n GLU 18 N -3.59 0.20 -1.79 2.33 -0.58 -0.68 -4.98 120.64 111.56 1u6r n GLU 18 Ca -0.00 -0.04 -0.42 0.00 -0.42 0.00 0.00 57.16 56.28 1u6r n GLU 18 Cb 0.73 -1.52 -0.02 0.00 -0.57 0.00 0.00 31.44 30.05 1u6r n GLU 18 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 1u6r s TYR 19 N -3.15 2.85 0.60 -0.32 5.04 0.00 -4.94 117.35 117.44 1u6r s TYR 19 Ca 0.04 0.61 -0.17 0.00 -2.44 0.00 0.00 57.07 55.10 1u6r s TYR 19 Cb 0.15 -4.07 -0.03 0.00 0.35 0.00 0.00 41.96 38.36 1u6r s TYR 19 CO 0.85 -3.81 1.13 -1.25 -1.34 0.00 0.00 175.55 171.13 1u6r s PRO 20 N 0.31 3.03 -0.63 4.97 0.04 -1.26 -4.96 135.00 136.50 1u6r s PRO 20 Ca 0.68 1.55 -0.22 0.00 0.04 0.00 0.00 61.00 63.06 1u6r s PRO 20 Cb -0.48 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.17 1u6r s PRO 20 CO 0.40 -1.10 0.90 0.34 0.04 0.00 0.00 177.00 177.58 1u6r s ASP 21 N -2.09 6.19 -0.18 6.66 2.15 -1.26 -4.86 116.67 123.28 1u6r s ASP 21 Ca 0.71 -1.02 0.16 0.00 0.43 0.00 0.00 52.55 52.83 1u6r s ASP 21 Cb -0.23 -2.39 0.66 0.00 -0.30 0.00 0.00 42.92 40.65 1u6r s ASP 21 CO 0.34 -1.34 1.57 0.18 -0.17 0.00 0.00 175.17 175.75 1u6r n LEU 22 N 7.36 4.66 -4.78 -1.34 4.77 -1.26 -4.95 117.00 121.46 1u6r n LEU 22 Ca -0.05 -2.83 -0.41 0.00 -0.03 0.00 0.00 56.01 52.70 1u6r n LEU 22 Cb 0.45 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1u6r n LEU 22 CO 0.63 0.69 1.13 -0.94 -1.33 0.00 0.00 177.39 177.56 1u6r s SER 23 N -1.28 6.27 -1.30 -1.43 1.04 -1.26 -2.07 113.70 113.67 1u6r s SER 23 Ca 0.47 3.05 -0.09 0.00 0.48 0.00 0.00 55.95 59.85 1u6r s SER 23 Cb 0.35 -2.67 0.07 0.00 0.10 0.00 0.00 66.02 63.88 1u6r s SER 23 CO 0.15 -0.92 0.49 0.29 0.98 0.00 0.00 173.24 174.23 1u6r n LYS 24 N 0.36 -3.41 -3.86 4.02 5.02 -1.26 -4.97 118.16 114.06 1u6r n LYS 24 Ca 0.01 0.48 -0.36 0.00 -2.02 0.00 0.00 58.31 56.43 1u6r n LYS 24 Cb 0.39 -5.19 -0.06 0.00 -0.02 0.00 0.00 35.03 30.16 1u6r n LYS 24 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1u6r s HIS 25 N -2.94 3.59 -0.50 2.13 3.76 -0.88 -4.89 115.29 115.55 1u6r s HIS 25 Ca 0.40 0.51 0.06 0.00 -0.15 0.00 0.00 55.06 55.89 1u6r s HIS 25 Cb -0.21 -1.93 0.23 0.00 1.11 0.00 0.00 32.58 31.77 1u6r s HIS 25 CO 0.50 0.70 0.56 -1.71 -0.85 0.00 0.00 174.74 173.93 1u6r n ASN 26 N 1.61 1.42 -4.08 1.40 5.15 0.15 -4.90 115.26 116.02 1u6r n ASN 26 Ca -0.16 -2.92 -0.10 0.00 -0.60 0.00 0.00 54.58 50.80 1u6r n ASN 26 Cb 0.54 -0.65 -0.09 0.00 -0.53 0.00 0.00 39.78 39.06 1u6r n ASN 26 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1u6r s ASN 27 N -1.39 0.15 0.25 1.20 2.20 -1.25 -4.56 114.94 111.53 1u6r s ASN 27 Ca 0.35 -1.10 -0.03 0.00 -0.94 0.00 0.00 52.86 51.13 1u6r s ASN 27 Cb 0.12 0.39 0.30 0.00 -2.00 0.00 0.00 41.25 40.06 1u6r s ASN 27 CO -0.10 -0.85 1.79 0.45 -2.94 0.00 0.00 177.10 175.45 1u6r h HIS 28 N 2.65 0.96 -0.37 1.54 3.86 -1.06 -2.50 115.15 120.23 1u6r h HIS 28 Ca -0.33 -0.10 0.02 0.00 -1.16 0.00 0.00 60.37 58.80 1u6r h HIS 28 Cb 1.22 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 29.39 1u6r h HIS 28 CO 0.40 0.80 0.19 1.98 0.86 0.00 0.00 177.93 182.17 1u6r h MET 29 N 0.88 0.38 0.00 2.45 1.85 -1.10 -2.55 114.93 116.85 1u6r h MET 29 Ca 0.19 -0.02 -0.02 0.00 -0.61 0.00 0.00 59.70 59.24 1u6r h MET 29 Cb 0.34 -0.09 -0.00 0.00 0.43 0.00 0.00 31.60 32.28 1u6r h MET 29 CO 0.00 0.25 -0.08 0.00 -0.40 0.00 0.00 176.91 176.68 1u6r h ALA 30 N 1.18 1.05 0.00 0.39 0.00 -1.75 0.05 119.26 120.19 1u6r h ALA 30 Ca 0.15 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1u6r h ALA 30 Cb 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1u6r h ALA 30 CO -0.10 0.10 -0.28 -0.22 0.00 0.00 0.00 179.25 178.76 1u6r h LYS 31 N 0.00 0.00 0.00 0.00 3.64 -1.07 -3.37 116.57 115.77 1u6r h LYS 31 Ca -0.00 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.16 1u6r h LYS 31 Cb 0.50 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 1u6r h LYS 31 CO 0.01 0.28 -1.83 0.28 -2.27 0.00 0.00 179.45 175.92 1u6r n VAL 32 N -3.39 0.84 -1.74 2.00 0.31 -0.53 -5.01 118.33 110.81 1u6r n VAL 32 Ca 0.00 -0.33 -0.42 0.00 -0.01 0.00 0.00 64.34 63.59 1u6r n VAL 32 Cb 0.48 -1.01 -0.01 0.00 -0.91 0.00 0.00 33.84 32.39 1u6r n VAL 32 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1u6r n LEU 33 N -2.91 4.17 -4.30 7.52 7.94 -0.11 -5.01 117.00 124.29 1u6r n LEU 33 Ca -0.26 1.19 -0.16 0.00 -1.11 0.00 0.00 56.01 55.67 1u6r n LEU 33 Cb 0.78 -1.56 -0.10 0.00 0.53 0.00 0.00 43.42 43.07 1u6r n LEU 33 CO 0.15 -0.07 -0.39 0.42 -1.11 0.00 0.00 177.39 176.39 1u6r s THR 34 N -0.64 1.28 0.27 1.96 -4.23 -1.26 -4.97 115.64 108.05 1u6r s THR 34 Ca 0.59 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 1u6r s THR 34 Cb -0.52 -2.06 0.25 0.00 1.34 0.00 0.00 72.50 71.51 1u6r s THR 34 CO 0.57 -0.57 1.76 -0.65 -0.54 0.00 0.00 174.62 175.19 1u6r h PRO 35 N 2.62 0.60 -0.52 3.99 0.11 -1.99 -1.52 132.00 135.29 1u6r h PRO 35 Ca -0.38 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.62 1u6r h PRO 35 Cb 1.21 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1u6r h PRO 35 CO 0.64 0.40 0.01 -0.44 -0.21 0.00 0.00 178.00 178.39 1u6r h ASP 36 N 0.62 0.90 -0.45 -2.05 5.19 -1.99 -0.55 116.42 118.08 1u6r h ASP 36 Ca 0.49 -0.30 -0.02 0.00 -0.62 0.00 0.00 57.03 56.57 1u6r h ASP 36 Cb 0.72 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 1u6r h ASP 36 CO -0.38 0.98 0.19 -0.07 -3.12 0.00 0.00 179.24 176.84 1u6r h LEU 37 N 0.79 0.62 -0.16 1.55 3.38 -1.88 -1.00 115.31 118.61 1u6r h LEU 37 Ca 0.15 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1u6r h LEU 37 Cb 0.52 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1u6r h LEU 37 CO 0.03 0.61 0.09 0.22 0.09 0.00 0.00 178.44 179.48 1u6r h TYR 38 N 0.59 0.22 -0.90 1.13 3.20 -1.14 -1.47 116.97 118.59 1u6r h TYR 38 Ca 0.15 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.06 1u6r h TYR 38 Cb 0.18 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.33 1u6r h TYR 38 CO 0.00 0.21 0.58 -0.22 -1.64 0.00 0.00 178.16 177.09 1u6r h LYS 39 N 0.17 1.08 -0.44 1.82 3.64 -0.95 -0.51 116.57 121.39 1u6r h LYS 39 Ca 0.06 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 1u6r h LYS 39 Cb 0.06 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1u6r h LYS 39 CO -0.01 0.72 -0.18 -0.22 -2.27 0.00 0.00 179.45 177.48 1u6r h LYS 40 N 1.12 0.86 -0.00 1.90 3.64 -0.89 -3.34 116.57 119.85 1u6r h LYS 40 Ca 0.37 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1u6r h LYS 40 Cb 0.04 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1u6r h LYS 40 CO -0.13 0.97 -0.56 1.28 -2.27 0.00 0.00 179.45 178.75 1u6r n LEU 41 N -4.12 0.89 0.14 5.20 4.77 -0.58 -4.52 117.00 118.77 1u6r n LEU 41 Ca 0.01 -0.57 0.12 0.00 -0.03 0.00 0.00 56.01 55.53 1u6r n LEU 41 Cb 0.42 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 42.01 1u6r n LEU 41 CO 0.45 0.20 0.86 -2.11 -1.33 0.00 0.00 177.39 175.46 1u6r n ARG 42 N -1.00 0.20 -0.40 3.23 1.85 -0.23 -1.93 116.66 118.38 1u6r n ARG 42 Ca 0.04 0.43 0.09 0.00 -1.00 0.00 0.00 57.85 57.41 1u6r n ARG 42 Cb 0.24 -1.89 0.28 0.00 -1.05 0.00 0.00 32.46 30.05 1u6r n ARG 42 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1u6r n ASP 43 N -2.27 3.93 -4.94 2.89 5.75 -1.26 -4.83 116.55 115.82 1u6r n ASP 43 Ca 0.02 -2.22 -0.27 0.00 -0.01 0.00 0.00 54.79 52.31 1u6r n ASP 43 Cb 0.23 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 39.83 1u6r n ASP 43 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1u6r s LYS 44 N -1.40 3.45 0.04 0.11 -0.14 -0.81 -5.12 119.74 115.86 1u6r s LYS 44 Ca 0.42 -0.54 -0.10 0.00 -1.36 0.00 0.00 55.97 54.39 1u6r s LYS 44 Cb 0.25 -2.97 0.01 0.00 -1.68 0.00 0.00 37.83 33.43 1u6r s LYS 44 CO 0.24 0.53 0.22 -1.83 -0.76 0.00 0.00 175.35 173.76 1u6r s GLU 45 N -3.05 0.72 0.81 1.68 -1.05 -1.26 -4.38 118.70 112.17 1u6r s GLU 45 Ca 0.35 -0.61 -0.12 0.00 -0.15 0.00 0.00 54.97 54.45 1u6r s GLU 45 Cb -0.12 0.30 0.10 0.00 -0.44 0.00 0.00 34.13 33.97 1u6r s GLU 45 CO 0.28 -0.22 1.17 0.95 0.95 0.00 0.00 175.26 178.40 1u6r s THR 46 N -2.58 2.04 0.63 1.83 -4.23 -0.38 -4.91 115.64 108.04 1u6r s THR 46 Ca -0.05 -0.05 0.38 0.00 -1.18 0.00 0.00 61.69 60.79 1u6r s THR 46 Cb -0.01 -2.99 0.41 0.00 1.34 0.00 0.00 72.50 71.24 1u6r s THR 46 CO -0.04 0.00 2.32 -0.65 -0.54 0.00 0.00 174.62 175.71 1u6r h PRO 47 N -1.07 0.00 -0.36 3.99 0.11 -1.97 0.13 132.00 132.83 1u6r h PRO 47 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1u6r h PRO 47 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1u6r h PRO 47 CO 0.61 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.27 1u6r n SER 48 N -3.43 2.73 0.00 -2.05 3.41 -1.26 -4.95 113.62 108.07 1u6r n SER 48 Ca -0.03 -1.91 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 1u6r n SER 48 Cb 0.08 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1u6r n SER 48 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u6r n GLY 49 N 1.35 0.52 3.74 5.00 0.00 0.03 -5.04 105.19 110.79 1u6r n GLY 49 Ca 0.18 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.98 1u6r n GLY 49 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1u6r s PHE 50 N -2.00 3.75 0.37 1.61 5.36 -1.26 -4.77 117.98 121.04 1u6r s PHE 50 Ca 0.00 1.75 0.05 0.00 -0.96 0.00 0.00 56.93 57.78 1u6r s PHE 50 Cb 0.00 -3.15 -0.07 0.00 -0.34 0.00 0.00 43.02 39.46 1u6r s PHE 50 CO 0.00 -0.12 0.04 0.95 -1.46 0.00 0.00 175.22 174.63 1u6r s THR 51 N -0.65 1.55 0.22 0.12 -4.23 -1.26 -1.25 115.64 110.14 1u6r s THR 51 Ca 0.45 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.88 1u6r s THR 51 Cb -0.28 -2.87 0.17 0.00 1.34 0.00 0.00 72.50 70.86 1u6r s THR 51 CO 0.34 0.00 1.84 0.25 -0.54 0.00 0.00 174.62 176.51 1u6r h LEU 52 N 1.94 0.73 -1.18 4.79 5.85 -1.79 -1.08 115.31 124.57 1u6r h LEU 52 Ca -0.42 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.32 1u6r h LEU 52 Cb 1.24 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1u6r h LEU 52 CO 0.75 0.49 0.56 0.44 -0.34 0.00 0.00 178.44 180.33 1u6r h ASP 53 N 0.87 0.96 -0.53 1.25 3.32 -1.93 -1.75 116.42 118.60 1u6r h ASP 53 Ca 0.32 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.28 1u6r h ASP 53 Cb 0.10 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1u6r h ASP 53 CO -0.15 0.69 0.06 0.44 -1.72 0.00 0.00 179.24 178.55 1u6r h ASP 54 N 1.13 0.88 -0.42 6.45 3.32 -1.66 -2.06 116.42 124.05 1u6r h ASP 54 Ca 0.31 -0.28 0.08 0.00 0.02 0.00 0.00 57.03 57.17 1u6r h ASP 54 Cb -0.10 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.14 1u6r h ASP 54 CO -0.07 0.94 -0.04 0.58 -1.72 0.00 0.00 179.24 178.93 1u6r h VAL 55 N 0.79 0.65 -0.01 -1.35 2.07 -0.58 -3.20 116.25 114.61 1u6r h VAL 55 Ca 0.16 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.66 1u6r h VAL 55 Cb 0.45 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1u6r h VAL 55 CO 0.02 0.01 -0.41 2.30 0.02 0.00 0.00 177.57 179.51 1u6r n ILE 56 N -5.24 0.00 -0.25 4.57 -5.35 -0.72 -1.35 119.36 111.02 1u6r n ILE 56 Ca 0.03 -0.12 0.03 0.00 -0.27 0.00 0.00 62.75 62.42 1u6r n ILE 56 Cb 0.22 0.61 0.16 0.00 -1.74 0.00 0.00 39.64 38.89 1u6r n ILE 56 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1u6r h GLN 57 N 1.16 0.50 -0.36 6.28 5.75 -1.37 -1.29 115.11 125.78 1u6r h GLN 57 Ca 0.00 -0.03 -0.06 0.00 -0.15 0.00 0.00 58.65 58.41 1u6r h GLN 57 Cb 0.56 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.98 1u6r h GLN 57 CO 0.00 0.33 -0.01 0.00 -2.65 0.00 0.00 178.83 176.50 1u6r h THR 58 N 0.51 1.21 0.00 2.39 1.03 -1.79 -0.75 112.91 115.51 1u6r h THR 58 Ca 0.38 -0.85 -0.02 0.00 -0.01 0.00 0.00 66.41 65.90 1u6r h THR 58 Cb 0.51 0.95 -0.00 0.00 -1.07 0.00 0.00 68.15 68.54 1u6r h THR 58 CO -0.34 0.29 -0.12 1.23 -0.01 0.00 0.00 175.52 176.57 1u6r h GLY 59 N 0.88 0.00 0.45 2.99 0.00 -0.29 0.10 103.07 107.20 1u6r h GLY 59 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.41 1u6r h GLY 59 CO 0.01 0.00 -0.13 -2.08 0.00 0.00 0.00 176.54 174.35 1u6r h VAL 60 N 0.00 1.50 -0.03 4.60 2.07 -0.72 -3.35 116.25 120.32 1u6r h VAL 60 Ca -0.00 -1.66 -0.11 0.00 0.82 0.00 0.00 66.70 65.74 1u6r h VAL 60 Cb 0.86 2.54 -0.01 0.00 -1.52 0.00 0.00 31.29 33.16 1u6r h VAL 60 CO 0.02 0.45 -0.51 0.44 0.02 0.00 0.00 177.57 177.98 1u6r h ASP 61 N -0.49 0.08 -3.80 0.57 5.19 -1.06 -3.38 116.42 113.52 1u6r h ASP 61 Ca -0.01 -0.04 -0.65 0.00 -0.62 0.00 0.00 57.03 55.71 1u6r h ASP 61 Cb 0.80 -0.02 -0.40 0.00 0.18 0.00 0.00 39.33 39.89 1u6r h ASP 61 CO 0.03 0.58 -0.50 0.20 -3.12 0.00 0.00 179.24 176.43 1u6r s ASN 62 N -6.88 4.86 0.52 6.45 0.01 0.34 -4.95 114.94 115.29 1u6r s ASN 62 Ca -0.03 -3.36 0.21 0.00 -0.71 0.00 0.00 52.86 48.98 1u6r s ASN 62 Cb 0.13 -1.71 1.38 0.00 0.41 0.00 0.00 41.25 41.46 1u6r s ASN 62 CO 0.76 -0.20 2.12 1.55 -1.51 0.00 0.00 177.10 179.82 1u6r h PRO 63 N 6.16 0.00 0.00 -0.60 0.13 -1.76 -3.43 132.00 132.51 1u6r h PRO 63 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1u6r h PRO 63 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1u6r h PRO 63 CO 0.72 0.07 0.00 0.41 -0.23 0.00 0.00 178.00 178.97 1u6r n GLY 64 N -1.19 3.55 3.33 1.56 0.00 -1.26 0.30 105.19 111.47 1u6r n GLY 64 Ca -0.03 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.83 1u6r n GLY 64 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1u6r s HIS 65 N -3.10 -0.42 0.40 1.61 2.46 -1.26 -5.00 115.29 109.98 1u6r s HIS 65 Ca 0.00 0.92 0.39 0.00 0.47 0.00 0.00 55.06 56.84 1u6r s HIS 65 Cb 0.00 0.17 1.92 0.00 -0.13 0.00 0.00 32.58 34.55 1u6r s HIS 65 CO 0.00 -0.32 2.19 -1.00 -2.47 0.00 0.00 174.74 173.13 1u6r h PRO 66 N 4.69 0.00 0.00 2.88 0.13 -2.00 -3.37 132.00 134.33 1u6r h PRO 66 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1u6r h PRO 66 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1u6r h PRO 66 CO 0.29 0.00 -0.81 1.19 -0.23 0.00 0.00 178.00 178.45 1u6r n PHE 67 N -3.10 0.00 -4.35 1.56 3.01 -1.26 -5.11 117.46 108.20 1u6r n PHE 67 Ca -0.01 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.27 1u6r n PHE 67 Cb 0.18 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.55 1u6r n PHE 67 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 1u6r s ILE 68 N -1.81 0.88 -0.04 4.37 -4.36 -1.26 -4.96 121.20 114.02 1u6r s ILE 68 Ca 0.00 -2.01 -0.27 0.00 -0.26 0.00 0.00 60.65 58.11 1u6r s ILE 68 Cb 0.00 -2.57 -0.03 0.00 1.25 0.00 0.00 42.46 41.11 1u6r s ILE 68 CO 0.00 -0.12 0.85 -0.32 0.24 0.00 0.00 174.94 175.60 1u6r s MET 69 N -3.94 4.48 0.17 0.37 -2.45 -1.26 -4.20 119.30 112.48 1u6r s MET 69 Ca 0.34 1.17 0.06 0.00 -1.25 0.00 0.00 55.69 56.00 1u6r s MET 69 Cb 0.07 -3.47 -0.04 0.00 1.25 0.00 0.00 34.83 32.65 1u6r s MET 69 CO 0.12 -0.03 0.11 0.95 1.05 0.00 0.00 175.02 177.22 1u6r s THR 70 N 1.04 4.29 0.10 10.11 -4.23 -1.26 -5.03 115.64 120.66 1u6r s THR 70 Ca 0.45 -1.20 -0.11 0.00 -1.18 0.00 0.00 61.69 59.66 1u6r s THR 70 Cb -0.19 -3.19 -0.19 0.00 1.34 0.00 0.00 72.50 70.26 1u6r s THR 70 CO 0.22 -0.13 1.27 0.58 -0.54 0.00 0.00 174.62 176.02 1u6r h VAL 71 N 2.10 1.31 0.00 2.29 2.07 -1.96 -1.15 116.25 120.90 1u6r h VAL 71 Ca -0.47 -2.19 0.00 0.00 0.82 0.00 0.00 66.70 64.85 1u6r h VAL 71 Cb 1.20 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 1u6r h VAL 71 CO 0.62 0.68 0.00 0.61 0.02 0.00 0.00 177.57 179.49 1u6r n GLY 72 N 0.90 0.46 3.52 2.17 0.00 -1.26 -0.56 105.19 110.42 1u6r n GLY 72 Ca -0.09 -0.55 -0.11 0.00 0.00 0.00 0.00 46.02 45.28 1u6r n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6r s VAL 74 N -3.79 0.40 0.15 0.00 -7.23 -0.45 -4.53 120.40 104.95 1u6r s VAL 74 Ca 0.03 -1.80 -0.09 0.00 -1.81 0.00 0.00 61.98 58.32 1u6r s VAL 74 Cb -0.02 -1.50 -0.06 0.00 0.56 0.00 0.00 36.38 35.36 1u6r s VAL 74 CO -0.08 -0.92 0.45 0.00 -0.31 0.00 0.00 175.10 174.24 1u6r s ALA 75 N -3.64 3.68 -1.01 1.32 0.00 -0.06 -4.35 121.76 117.71 1u6r s ALA 75 Ca 0.07 -0.38 0.14 0.00 0.00 0.00 0.00 51.96 51.80 1u6r s ALA 75 Cb 0.06 -2.30 -0.06 0.00 0.00 0.00 0.00 23.12 20.81 1u6r s ALA 75 CO -0.07 0.57 0.69 0.41 0.00 0.00 0.00 175.76 177.36 1u6r n GLY 76 N 0.35 -0.16 3.86 0.00 0.00 -1.26 -4.65 105.19 103.33 1u6r n GLY 76 Ca -0.04 -0.39 -0.00 0.00 0.00 0.00 0.00 46.02 45.59 1u6r n GLY 76 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1u6r s ASP 77 N -1.95 -0.02 0.20 1.61 1.47 -1.26 -0.75 116.67 115.96 1u6r s ASP 77 Ca 0.09 -0.40 -0.10 0.00 1.18 0.00 0.00 52.55 53.32 1u6r s ASP 77 Cb 0.11 0.33 0.13 0.00 -0.34 0.00 0.00 42.92 43.15 1u6r s ASP 77 CO 0.44 -0.64 1.81 -0.08 0.68 0.00 0.00 175.17 177.38 1u6r h GLU 78 N 2.00 1.02 0.00 2.11 4.81 -1.96 -2.86 114.58 119.70 1u6r h GLU 78 Ca -0.26 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 58.83 1u6r h GLU 78 Cb 1.21 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.39 1u6r h GLU 78 CO 0.32 0.77 -0.08 0.93 -0.73 0.00 0.00 179.01 180.22 1u6r h GLU 79 N 1.00 0.00 -0.82 1.92 3.07 -1.99 -2.85 114.58 114.90 1u6r h GLU 79 Ca 0.25 0.00 0.18 0.00 -0.50 0.00 0.00 59.36 59.30 1u6r h GLU 79 Cb 0.06 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 27.86 1u6r h GLU 79 CO -0.04 0.08 0.32 0.77 -1.40 0.00 0.00 179.01 178.74 1u6r h SER 80 N 0.00 0.24 0.81 1.42 0.02 -1.90 -0.30 113.55 113.84 1u6r h SER 80 Ca -0.00 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1u6r h SER 80 Cb 0.24 0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1u6r h SER 80 CO 0.01 0.02 -0.03 1.88 -1.14 0.00 0.00 176.83 177.57 1u6r h TYR 81 N 0.39 0.00 0.00 3.45 0.05 -1.70 -1.45 116.97 117.72 1u6r h TYR 81 Ca 0.48 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 59.04 1u6r h TYR 81 Cb 0.85 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.55 1u6r h TYR 81 CO -0.18 0.03 -1.30 2.41 -1.05 0.00 0.00 178.16 178.07 1u6r n THR 82 N -3.16 1.52 -0.30 -2.88 -1.04 -0.42 -3.31 114.28 104.69 1u6r n THR 82 Ca -0.00 -0.03 -0.01 0.00 -2.04 0.00 0.00 64.05 61.97 1u6r n THR 82 Cb 0.28 -2.07 0.12 0.00 -1.82 0.00 0.00 70.33 66.83 1u6r n THR 82 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1u6r h VAL 83 N -1.00 1.09 -0.60 12.58 2.07 -1.12 -2.57 116.25 126.71 1u6r h VAL 83 Ca -0.34 -0.34 -0.29 0.00 0.82 0.00 0.00 66.70 66.55 1u6r h VAL 83 Cb 1.24 0.01 -0.17 0.00 -1.52 0.00 0.00 31.29 30.84 1u6r h VAL 83 CO -0.21 0.18 0.20 0.49 0.02 0.00 0.00 177.57 178.26 1u6r n PHE 84 N -4.60 1.86 0.14 1.57 3.72 -0.55 -4.74 117.46 114.88 1u6r n PHE 84 Ca 0.11 -1.63 0.09 0.00 -0.05 0.00 0.00 57.45 55.97 1u6r n PHE 84 Cb 0.12 -0.66 0.59 0.00 -0.94 0.00 0.00 39.48 38.60 1u6r n PHE 84 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1u6r h LYS 85 N 1.15 0.14 0.00 -1.08 2.10 -1.45 -1.00 116.57 116.44 1u6r h LYS 85 Ca 0.36 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.98 1u6r h LYS 85 Cb 2.12 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 33.42 1u6r h LYS 85 CO 0.66 0.09 -0.11 -0.44 -2.00 0.00 0.00 179.45 177.65 1u6r h ASP 86 N 0.14 0.00 0.02 7.07 3.32 -1.85 0.70 116.42 125.82 1u6r h ASP 86 Ca 0.09 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.90 1u6r h ASP 86 Cb 0.17 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1u6r h ASP 86 CO -0.01 0.11 -1.29 0.25 -1.72 0.00 0.00 179.24 176.58 1u6r h LEU 87 N 0.00 0.06 -0.56 1.55 5.85 -1.61 -3.41 115.31 117.19 1u6r h LEU 87 Ca -0.00 -0.59 -0.03 0.00 0.84 0.00 0.00 57.88 58.09 1u6r h LEU 87 Cb 0.43 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1u6r h LEU 87 CO 0.01 1.52 0.21 -0.26 -0.34 0.00 0.00 178.44 179.58 1u6r h PHE 88 N -0.85 0.86 -0.17 1.25 0.04 -1.16 -3.22 116.94 113.68 1u6r h PHE 88 Ca -0.34 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 60.36 1u6r h PHE 88 Cb 1.39 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 39.28 1u6r h PHE 88 CO 0.11 0.70 0.10 -0.44 -0.60 0.00 0.00 178.31 178.18 1u6r h ASP 89 N 0.77 0.21 -0.23 2.17 3.32 -1.09 0.85 116.42 122.42 1u6r h ASP 89 Ca 0.18 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1u6r h ASP 89 Cb 0.22 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1u6r h ASP 89 CO -0.01 0.22 0.13 -0.65 -1.72 0.00 0.00 179.24 177.21 1u6r h PRO 90 N 0.19 0.34 -0.12 3.56 0.11 -1.80 -0.68 132.00 133.60 1u6r h PRO 90 Ca 0.06 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.11 1u6r h PRO 90 Cb 0.05 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.09 1u6r h PRO 90 CO -0.01 0.27 -0.05 0.82 -0.21 0.00 0.00 178.00 178.82 1u6r h ILE 91 N 0.35 1.31 -0.58 4.15 2.04 -1.35 -1.72 117.51 121.70 1u6r h ILE 91 Ca 0.09 -1.04 0.05 0.00 1.00 0.00 0.00 64.86 64.96 1u6r h ILE 91 Cb 0.03 1.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 1u6r h ILE 91 CO -0.01 0.30 0.31 0.40 0.00 0.00 0.00 178.15 179.15 1u6r h ILE 92 N -0.08 0.96 -0.33 -0.67 2.04 -0.67 0.26 117.51 119.01 1u6r h ILE 92 Ca 0.03 -0.20 0.02 0.00 1.00 0.00 0.00 64.86 65.70 1u6r h ILE 92 Cb 0.49 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1u6r h ILE 92 CO 0.02 0.11 0.18 -0.61 0.00 0.00 0.00 178.15 177.85 1u6r h GLN 93 N 0.59 0.37 -0.11 2.37 4.15 -1.03 -1.33 115.11 120.11 1u6r h GLN 93 Ca 0.26 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.65 1u6r h GLN 93 Cb 0.16 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 1u6r h GLN 93 CO -0.17 0.24 0.03 -0.44 -1.93 0.00 0.00 178.83 176.56 1u6r h ASP 94 N 0.38 0.16 -0.03 -0.69 3.32 -0.88 0.23 116.42 118.91 1u6r h ASP 94 Ca 0.13 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.87 1u6r h ASP 94 Cb 0.01 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1u6r h ASP 94 CO -0.07 0.33 -0.28 -0.09 -1.72 0.00 0.00 179.24 177.41 1u6r h ARG 95 N -0.01 0.46 -0.56 3.56 9.65 -0.32 -3.15 114.38 124.00 1u6r h ARG 95 Ca 0.04 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.73 1u6r h ARG 95 Cb 0.23 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 1u6r h ARG 95 CO -0.00 0.70 0.00 0.72 2.80 0.00 0.00 179.97 184.19 1u6r n HIS 96 N -4.11 1.92 -2.56 2.20 8.25 -0.52 -4.86 115.22 115.54 1u6r n HIS 96 Ca -0.01 -0.72 -0.05 0.00 -0.26 0.00 0.00 57.72 56.68 1u6r n HIS 96 Cb 0.42 -0.46 0.01 0.00 1.12 0.00 0.00 29.99 31.08 1u6r n HIS 96 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u6r n GLY 97 N 0.61 0.49 0.00 -1.41 0.00 -1.18 -4.25 105.19 99.45 1u6r n GLY 97 Ca 0.27 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1u6r n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6r n GLY 98 N -0.89 1.31 3.62 -0.02 0.00 0.81 -5.05 105.19 104.96 1u6r n GLY 98 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1u6r n GLY 98 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1u6r s PHE 99 N -2.00 2.28 0.42 1.61 5.36 -1.20 -4.99 117.98 119.45 1u6r s PHE 99 Ca 0.00 0.67 -0.08 0.00 -0.96 0.00 0.00 56.93 56.56 1u6r s PHE 99 Cb 0.00 -4.07 -0.05 0.00 -0.34 0.00 0.00 43.02 38.56 1u6r s PHE 99 CO 0.00 -2.40 0.75 0.15 -1.46 0.00 0.00 175.22 172.25 1u6r s LYS 100 N 4.76 3.67 0.57 10.12 1.02 -1.26 -3.63 119.74 134.99 1u6r s LYS 100 Ca 0.66 0.30 0.29 0.00 0.02 0.00 0.00 55.97 57.25 1u6r s LYS 100 Cb -0.20 -2.42 1.46 0.00 -0.52 0.00 0.00 37.83 36.15 1u6r s LYS 100 CO 0.29 -0.06 1.87 -1.35 -0.92 0.00 0.00 175.35 175.18 1u6r h PRO 101 N 0.94 0.00 0.00 -1.68 0.11 -1.94 0.00 132.00 129.43 1u6r h PRO 101 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1u6r h PRO 101 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1u6r h PRO 101 CO 0.63 0.00 -0.43 0.25 -0.21 0.00 0.00 178.00 178.24 1u6r n THR 102 N -3.86 0.16 -1.63 -1.15 -2.24 -1.26 -4.91 114.28 99.40 1u6r n THR 102 Ca 0.12 -0.12 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1u6r n THR 102 Cb 0.78 -0.06 0.09 0.00 -2.10 0.00 0.00 70.33 69.05 1u6r n THR 102 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1u6r s ASP 103 N -3.54 4.42 0.03 3.42 1.01 -0.01 -5.08 116.67 116.92 1u6r s ASP 103 Ca 0.10 1.16 0.06 0.00 0.71 0.00 0.00 52.55 54.58 1u6r s ASP 103 Cb 0.16 -1.85 -0.02 0.00 1.01 0.00 0.00 42.92 42.22 1u6r s ASP 103 CO 0.67 -2.00 -0.18 -0.54 0.21 0.00 0.00 175.17 173.34 1u6r s LYS 104 N -5.25 1.23 0.45 8.23 1.02 -1.26 -4.84 119.74 119.32 1u6r s LYS 104 Ca 0.61 -0.81 -0.24 0.00 0.02 0.00 0.00 55.97 55.55 1u6r s LYS 104 Cb -0.14 -1.28 -0.09 0.00 -0.52 0.00 0.00 37.83 35.80 1u6r s LYS 104 CO 0.53 0.33 1.13 1.58 -0.92 0.00 0.00 175.35 178.00 1u6r n HIS 105 N 2.02 1.60 -5.16 3.18 -0.00 -0.97 -4.58 115.22 111.31 1u6r n HIS 105 Ca -0.17 0.51 -0.31 0.00 -0.00 0.00 0.00 57.72 57.75 1u6r n HIS 105 Cb 0.54 -2.29 -0.17 0.00 -0.00 0.00 0.00 29.99 28.07 1u6r n HIS 105 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.34 176.55 1u6r s LYS 106 N -2.23 2.88 0.01 1.57 2.20 -1.26 -4.97 119.74 117.95 1u6r s LYS 106 Ca 0.64 -0.84 -0.02 0.00 -0.36 0.00 0.00 55.97 55.39 1u6r s LYS 106 Cb -0.51 -2.20 -0.01 0.00 -1.51 0.00 0.00 37.83 33.59 1u6r s LYS 106 CO 0.56 0.18 0.03 0.95 -0.36 0.00 0.00 175.35 176.70 1u6r s THR 107 N 0.33 0.10 0.53 3.43 -4.23 -1.26 -3.97 115.64 110.58 1u6r s THR 107 Ca -0.17 -0.84 0.01 0.00 -1.18 0.00 0.00 61.69 59.51 1u6r s THR 107 Cb -0.17 -0.32 0.01 0.00 1.34 0.00 0.00 72.50 73.36 1u6r s THR 107 CO 0.08 -0.46 0.09 -0.90 -0.54 0.00 0.00 174.62 172.89 1u6r n ASP 108 N 1.55 3.31 -0.63 3.99 5.68 -1.26 -5.05 116.55 124.13 1u6r n ASP 108 Ca -0.24 -3.21 0.06 0.00 -0.50 0.00 0.00 54.79 50.90 1u6r n ASP 108 Cb 0.55 0.28 0.16 0.00 -1.14 0.00 0.00 41.12 40.97 1u6r n ASP 108 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1u6r n LEU 109 N 0.00 3.06 -3.46 -2.12 4.77 -1.26 -4.77 117.00 113.21 1u6r n LEU 109 Ca -0.18 -2.25 -0.40 0.00 -0.03 0.00 0.00 56.01 53.16 1u6r n LEU 109 Cb 0.66 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 1u6r n LEU 109 CO 0.36 0.70 2.81 0.59 -1.33 0.00 0.00 177.39 180.52 1u6r n ASN 110 N 0.17 7.82 0.25 -1.43 5.03 -1.26 -4.72 115.26 121.12 1u6r n ASN 110 Ca 0.13 -2.88 0.15 0.00 0.87 0.00 0.00 54.58 52.85 1u6r n ASN 110 Cb 0.52 -1.47 0.83 0.00 -1.02 0.00 0.00 39.78 38.64 1u6r n ASN 110 CO 0.00 0.00 0.00 1.12 -1.83 0.00 0.00 177.26 176.55 1u6r h HIS 111 N 4.96 0.00 0.00 3.10 2.07 -1.97 -1.19 115.15 122.13 1u6r h HIS 111 Ca 0.74 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.26 1u6r h HIS 111 Cb 0.34 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.32 1u6r h HIS 111 CO 1.69 0.00 0.00 0.39 -3.07 0.00 0.00 177.93 176.94 1u6r n GLU 112 N -3.98 0.05 0.00 5.12 4.71 -1.26 -2.60 120.64 122.69 1u6r n GLU 112 Ca -0.01 0.30 0.14 0.00 -0.01 0.00 0.00 57.16 57.58 1u6r n GLU 112 Cb 0.18 -1.60 0.77 0.00 -1.01 0.00 0.00 31.44 29.78 1u6r n GLU 112 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1u6r n ASN 113 N -1.70 0.00 -4.73 1.62 3.02 -0.45 -4.83 115.26 108.19 1u6r n ASN 113 Ca 0.03 -0.32 -0.42 0.00 -0.03 0.00 0.00 54.58 53.84 1u6r n ASN 113 Cb 0.19 -0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 1u6r n ASN 113 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1u6r s LEU 114 N -2.44 4.36 -0.28 3.41 2.96 -1.07 -4.96 118.68 120.67 1u6r s LEU 114 Ca 0.32 2.90 -0.11 0.00 -0.22 0.00 0.00 54.13 57.02 1u6r s LEU 114 Cb 0.20 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.23 1u6r s LEU 114 CO 0.42 -0.96 0.18 -0.75 -1.32 0.00 0.00 176.35 173.92 1u6r s LYS 115 N 0.66 3.89 3.11 1.98 2.20 -1.26 -4.94 119.74 125.39 1u6r s LYS 115 Ca 0.71 -0.36 0.00 0.00 -0.36 0.00 0.00 55.97 55.97 1u6r s LYS 115 Cb -0.49 -3.64 0.00 0.00 -1.51 0.00 0.00 37.83 32.18 1u6r s LYS 115 CO 0.37 -0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.57 1u6r n GLY 116 N 5.05 0.23 2.22 5.54 0.00 -1.26 -4.93 105.19 112.04 1u6r n GLY 116 Ca -0.14 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1u6r n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6r n GLY 117 N 0.00 1.21 0.46 -0.02 0.00 -1.26 -4.71 105.19 100.87 1u6r n GLY 117 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1u6r n GLY 117 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1u6r n ASP 118 N 0.00 1.45 -1.41 1.61 5.75 -1.26 -0.81 116.55 121.88 1u6r n ASP 118 Ca 0.00 -1.47 0.02 0.00 -0.01 0.00 0.00 54.79 53.33 1u6r n ASP 118 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 1u6r n ASP 118 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1u6r n ASP 119 N 0.13 0.66 -4.74 -1.12 5.75 -1.24 -4.37 116.55 111.61 1u6r n ASP 119 Ca 0.19 -2.00 -0.42 0.00 -0.01 0.00 0.00 54.79 52.55 1u6r n ASP 119 Cb 0.35 -0.20 -0.02 0.00 -1.03 0.00 0.00 41.12 40.22 1u6r n ASP 119 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1u6r n LEU 120 N 0.41 4.25 -4.63 -2.12 4.77 -0.96 -4.82 117.00 113.90 1u6r n LEU 120 Ca 0.00 1.12 -0.42 0.00 -0.03 0.00 0.00 56.01 56.68 1u6r n LEU 120 Cb 1.07 -1.59 -0.03 0.00 -2.33 0.00 0.00 43.42 40.54 1u6r n LEU 120 CO -0.06 0.16 1.70 -0.62 -1.33 0.00 0.00 177.39 177.24 1u6r s ASP 121 N 0.67 6.01 0.00 -1.43 -1.08 -1.26 -4.12 116.67 115.47 1u6r s ASP 121 Ca 0.67 2.30 0.19 0.00 -0.52 0.00 0.00 52.55 55.19 1u6r s ASP 121 Cb -0.50 -2.52 0.86 0.00 -1.46 0.00 0.00 42.92 39.30 1u6r s ASP 121 CO 0.44 -1.45 1.58 -0.81 0.52 0.00 0.00 175.17 175.45 1u6r n PRO 122 N 8.07 0.12 0.19 4.34 -0.04 -1.26 -0.58 135.00 145.84 1u6r n PRO 122 Ca 0.24 0.15 0.04 0.00 -0.04 0.00 0.00 63.50 63.89 1u6r n PRO 122 Cb 0.43 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.77 1u6r n PRO 122 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1u6r h HIS 123 N 0.00 0.00 0.00 0.54 3.86 -2.01 -3.37 115.15 114.17 1u6r h HIS 123 Ca 0.00 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.94 1u6r h HIS 123 Cb 0.25 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.68 1u6r h HIS 123 CO 0.00 0.36 -1.94 0.66 0.86 0.00 0.00 177.93 177.86 1u6r n TYR 124 N -3.99 0.00 -2.92 2.45 4.02 -0.70 -4.87 117.16 111.16 1u6r n TYR 124 Ca -0.02 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.44 1u6r n TYR 124 Cb 0.41 -0.62 -0.04 0.00 -0.02 0.00 0.00 39.34 39.07 1u6r n TYR 124 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1u6r s VAL 125 N -2.32 4.47 -0.13 -0.72 1.01 0.25 -0.96 120.40 122.00 1u6r s VAL 125 Ca -0.23 -0.29 0.15 0.00 0.00 0.00 0.00 61.98 61.61 1u6r s VAL 125 Cb 0.08 -4.58 -0.00 0.00 0.00 0.00 0.00 36.38 31.88 1u6r s VAL 125 CO 0.33 -1.25 1.28 -0.07 0.00 0.00 0.00 175.10 175.38 1u6r h LEU 126 N 10.89 0.00 -7.00 3.92 3.38 -0.96 -3.36 115.31 122.18 1u6r h LEU 126 Ca -0.28 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.70 1u6r h LEU 126 Cb 1.08 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.64 1u6r h LEU 126 CO 1.12 0.55 0.35 -0.94 0.09 0.00 0.00 178.44 179.61 1u6r s SER 127 N -6.30 -0.51 -0.02 -0.43 1.04 -1.22 -0.85 113.70 105.41 1u6r s SER 127 Ca 0.02 0.41 0.05 0.00 0.48 0.00 0.00 55.95 56.91 1u6r s SER 127 Cb 0.08 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 1u6r s SER 127 CO 0.77 -0.58 -0.17 -0.44 0.98 0.00 0.00 173.24 173.80 1u6r s SER 128 N -1.59 1.98 -0.05 7.02 0.01 -0.50 -1.43 113.70 119.14 1u6r s SER 128 Ca -0.04 -0.31 -0.08 0.00 1.31 0.00 0.00 55.95 56.83 1u6r s SER 128 Cb -0.00 -0.32 0.02 0.00 0.21 0.00 0.00 66.02 65.92 1u6r s SER 128 CO 0.01 0.19 0.20 -0.60 0.41 0.00 0.00 173.24 173.45 1u6r s ARG 129 N -0.26 0.34 -0.06 12.44 3.52 -0.32 -1.70 118.95 132.91 1u6r s ARG 129 Ca 0.03 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.72 1u6r s ARG 129 Cb -0.08 0.15 0.02 0.00 -1.56 0.00 0.00 34.95 33.49 1u6r s ARG 129 CO 0.00 -0.06 -0.04 0.08 -0.81 0.00 0.00 175.30 174.47 1u6r s VAL 130 N -0.37 0.59 0.17 7.11 1.01 0.26 -0.65 120.40 128.52 1u6r s VAL 130 Ca -0.05 -0.10 0.06 0.00 0.00 0.00 0.00 61.98 61.89 1u6r s VAL 130 Cb -0.03 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 1u6r s VAL 130 CO 0.01 0.26 -0.12 0.00 0.00 0.00 0.00 175.10 175.25 1u6r s ARG 131 N 1.25 1.16 0.32 2.72 1.04 -0.55 -0.62 118.95 124.27 1u6r s ARG 131 Ca -0.06 -1.49 0.00 0.00 -1.04 0.00 0.00 55.73 53.14 1u6r s ARG 131 Cb -0.14 -0.83 -0.01 0.00 -2.04 0.00 0.00 34.95 31.93 1u6r s ARG 131 CO -0.02 0.12 0.38 -0.08 -0.04 0.00 0.00 175.30 175.66 1u6r s THR 132 N -3.13 0.00 0.20 4.99 -1.32 -0.37 -0.44 115.64 115.57 1u6r s THR 132 Ca 0.18 -1.76 0.09 0.00 -1.21 0.00 0.00 61.69 59.00 1u6r s THR 132 Cb 0.01 -2.56 -0.04 0.00 -1.51 0.00 0.00 72.50 68.39 1u6r s THR 132 CO 0.03 0.00 -0.18 -0.83 -2.21 0.00 0.00 174.62 171.44 1u6r s GLY 133 N -3.27 1.50 0.02 6.08 0.00 -1.26 -0.65 107.32 109.74 1u6r s GLY 133 Ca 0.34 -1.62 0.01 0.00 0.00 0.00 0.00 44.72 43.45 1u6r s GLY 133 CO 0.22 -1.69 -0.03 0.54 0.00 0.00 0.00 173.10 172.13 1u6r s LYS 134 N -3.19 0.28 -0.01 2.90 -0.14 -0.53 -4.85 119.74 114.20 1u6r s LYS 134 Ca 0.21 -0.41 0.03 0.00 -1.36 0.00 0.00 55.97 54.44 1u6r s LYS 134 Cb -0.04 -0.06 -0.03 0.00 -1.68 0.00 0.00 37.83 36.01 1u6r s LYS 134 CO 0.08 0.00 -0.08 -1.12 -0.76 0.00 0.00 175.35 173.48 1u6r s SER 135 N -0.90 4.53 -0.21 2.83 0.01 -1.25 -1.63 113.70 117.08 1u6r s SER 135 Ca -0.08 -0.15 -0.26 0.00 1.31 0.00 0.00 55.95 56.76 1u6r s SER 135 Cb -0.06 -1.04 -0.00 0.00 0.21 0.00 0.00 66.02 65.12 1u6r s SER 135 CO -0.00 0.30 0.91 -0.63 0.41 0.00 0.00 173.24 174.22 1u6r s ILE 136 N -0.95 4.79 0.31 1.44 -1.09 -1.26 -0.88 121.20 123.56 1u6r s ILE 136 Ca 0.16 1.76 -0.29 0.00 -2.23 0.00 0.00 60.65 60.04 1u6r s ILE 136 Cb -0.11 -4.19 -0.12 0.00 -1.58 0.00 0.00 42.46 36.45 1u6r s ILE 136 CO 0.06 -0.08 1.47 1.17 -1.23 0.00 0.00 174.94 176.33 1u6r n LYS 137 N 5.88 2.43 -0.33 2.79 4.81 -0.22 -2.60 118.16 130.91 1u6r n LYS 137 Ca 0.08 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 1u6r n LYS 137 Cb 0.47 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 32.96 1u6r n LYS 137 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1u6r n GLY 138 N 1.53 0.68 3.21 3.14 0.00 -1.26 -4.88 105.19 107.61 1u6r n GLY 138 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 1u6r n GLY 138 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u6r s TYR 139 N -2.59 1.69 0.72 1.61 2.02 -1.07 -5.13 117.35 114.59 1u6r s TYR 139 Ca 0.00 -0.34 -0.13 0.00 -0.37 0.00 0.00 57.07 56.23 1u6r s TYR 139 Cb 0.00 -1.04 0.03 0.00 -0.40 0.00 0.00 41.96 40.55 1u6r s TYR 139 CO 0.00 0.03 1.10 0.95 -1.57 0.00 0.00 175.55 176.06 1u6r s THR 140 N -0.63 3.30 0.51 -0.71 -4.23 -1.26 -4.73 115.64 107.89 1u6r s THR 140 Ca 0.07 0.51 -0.04 0.00 -1.18 0.00 0.00 61.69 61.04 1u6r s THR 140 Cb -0.08 -3.01 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 1u6r s THR 140 CO 0.01 -0.47 0.80 -0.76 -0.54 0.00 0.00 174.62 173.65 1u6r s LEU 141 N -5.42 3.50 0.48 4.79 1.43 0.07 -4.60 118.68 118.93 1u6r s LEU 141 Ca 0.64 0.72 0.32 0.00 -1.03 0.00 0.00 54.13 54.77 1u6r s LEU 141 Cb -0.19 -3.61 1.42 0.00 0.03 0.00 0.00 46.19 43.85 1u6r s LEU 141 CO 0.49 -0.77 1.72 -0.65 0.23 0.00 0.00 176.35 177.37 1u6r h PRO 142 N 0.12 0.13 0.00 1.29 0.11 -1.87 0.16 132.00 131.94 1u6r h PRO 142 Ca -0.46 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1u6r h PRO 142 Cb 1.23 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1u6r h PRO 142 CO 0.61 0.09 -0.01 -1.35 -0.21 0.00 0.00 178.00 177.12 1u6r h PRO 143 N 0.13 0.00 0.00 1.05 0.11 -1.82 -3.34 132.00 128.13 1u6r h PRO 143 Ca 0.69 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.80 1u6r h PRO 143 Cb 2.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.43 1u6r h PRO 143 CO -0.19 0.01 -0.61 1.58 -0.21 0.00 0.00 178.00 178.58 1u6r n HIS 144 N -4.16 0.00 -1.94 0.65 -0.00 -0.11 -4.45 115.22 105.21 1u6r n HIS 144 Ca -0.03 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.28 1u6r n HIS 144 Cb 0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.07 1u6r n HIS 144 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1u6r s SER 146 N 0.24 3.76 0.25 0.00 1.04 -1.26 -4.80 113.70 112.93 1u6r s SER 146 Ca 0.58 1.18 -0.03 0.00 0.48 0.00 0.00 55.95 58.16 1u6r s SER 146 Cb -0.44 -1.84 0.44 0.00 0.10 0.00 0.00 66.02 64.29 1u6r s SER 146 CO 0.48 -2.42 1.81 0.03 0.98 0.00 0.00 173.24 174.12 1u6r h ARG 147 N -1.40 0.80 -0.51 4.02 3.08 -1.97 -0.83 114.38 117.57 1u6r h ARG 147 Ca -0.50 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.46 1u6r h ARG 147 Cb 1.30 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.15 1u6r h ARG 147 CO 0.60 0.53 0.12 0.78 -1.07 0.00 0.00 179.97 180.93 1u6r h GLY 148 N 0.83 0.88 0.91 0.04 0.00 -1.99 -1.32 103.07 102.42 1u6r h GLY 148 Ca 0.42 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 1u6r h GLY 148 CO -0.26 0.51 0.07 -2.09 0.00 0.00 0.00 176.54 174.78 1u6r h GLU 149 N 0.71 0.56 -0.51 4.80 4.57 -1.79 -0.70 114.58 122.21 1u6r h GLU 149 Ca 0.16 -0.14 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1u6r h GLU 149 Cb 0.33 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 1u6r h GLU 149 CO 0.00 0.63 0.31 -0.09 -1.18 0.00 0.00 179.01 178.68 1u6r h ARG 150 N 0.41 0.61 -0.82 1.92 2.43 -1.08 -1.30 114.38 116.55 1u6r h ARG 150 Ca 0.11 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1u6r h ARG 150 Cb 0.33 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 1u6r h ARG 150 CO 0.00 0.41 0.35 0.00 -1.51 0.00 0.00 179.97 179.21 1u6r h ARG 151 N 0.63 1.21 -0.64 0.20 3.08 -1.06 -0.92 114.38 116.88 1u6r h ARG 151 Ca 0.20 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1u6r h ARG 151 Cb -0.01 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 1u6r h ARG 151 CO -0.08 0.97 0.36 0.00 -1.07 0.00 0.00 179.97 180.15 1u6r h ALA 152 N 1.19 0.82 -0.57 0.04 0.00 -0.65 -0.41 119.26 119.69 1u6r h ALA 152 Ca 0.28 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1u6r h ALA 152 Cb 0.19 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1u6r h ALA 152 CO -0.03 0.33 0.13 0.28 0.00 0.00 0.00 179.25 179.96 1u6r h VAL 153 N 0.88 1.25 0.03 0.00 2.07 -0.89 -2.28 116.25 117.30 1u6r h VAL 153 Ca 0.23 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1u6r h VAL 153 Cb 0.02 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1u6r h VAL 153 CO -0.04 0.33 -0.02 -0.08 0.02 0.00 0.00 177.57 177.79 1u6r h GLU 154 N 0.82 -0.04 -0.08 1.57 4.81 -0.90 -1.10 114.58 119.66 1u6r h GLU 154 Ca 0.18 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 1u6r h GLU 154 Cb 0.36 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 1u6r h GLU 154 CO 0.00 0.04 -0.13 -0.22 -0.73 0.00 0.00 179.01 177.97 1u6r h LYS 155 N -0.11 -0.17 -0.12 1.92 3.64 -0.96 -1.04 116.57 119.73 1u6r h LYS 155 Ca -0.00 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 1u6r h LYS 155 Cb 0.10 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1u6r h LYS 155 CO 0.01 -0.11 -0.44 1.37 -2.27 0.00 0.00 179.45 178.00 1u6r h LEU 156 N -0.18 0.30 -0.34 5.20 8.10 -1.39 -2.50 115.31 124.51 1u6r h LEU 156 Ca 0.07 -0.14 -0.17 0.00 0.11 0.00 0.00 57.88 57.75 1u6r h LEU 156 Cb 0.28 -0.09 -0.00 0.00 -0.44 0.00 0.00 40.66 40.41 1u6r h LEU 156 CO -0.18 0.71 -0.46 0.28 -4.11 0.00 0.00 178.44 174.68 1u6r h SER 157 N 0.24 0.99 -0.37 0.17 0.02 -0.95 -2.23 113.55 111.42 1u6r h SER 157 Ca 0.02 -0.50 -0.13 0.00 -0.84 0.00 0.00 61.79 60.34 1u6r h SER 157 Cb 0.88 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1u6r h SER 157 CO 0.07 1.29 -0.26 0.58 -1.14 0.00 0.00 176.83 177.37 1u6r h VAL 158 N 0.72 1.28 -0.53 2.27 2.07 -1.14 0.00 116.25 120.92 1u6r h VAL 158 Ca 0.04 -1.42 0.03 0.00 0.82 0.00 0.00 66.70 66.17 1u6r h VAL 158 Cb 1.06 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 1u6r h VAL 158 CO 0.11 0.47 0.32 -0.08 0.02 0.00 0.00 177.57 178.40 1u6r h GLU 159 N 0.63 0.61 0.11 1.57 4.81 -1.43 0.08 114.58 120.95 1u6r h GLU 159 Ca 0.07 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1u6r h GLU 159 Cb 0.83 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1u6r h GLU 159 CO 0.07 0.40 -0.05 0.00 -0.73 0.00 0.00 179.01 178.70 1u6r h ALA 160 N 1.24 -0.15 -0.23 2.92 0.00 -1.22 -3.19 119.26 118.63 1u6r h ALA 160 Ca 0.22 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1u6r h ALA 160 Cb 0.03 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1u6r h ALA 160 CO -0.10 -0.50 -0.06 -0.07 0.00 0.00 0.00 179.25 178.51 1u6r h LEU 161 N -0.31 0.34 -0.35 0.00 3.38 -0.68 -1.41 115.31 116.28 1u6r h LEU 161 Ca -0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1u6r h LEU 161 Cb 0.26 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1u6r h LEU 161 CO 0.03 0.45 0.00 0.59 0.09 0.00 0.00 178.44 179.59 1u6r n ASN 162 N -4.29 0.22 -0.25 -0.43 3.02 -0.01 -1.59 115.26 111.93 1u6r n ASN 162 Ca 0.00 0.57 0.13 0.00 -0.03 0.00 0.00 54.58 55.26 1u6r n ASN 162 Cb 0.25 -0.61 0.42 0.00 -0.61 0.00 0.00 39.78 39.23 1u6r n ASN 162 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1u6r n SER 163 N -1.76 0.99 -4.76 6.41 3.41 -0.53 -4.90 113.62 112.48 1u6r n SER 163 Ca 0.02 -0.90 -0.40 0.00 -0.26 0.00 0.00 58.87 57.33 1u6r n SER 163 Cb 0.12 0.10 0.01 0.00 -0.26 0.00 0.00 64.21 64.18 1u6r n SER 163 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1u6r s LEU 164 N -2.46 4.10 0.00 1.04 1.43 -0.62 -5.03 118.68 117.15 1u6r s LEU 164 Ca 0.26 2.84 0.04 0.00 -1.03 0.00 0.00 54.13 56.23 1u6r s LEU 164 Cb 0.19 -3.97 -0.01 0.00 0.03 0.00 0.00 46.19 42.43 1u6r s LEU 164 CO 0.50 -1.15 0.14 0.35 0.23 0.00 0.00 176.35 176.41 1u6r n THR 165 N -0.23 0.00 -2.15 5.49 -2.24 -1.26 -4.14 114.28 109.75 1u6r n THR 165 Ca 0.05 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.01 1u6r n THR 165 Cb 0.43 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 1u6r n THR 165 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u6r n GLY 166 N -0.17 2.68 0.11 3.38 0.00 -1.26 -1.76 105.19 108.18 1u6r n GLY 166 Ca -0.02 -0.35 0.10 0.00 0.00 0.00 0.00 46.02 45.75 1u6r n GLY 166 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1u6r n GLU 167 N 13.56 0.14 -0.06 1.61 0.28 -1.26 -2.07 120.64 132.84 1u6r n GLU 167 Ca 0.00 0.47 0.11 0.00 -0.16 0.00 0.00 57.16 57.59 1u6r n GLU 167 Cb 0.00 -1.82 0.13 0.00 1.43 0.00 0.00 31.44 31.18 1u6r n GLU 167 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1u6r n PHE 168 N -2.10 0.17 -1.67 -1.84 3.72 -0.72 -4.92 117.46 110.10 1u6r n PHE 168 Ca 0.01 -0.09 -0.46 0.00 -0.05 0.00 0.00 57.45 56.86 1u6r n PHE 168 Cb 0.14 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.64 1u6r n PHE 168 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1u6r n LYS 169 N 1.29 2.10 0.00 -1.08 3.00 -0.88 -4.48 118.16 118.12 1u6r n LYS 169 Ca 0.15 0.76 0.00 0.00 -0.00 0.00 0.00 58.31 59.22 1u6r n LYS 169 Cb 0.56 -2.52 0.00 0.00 0.00 0.00 0.00 35.03 33.07 1u6r n LYS 169 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1u6r n GLY 170 N 3.39 3.35 3.75 3.14 0.00 -1.26 -3.66 105.19 113.90 1u6r n GLY 170 Ca 0.17 -0.78 -0.03 0.00 0.00 0.00 0.00 46.02 45.38 1u6r n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u6r s LYS 171 N 1.20 1.15 -0.05 1.61 -2.85 -0.83 -4.93 119.74 115.03 1u6r s LYS 171 Ca 0.00 -0.64 -0.05 0.00 -1.00 0.00 0.00 55.97 54.27 1u6r s LYS 171 Cb 0.00 0.39 -0.04 0.00 -2.06 0.00 0.00 37.83 36.12 1u6r s LYS 171 CO 0.00 -0.53 0.18 -0.47 0.10 0.00 0.00 175.35 174.63 1u6r s TYR 172 N -3.16 3.58 -0.35 1.78 5.04 -1.26 -1.48 117.35 121.51 1u6r s TYR 172 Ca 0.13 0.47 0.01 0.00 -2.44 0.00 0.00 57.07 55.24 1u6r s TYR 172 Cb -0.01 -1.90 0.11 0.00 0.35 0.00 0.00 41.96 40.50 1u6r s TYR 172 CO 0.02 0.68 0.12 0.71 -1.34 0.00 0.00 175.55 175.74 1u6r s TYR 173 N -1.20 2.19 0.40 4.97 2.02 0.90 -4.98 117.35 121.66 1u6r s TYR 173 Ca 0.22 -2.15 -0.27 0.00 -0.37 0.00 0.00 57.07 54.50 1u6r s TYR 173 Cb -0.13 -2.01 -0.10 0.00 -0.40 0.00 0.00 41.96 39.32 1u6r s TYR 173 CO 0.12 -0.87 1.42 -2.30 -1.57 0.00 0.00 175.55 172.35 1u6r n PRO 174 N 4.43 2.37 -0.18 -1.71 -0.02 -1.26 -1.56 135.00 137.08 1u6r n PRO 174 Ca 0.01 0.84 -0.03 0.00 -2.02 0.00 0.00 63.50 62.30 1u6r n PRO 174 Cb 0.40 -2.58 0.16 0.00 -0.02 0.00 0.00 33.50 31.47 1u6r n PRO 174 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1u6r h LEU 175 N 2.57 0.87 -1.84 2.45 5.85 -1.29 -2.59 115.31 121.33 1u6r h LEU 175 Ca -0.50 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.05 1u6r h LEU 175 Cb 1.26 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1u6r h LEU 175 CO 0.62 0.81 -0.12 0.07 -0.34 0.00 0.00 178.44 179.48 1u6r h LYS 176 N 0.91 0.00 -0.00 1.25 2.10 -1.80 -2.59 116.57 116.43 1u6r h LYS 176 Ca 0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.85 1u6r h LYS 176 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 1u6r h LYS 176 CO -0.01 0.12 -0.25 0.43 -2.00 0.00 0.00 179.45 177.75 1u6r n SER 177 N -3.58 0.62 -4.78 7.07 7.64 -0.98 -4.87 113.62 114.73 1u6r n SER 177 Ca -0.02 -0.49 -0.38 0.00 1.01 0.00 0.00 58.87 58.99 1u6r n SER 177 Cb 0.26 0.04 -0.06 0.00 -1.01 0.00 0.00 64.21 63.43 1u6r n SER 177 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1u6r s MET 178 N -2.67 4.53 0.76 1.43 -1.94 -0.98 -5.03 119.30 115.40 1u6r s MET 178 Ca 0.21 1.16 -0.11 0.00 -1.71 0.00 0.00 55.69 55.24 1u6r s MET 178 Cb 0.19 -3.11 0.04 0.00 2.01 0.00 0.00 34.83 33.97 1u6r s MET 178 CO 0.55 0.48 1.08 0.95 -0.01 0.00 0.00 175.02 178.07 1u6r s THR 179 N -1.31 3.51 0.22 2.05 -4.23 -1.26 -4.84 115.64 109.79 1u6r s THR 179 Ca 0.40 0.49 -0.08 0.00 -1.18 0.00 0.00 61.69 61.33 1u6r s THR 179 Cb -0.21 -3.17 0.17 0.00 1.34 0.00 0.00 72.50 70.63 1u6r s THR 179 CO 0.25 -0.64 1.78 -0.33 -0.54 0.00 0.00 174.62 175.14 1u6r h GLU 180 N -0.97 0.56 -0.53 3.99 4.39 -1.97 -0.75 114.58 119.30 1u6r h GLU 180 Ca -0.45 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.19 1u6r h GLU 180 Cb 1.24 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.74 1u6r h GLU 180 CO 0.56 0.37 0.25 0.37 -1.16 0.00 0.00 179.01 179.41 1u6r h GLN 181 N 0.58 0.76 -0.41 2.33 4.15 -1.99 -0.23 115.11 120.30 1u6r h GLN 181 Ca 0.34 -0.11 -0.02 0.00 0.77 0.00 0.00 58.65 59.62 1u6r h GLN 181 Cb 0.35 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.88 1u6r h GLN 181 CO -0.26 0.63 0.17 0.93 -1.93 0.00 0.00 178.83 178.37 1u6r h GLU 182 N 0.71 0.61 -0.19 1.69 5.08 -1.80 -0.61 114.58 120.08 1u6r h GLU 182 Ca 0.18 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1u6r h GLU 182 Cb 0.12 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1u6r h GLU 182 CO -0.02 0.57 0.11 0.37 -1.00 0.00 0.00 179.01 179.04 1u6r h GLN 183 N 0.52 0.26 -0.40 2.33 4.15 -0.97 -2.26 115.11 118.74 1u6r h GLN 183 Ca 0.14 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.47 1u6r h GLN 183 Cb 0.18 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 1u6r h GLN 183 CO -0.01 0.23 -0.01 0.37 -1.93 0.00 0.00 178.83 177.48 1u6r h GLN 184 N 0.22 0.65 -0.48 1.69 5.75 -0.81 -1.65 115.11 120.47 1u6r h GLN 184 Ca 0.07 -0.16 -0.04 0.00 -0.15 0.00 0.00 58.65 58.37 1u6r h GLN 184 Cb 0.04 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 1u6r h GLN 184 CO -0.01 0.67 0.15 0.37 -2.65 0.00 0.00 178.83 177.36 1u6r h GLN 185 N 0.61 0.75 -0.30 1.69 5.75 -0.94 0.40 115.11 123.07 1u6r h GLN 185 Ca 0.13 -0.16 -0.04 0.00 -0.15 0.00 0.00 58.65 58.42 1u6r h GLN 185 Cb 0.40 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.82 1u6r h GLN 185 CO 0.02 0.71 0.01 -0.07 -2.65 0.00 0.00 178.83 176.84 1u6r h LEU 186 N 0.65 0.41 -0.05 -2.39 3.38 -0.98 -0.65 115.31 115.68 1u6r h LEU 186 Ca 0.16 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1u6r h LEU 186 Cb 0.27 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1u6r h LEU 186 CO -0.00 0.47 -0.15 0.40 0.09 0.00 0.00 178.44 179.25 1u6r h ILE 187 N 0.43 1.45 -0.64 1.22 2.04 -1.04 -0.74 117.51 120.24 1u6r h ILE 187 Ca 0.10 -1.56 0.03 0.00 1.00 0.00 0.00 64.86 64.43 1u6r h ILE 187 Cb 0.27 2.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.67 1u6r h ILE 187 CO 0.01 0.43 0.42 0.44 0.00 0.00 0.00 178.15 179.45 1u6r h ASP 188 N -0.36 0.67 -0.10 1.72 3.32 -0.73 -0.32 116.42 120.63 1u6r h ASP 188 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1u6r h ASP 188 Cb 0.78 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1u6r h ASP 188 CO 0.03 0.46 0.00 0.47 -1.72 0.00 0.00 179.24 178.49 1u6r n ASP 189 N -4.46 0.83 -0.03 6.45 8.00 -0.27 -4.92 116.55 122.15 1u6r n ASP 189 Ca 0.08 -1.63 -0.00 0.00 0.71 0.00 0.00 54.79 53.94 1u6r n ASP 189 Cb 0.12 -0.06 -0.00 0.00 -0.02 0.00 0.00 41.12 41.15 1u6r n ASP 189 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1u6r n HIS 190 N -0.21 0.00 -0.02 1.24 8.25 -0.13 -4.91 115.22 119.44 1u6r n HIS 190 Ca 0.13 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.38 1u6r n HIS 190 Cb 0.19 -0.32 -0.13 0.00 1.12 0.00 0.00 29.99 30.84 1u6r n HIS 190 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1u6r n PHE 191 N -2.89 1.23 -4.05 4.41 3.72 -0.36 -4.95 117.46 114.56 1u6r n PHE 191 Ca -0.00 0.32 -0.34 0.00 -0.05 0.00 0.00 57.45 57.37 1u6r n PHE 191 Cb 0.06 -1.15 -0.07 0.00 -0.94 0.00 0.00 39.48 37.38 1u6r n PHE 191 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1u6r s LEU 192 N -7.27 4.06 0.65 4.37 2.96 -0.75 -5.00 118.68 117.70 1u6r s LEU 192 Ca -0.24 0.26 -0.17 0.00 -0.22 0.00 0.00 54.13 53.76 1u6r s LEU 192 Cb 0.06 -2.23 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 1u6r s LEU 192 CO 0.73 0.32 1.03 2.22 -1.32 0.00 0.00 176.35 179.32 1u6r n PHE 193 N 1.44 0.99 -1.33 5.38 -1.74 -1.26 -4.37 117.46 116.57 1u6r n PHE 193 Ca -0.15 0.42 -0.29 0.00 -0.56 0.00 0.00 57.45 56.87 1u6r n PHE 193 Cb 0.53 -2.14 0.19 0.00 1.52 0.00 0.00 39.48 39.57 1u6r n PHE 193 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1u6r s ASP 194 N -1.42 2.40 0.83 5.98 -1.08 -1.26 -4.86 116.67 117.27 1u6r s ASP 194 Ca 0.77 0.85 -0.14 0.00 -0.52 0.00 0.00 52.55 53.51 1u6r s ASP 194 Cb -0.38 -1.30 0.01 0.00 -1.46 0.00 0.00 42.92 39.79 1u6r s ASP 194 CO 0.46 -3.23 0.58 0.29 0.52 0.00 0.00 175.17 173.79 1u6r n LYS 195 N -4.20 0.03 -1.70 4.34 5.02 -1.26 -4.79 118.16 115.60 1u6r n LYS 195 Ca 0.09 0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 56.02 1u6r n LYS 195 Cb 0.59 -1.94 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 1u6r n LYS 195 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1u6r n PRO 196 N -1.55 2.50 0.00 1.97 -0.04 -1.26 -4.50 135.00 132.11 1u6r n PRO 196 Ca 0.09 -2.48 0.04 0.00 -0.04 0.00 0.00 63.50 61.11 1u6r n PRO 196 Cb 0.52 -3.24 -0.02 0.00 -0.04 0.00 0.00 33.50 30.72 1u6r n PRO 196 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1u6r n VAL 197 N 5.60 0.00 -1.98 0.52 0.24 -1.26 -4.82 118.33 116.63 1u6r n VAL 197 Ca 0.51 -0.38 -0.41 0.00 -2.04 0.00 0.00 64.34 62.01 1u6r n VAL 197 Cb 0.40 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 33.81 1u6r n VAL 197 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1u6r s SER 198 N -1.39 6.61 0.47 -1.34 0.15 -1.26 -4.90 113.70 112.04 1u6r s SER 198 Ca 0.05 2.70 0.15 0.00 0.70 0.00 0.00 55.95 59.55 1u6r s SER 198 Cb 0.06 -2.62 1.08 0.00 -1.71 0.00 0.00 66.02 62.83 1u6r s SER 198 CO 0.24 -0.74 2.04 1.55 1.20 0.00 0.00 173.24 177.53 1u6r h PRO 199 N 5.16 0.00 0.05 5.44 0.13 -1.99 -0.98 132.00 139.81 1u6r h PRO 199 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1u6r h PRO 199 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1u6r h PRO 199 CO 0.79 0.13 -0.03 1.25 -0.23 0.00 0.00 178.00 179.91 1u6r h LEU 200 N 0.00 -0.06 -0.59 1.56 5.85 -1.94 -1.38 115.31 118.75 1u6r h LEU 200 Ca -0.00 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 58.33 1u6r h LEU 200 Cb 0.23 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 1u6r h LEU 200 CO 0.02 0.45 0.26 0.25 -0.34 0.00 0.00 178.44 179.08 1u6r h LEU 201 N -0.59 0.32 0.16 2.25 5.85 -1.86 -2.08 115.31 119.36 1u6r h LEU 201 Ca -0.01 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1u6r h LEU 201 Cb 0.52 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1u6r h LEU 201 CO 0.01 0.21 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.17 1u6r h LEU 202 N 0.48 -0.18 -1.39 2.25 3.38 -1.25 -0.76 115.31 117.84 1u6r h LEU 202 Ca 0.28 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1u6r h LEU 202 Cb 0.28 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1u6r h LEU 202 CO -0.24 0.28 -0.25 0.00 0.09 0.00 0.00 178.44 178.31 1u6r h ALA 203 N 0.02 1.50 -0.00 1.53 0.00 -1.15 -2.81 119.26 118.34 1u6r h ALA 203 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1u6r h ALA 203 Cb 0.50 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1u6r h ALA 203 CO 0.04 0.37 -0.24 -1.13 0.00 0.00 0.00 179.25 178.29 1u6r n SER 204 N -4.21 0.44 0.00 0.00 3.41 -0.79 -4.48 113.62 107.98 1u6r n SER 204 Ca -0.02 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.34 1u6r n SER 204 Cb 0.33 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1u6r n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u6r n GLY 205 N 1.41 0.74 0.08 5.00 0.00 -1.06 -4.65 105.19 106.71 1u6r n GLY 205 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.23 1u6r n GLY 205 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1u6r n MET 206 N -2.07 0.15 0.00 1.61 2.81 -0.30 -3.27 117.12 116.05 1u6r n MET 206 Ca 0.00 0.23 0.13 0.00 -1.81 0.00 0.00 57.70 56.26 1u6r n MET 206 Cb 0.00 -1.72 0.37 0.00 -0.71 0.00 0.00 33.22 31.17 1u6r n MET 206 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1u6r n ALA 207 N -1.68 2.58 -1.70 3.04 0.00 -1.14 -4.90 120.51 116.70 1u6r n ALA 207 Ca 0.05 -0.52 -0.43 0.00 0.00 0.00 0.00 53.44 52.53 1u6r n ALA 207 Cb 0.32 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 1u6r n ALA 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1u6r n ARG 208 N 0.51 2.16 -0.99 0.00 1.74 -1.20 -2.62 116.66 116.25 1u6r n ARG 208 Ca 0.17 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 58.01 1u6r n ARG 208 Cb 0.43 -2.36 0.00 0.00 -1.02 0.00 0.00 32.46 29.51 1u6r n ARG 208 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1u6r n ASP 209 N 1.03 -4.78 -4.65 0.55 8.00 -1.26 -4.86 116.55 110.59 1u6r n ASP 209 Ca 0.06 0.00 -0.45 0.00 0.71 0.00 0.00 54.79 55.11 1u6r n ASP 209 Cb 0.35 -2.39 -0.02 0.00 -0.02 0.00 0.00 41.12 39.04 1u6r n ASP 209 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 1u6r n TRP 210 N -2.35 1.91 -0.68 1.24 -0.00 -1.08 -0.58 117.44 115.90 1u6r n TRP 210 Ca 0.00 0.54 0.00 0.00 -0.00 0.00 0.00 57.50 58.04 1u6r n TRP 210 Cb 0.31 -2.39 0.31 0.00 -0.00 0.00 0.00 31.31 29.54 1u6r n TRP 210 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1u6r n PRO 211 N 1.45 3.87 -1.67 5.87 -0.04 -1.26 -5.12 135.00 138.10 1u6r n PRO 211 Ca 0.10 -2.68 -0.47 0.00 -0.04 0.00 0.00 63.50 60.41 1u6r n PRO 211 Cb 0.31 -2.13 -0.04 0.00 -0.04 0.00 0.00 33.50 31.60 1u6r n PRO 211 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1u6r n ASP 212 N 0.23 3.09 -1.54 3.54 -0.08 0.25 -2.14 116.55 119.90 1u6r n ASP 212 Ca 0.30 1.05 -0.18 0.00 -1.51 0.00 0.00 54.79 54.45 1u6r n ASP 212 Cb 1.16 -1.39 -0.07 0.00 2.34 0.00 0.00 41.12 43.16 1u6r n ASP 212 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1u6r n ALA 213 N 4.29 -0.33 -2.81 -1.67 0.00 -1.26 -4.96 120.51 113.77 1u6r n ALA 213 Ca 0.19 0.27 -0.27 0.00 0.00 0.00 0.00 53.44 53.63 1u6r n ALA 213 Cb 0.28 -1.90 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 1u6r n ALA 213 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1u6r s ARG 214 N -3.82 2.94 0.00 0.00 3.00 -0.91 -4.61 118.95 115.55 1u6r s ARG 214 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 55.73 54.89 1u6r s ARG 214 Cb 0.00 -2.67 0.00 0.00 0.00 0.00 0.00 34.95 32.28 1u6r s ARG 214 CO 0.00 0.49 0.00 0.41 0.00 0.00 0.00 175.30 176.20 1u6r n GLY 215 N -0.30 -1.24 2.97 -3.53 0.00 -1.01 -0.85 105.19 101.22 1u6r n GLY 215 Ca -0.08 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.78 1u6r n GLY 215 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1u6r s ILE 216 N -2.45 0.76 -0.10 -0.61 2.07 -0.60 -1.09 121.20 119.17 1u6r s ILE 216 Ca 0.00 -0.30 -0.05 0.00 -1.41 0.00 0.00 60.65 58.89 1u6r s ILE 216 Cb 0.00 -0.71 -0.04 0.00 0.13 0.00 0.00 42.46 41.84 1u6r s ILE 216 CO 0.00 0.26 0.09 0.86 -1.91 0.00 0.00 174.94 174.24 1u6r s TRP 217 N 0.50 3.44 0.08 3.50 -0.00 -0.19 -0.07 118.94 126.20 1u6r s TRP 217 Ca -0.08 0.41 -0.23 0.00 -0.00 0.00 0.00 56.10 56.19 1u6r s TRP 217 Cb -0.12 -1.88 0.06 0.00 -0.00 0.00 0.00 33.47 31.53 1u6r s TRP 217 CO 0.01 0.64 0.56 -3.38 -0.00 0.00 0.00 176.95 174.78 1u6r s HIS 218 N -0.99 -0.48 0.90 5.86 -3.43 -0.55 -0.30 115.29 116.31 1u6r s HIS 218 Ca 0.15 0.47 -0.12 0.00 -0.80 0.00 0.00 55.06 54.76 1u6r s HIS 218 Cb -0.12 0.41 0.13 0.00 -1.43 0.00 0.00 32.58 31.58 1u6r s HIS 218 CO 0.04 -0.71 1.10 0.54 -2.00 0.00 0.00 174.74 173.71 1u6r s ASN 219 N -2.18 3.54 0.35 7.38 4.22 -0.67 -1.97 114.94 125.61 1u6r s ASN 219 Ca -0.03 1.30 0.04 0.00 -2.14 0.00 0.00 52.86 52.02 1u6r s ASN 219 Cb -0.00 -1.97 0.64 0.00 1.28 0.00 0.00 41.25 41.20 1u6r s ASN 219 CO -0.05 -2.57 1.95 -0.78 -2.04 0.00 0.00 177.10 173.62 1u6r h ASP 220 N -1.50 0.60 -0.48 3.54 3.58 -1.92 -1.86 116.42 118.38 1u6r h ASP 220 Ca -0.50 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 56.89 1u6r h ASP 220 Cb 1.30 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.19 1u6r h ASP 220 CO 0.57 0.53 0.00 -0.46 -2.88 0.00 0.00 179.24 177.00 1u6r n ASN 221 N -4.37 2.78 -3.04 2.28 0.23 -1.26 -4.93 115.26 106.94 1u6r n ASN 221 Ca 0.04 -2.07 -0.22 0.00 -0.53 0.00 0.00 54.58 51.80 1u6r n ASN 221 Cb 0.14 -0.36 0.02 0.00 -2.08 0.00 0.00 39.78 37.50 1u6r n ASN 221 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1u6r n LYS 222 N 0.87 -4.26 0.04 -3.83 5.02 -0.70 -4.86 118.16 110.43 1u6r n LYS 222 Ca 0.17 0.80 0.11 0.00 -2.02 0.00 0.00 58.31 57.37 1u6r n LYS 222 Cb 0.46 -5.61 -0.05 0.00 -0.02 0.00 0.00 35.03 29.82 1u6r n LYS 222 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1u6r n SER 223 N -2.41 0.51 -3.67 4.39 3.41 -1.26 -4.77 113.62 109.81 1u6r n SER 223 Ca -0.10 -0.01 -0.22 0.00 -0.26 0.00 0.00 58.87 58.29 1u6r n SER 223 Cb 0.61 1.06 -0.18 0.00 -0.26 0.00 0.00 64.21 65.44 1u6r n SER 223 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1u6r s PHE 224 N -3.34 0.20 0.08 7.33 5.36 -1.26 -1.78 117.98 124.58 1u6r s PHE 224 Ca -0.01 0.05 0.03 0.00 -0.96 0.00 0.00 56.93 56.04 1u6r s PHE 224 Cb 0.13 -0.59 -0.03 0.00 -0.34 0.00 0.00 43.02 42.19 1u6r s PHE 224 CO 0.83 -0.29 -0.09 -0.51 -1.46 0.00 0.00 175.22 173.71 1u6r s LEU 225 N 2.13 2.39 -0.10 6.12 1.02 0.30 -1.67 118.68 128.86 1u6r s LEU 225 Ca 0.04 -0.78 -0.02 0.00 0.02 0.00 0.00 54.13 53.40 1u6r s LEU 225 Cb -0.13 -0.22 0.03 0.00 0.02 0.00 0.00 46.19 45.90 1u6r s LEU 225 CO -0.05 -0.29 -0.00 -0.69 0.02 0.00 0.00 176.35 175.34 1u6r s VAL 226 N -2.40 0.50 0.17 -1.59 1.01 0.59 -0.10 120.40 118.59 1u6r s VAL 226 Ca 0.02 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.63 1u6r s VAL 226 Cb -0.03 -0.71 -0.07 0.00 0.00 0.00 0.00 36.38 35.57 1u6r s VAL 226 CO -0.01 0.18 0.95 0.26 0.00 0.00 0.00 175.10 176.48 1u6r s TRP 227 N 1.91 3.89 -0.22 5.22 0.51 0.37 -1.02 118.94 129.61 1u6r s TRP 227 Ca 0.04 1.86 -0.04 0.00 -2.12 0.00 0.00 56.10 55.83 1u6r s TRP 227 Cb -0.13 -3.02 -0.01 0.00 -0.81 0.00 0.00 33.47 29.49 1u6r s TRP 227 CO -0.06 0.32 -0.03 0.08 -0.51 0.00 0.00 176.95 176.74 1u6r s VAL 228 N -0.57 3.50 -1.12 4.03 1.01 -0.25 -1.38 120.40 125.63 1u6r s VAL 228 Ca 0.44 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1u6r s VAL 228 Cb -0.25 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1u6r s VAL 228 CO 0.31 0.42 0.00 0.59 0.00 0.00 0.00 175.10 176.42 1u6r n ASN 229 N 4.72 -4.06 0.00 3.32 3.02 0.09 -2.41 115.26 119.94 1u6r n ASN 229 Ca -0.18 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.39 1u6r n ASN 229 Cb 0.51 -3.19 0.00 0.00 -0.61 0.00 0.00 39.78 36.49 1u6r n ASN 229 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1u6r n GLU 230 N -2.27 0.00 0.14 3.52 2.13 -1.26 -4.81 120.64 118.09 1u6r n GLU 230 Ca -0.15 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.69 1u6r n GLU 230 Cb 0.59 0.00 0.10 0.00 0.27 0.00 0.00 31.44 32.41 1u6r n GLU 230 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1u6r h GLU 231 N 0.00 0.00 -5.13 5.31 4.81 -1.95 -3.45 114.58 114.17 1u6r h GLU 231 Ca 0.00 0.00 -0.41 0.00 -0.13 0.00 0.00 59.36 58.82 1u6r h GLU 231 Cb 0.00 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 29.24 1u6r h GLU 231 CO 0.00 0.57 -0.64 -0.51 -0.73 0.00 0.00 179.01 177.70 1u6r s ASP 232 N -6.53 1.96 0.13 1.04 1.01 -1.26 -4.49 116.67 108.53 1u6r s ASP 232 Ca 0.02 -1.29 -0.20 0.00 0.71 0.00 0.00 52.55 51.79 1u6r s ASP 232 Cb 0.09 -0.01 -0.03 0.00 1.01 0.00 0.00 42.92 43.98 1u6r s ASP 232 CO 0.74 -0.56 1.70 0.45 0.21 0.00 0.00 175.17 177.71 1u6r h HIS 233 N 2.34 -0.11 -4.24 4.23 3.86 -1.88 -3.02 115.15 116.33 1u6r h HIS 233 Ca -0.39 0.02 -0.50 0.00 -1.16 0.00 0.00 60.37 58.33 1u6r h HIS 233 Cb 1.23 0.08 -0.29 0.00 1.06 0.00 0.00 27.41 29.49 1u6r h HIS 233 CO 0.57 -0.09 -0.82 -0.51 0.86 0.00 0.00 177.93 177.94 1u6r s LEU 234 N -10.40 2.04 -0.19 2.43 1.43 -0.64 -0.73 118.68 112.62 1u6r s LEU 234 Ca -0.13 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 1u6r s LEU 234 Cb 0.10 -0.78 0.03 0.00 0.03 0.00 0.00 46.19 45.57 1u6r s LEU 234 CO 0.68 0.18 -0.13 -0.13 0.23 0.00 0.00 176.35 177.18 1u6r s ARG 235 N -0.39 2.28 -0.22 1.70 1.81 -0.48 -1.46 118.95 122.19 1u6r s ARG 235 Ca 0.06 -0.79 -0.12 0.00 -1.72 0.00 0.00 55.73 53.16 1u6r s ARG 235 Cb -0.06 -2.39 -0.05 0.00 -0.45 0.00 0.00 34.95 32.01 1u6r s ARG 235 CO -0.00 -0.35 0.21 0.08 -0.68 0.00 0.00 175.30 174.56 1u6r s VAL 236 N 1.38 5.33 -0.05 3.52 1.01 0.18 -0.48 120.40 131.30 1u6r s VAL 236 Ca 0.01 0.30 0.02 0.00 0.00 0.00 0.00 61.98 62.31 1u6r s VAL 236 Cb -0.15 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.70 1u6r s VAL 236 CO -0.09 0.34 -0.09 -0.63 0.00 0.00 0.00 175.10 174.63 1u6r s ILE 237 N 0.97 0.87 -0.08 2.22 1.01 0.86 -1.24 121.20 125.81 1u6r s ILE 237 Ca 0.10 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.43 1u6r s ILE 237 Cb -0.13 -0.81 -0.01 0.00 0.01 0.00 0.00 42.46 41.52 1u6r s ILE 237 CO 0.04 0.29 -0.19 -0.55 0.00 0.00 0.00 174.94 174.53 1u6r s SER 238 N 0.55 3.58 0.03 3.58 0.15 0.20 -0.54 113.70 121.26 1u6r s SER 238 Ca -0.10 -0.38 -0.27 0.00 0.70 0.00 0.00 55.95 55.89 1u6r s SER 238 Cb -0.13 -1.12 0.07 0.00 -1.71 0.00 0.00 66.02 63.13 1u6r s SER 238 CO 0.02 0.24 0.64 0.00 1.20 0.00 0.00 173.24 175.33 1u6r s MET 239 N -0.11 1.13 0.16 5.44 0.23 -0.73 -0.57 119.30 124.84 1u6r s MET 239 Ca -0.03 -0.03 -0.24 0.00 -1.03 0.00 0.00 55.69 54.36 1u6r s MET 239 Cb -0.14 0.53 0.06 0.00 -1.53 0.00 0.00 34.83 33.75 1u6r s MET 239 CO 0.04 -0.41 0.79 -1.83 -2.03 0.00 0.00 175.02 171.58 1u6r s GLU 240 N -2.14 1.30 0.64 3.16 -1.05 -0.69 -4.45 118.70 115.47 1u6r s GLU 240 Ca -0.07 -0.63 -0.16 0.00 -0.15 0.00 0.00 54.97 53.97 1u6r s GLU 240 Cb -0.00 0.50 -0.01 0.00 -0.44 0.00 0.00 34.13 34.18 1u6r s GLU 240 CO 0.01 -0.59 1.12 0.15 0.95 0.00 0.00 175.26 176.91 1u6r s LYS 241 N -3.55 2.89 0.99 -4.83 -0.14 -1.26 -1.42 119.74 112.43 1u6r s LYS 241 Ca 0.07 1.46 0.00 0.00 -1.36 0.00 0.00 55.97 56.14 1u6r s LYS 241 Cb -0.02 -1.96 0.00 0.00 -1.68 0.00 0.00 37.83 34.17 1u6r s LYS 241 CO -0.03 -1.19 0.00 0.41 -0.76 0.00 0.00 175.35 173.78 1u6r n GLY 242 N -0.33 -1.81 0.50 -3.33 0.00 -0.03 -4.72 105.19 95.47 1u6r n GLY 242 Ca 0.11 -1.59 0.08 0.00 0.00 0.00 0.00 46.02 44.62 1u6r n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6r n GLY 243 N 0.00 4.21 3.01 -0.02 0.00 -1.26 -2.87 105.19 108.27 1u6r n GLY 243 Ca 0.00 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.62 1u6r n GLY 243 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1u6r n ASN 244 N -0.79 4.88 -0.01 1.61 2.85 -1.26 -2.28 115.26 120.26 1u6r n ASN 244 Ca 0.17 -3.02 0.04 0.00 -0.11 0.00 0.00 54.58 51.67 1u6r n ASN 244 Cb 0.72 -1.55 0.43 0.00 1.24 0.00 0.00 39.78 40.62 1u6r n ASN 244 CO 0.00 0.00 0.00 -0.03 -2.11 0.00 0.00 177.26 175.12 1u6r h MET 245 N 6.20 0.54 -0.63 1.20 1.85 -1.27 -2.20 114.93 120.62 1u6r h MET 245 Ca 0.42 -0.03 -0.02 0.00 -0.61 0.00 0.00 59.70 59.46 1u6r h MET 245 Cb 0.70 -0.12 -0.03 0.00 0.43 0.00 0.00 31.60 32.58 1u6r h MET 245 CO 1.59 0.36 0.32 -0.22 -0.40 0.00 0.00 176.91 178.56 1u6r h LYS 246 N 0.56 0.89 -0.40 0.39 3.64 -1.64 0.40 116.57 120.41 1u6r h LYS 246 Ca 0.16 -0.12 -0.10 0.00 -1.27 0.00 0.00 60.65 59.32 1u6r h LYS 246 Cb -0.04 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 1u6r h LYS 246 CO -0.04 0.69 -0.13 1.49 -2.27 0.00 0.00 179.45 179.20 1u6r h GLU 247 N 0.85 0.79 -0.78 1.90 4.57 -1.77 0.13 114.58 120.27 1u6r h GLU 247 Ca 0.22 -0.32 0.05 0.00 -1.18 0.00 0.00 59.36 58.13 1u6r h GLU 247 Cb 0.08 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.58 1u6r h GLU 247 CO -0.03 0.94 0.48 0.28 -1.18 0.00 0.00 179.01 179.50 1u6r h VAL 248 N 0.60 1.05 -0.29 0.32 2.07 -1.12 -1.18 116.25 117.70 1u6r h VAL 248 Ca 0.10 -0.31 -0.18 0.00 0.82 0.00 0.00 66.70 67.13 1u6r h VAL 248 Cb 0.67 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1u6r h VAL 248 CO 0.05 0.16 -0.52 0.15 0.02 0.00 0.00 177.57 177.43 1u6r h PHE 249 N 0.90 1.06 -0.04 1.57 3.57 -0.73 -0.71 116.94 122.56 1u6r h PHE 249 Ca 0.33 -0.37 0.03 0.00 3.53 0.00 0.00 57.97 61.50 1u6r h PHE 249 Cb 0.12 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 1u6r h PHE 249 CO -0.04 1.19 -0.21 -0.09 -2.23 0.00 0.00 178.31 176.93 1u6r h ARG 250 N 0.66 -0.30 -0.52 1.11 2.43 -0.38 0.15 114.38 117.54 1u6r h ARG 250 Ca 0.02 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1u6r h ARG 250 Cb 1.12 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 1u6r h ARG 250 CO 0.12 -0.20 0.29 -0.09 -1.51 0.00 0.00 179.97 178.57 1u6r h ARG 251 N -0.31 0.73 -0.05 0.20 2.43 -1.14 -0.70 114.38 115.54 1u6r h ARG 251 Ca 0.07 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1u6r h ARG 251 Cb 0.41 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 1u6r h ARG 251 CO -0.22 0.56 -0.25 0.35 -1.51 0.00 0.00 179.97 178.90 1u6r h PHE 252 N 0.69 -0.68 -0.21 2.20 3.57 -0.91 -0.63 116.94 120.98 1u6r h PHE 252 Ca 0.18 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 1u6r h PHE 252 Cb 0.05 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 1u6r h PHE 252 CO -0.02 -0.34 -0.23 0.00 -2.23 0.00 0.00 178.31 175.50 1u6r h VAL 254 N 0.20 1.22 -0.48 0.00 2.07 -1.15 -1.56 116.25 116.56 1u6r h VAL 254 Ca 0.03 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 1u6r h VAL 254 Cb 0.78 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1u6r h VAL 254 CO 0.06 0.25 0.21 1.23 0.02 0.00 0.00 177.57 179.33 1u6r h GLY 255 N 0.36 0.75 1.02 2.17 0.00 -1.01 -1.81 103.07 104.55 1u6r h GLY 255 Ca 0.10 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 1u6r h GLY 255 CO 0.00 0.37 0.32 -2.00 0.00 0.00 0.00 176.54 175.24 1u6r h LEU 256 N 0.63 0.95 -0.73 3.11 5.85 -0.55 -0.23 115.31 124.35 1u6r h LEU 256 Ca 0.16 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1u6r h LEU 256 Cb 0.16 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1u6r h LEU 256 CO -0.02 0.83 0.34 1.56 -0.34 0.00 0.00 178.44 180.82 1u6r h GLN 257 N 1.00 1.05 -0.57 1.25 4.20 -1.11 -0.77 115.11 120.16 1u6r h GLN 257 Ca 0.24 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1u6r h GLN 257 Cb 0.15 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 1u6r h GLN 257 CO -0.03 0.83 0.31 0.87 -0.67 0.00 0.00 178.83 180.14 1u6r h LYS 258 N 1.02 0.81 0.02 1.46 1.79 -0.81 -1.58 116.57 119.28 1u6r h LYS 258 Ca 0.25 -0.10 0.02 0.00 -2.18 0.00 0.00 60.65 58.63 1u6r h LYS 258 Cb 0.13 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 1u6r h LYS 258 CO -0.03 0.63 -0.11 0.82 -1.08 0.00 0.00 179.45 179.68 1u6r h ILE 259 N 0.78 0.73 -0.50 1.86 2.04 -0.71 -1.25 117.51 120.45 1u6r h ILE 259 Ca 0.20 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.99 1u6r h ILE 259 Cb 0.06 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1u6r h ILE 259 CO -0.03 0.00 0.01 -0.08 0.00 0.00 0.00 178.15 178.05 1u6r h GLU 260 N -0.20 0.84 -0.43 2.37 4.81 -0.96 -0.04 114.58 120.97 1u6r h GLU 260 Ca 0.03 -0.23 0.05 0.00 -0.13 0.00 0.00 59.36 59.09 1u6r h GLU 260 Cb 0.24 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 1u6r h GLU 260 CO -0.09 0.83 0.15 1.49 -0.73 0.00 0.00 179.01 180.66 1u6r h GLU 261 N 0.78 0.31 -0.19 1.92 4.81 -1.15 -0.49 114.58 120.58 1u6r h GLU 261 Ca 0.15 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1u6r h GLU 261 Cb 0.46 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1u6r h GLU 261 CO 0.02 0.21 0.05 0.82 -0.73 0.00 0.00 179.01 179.38 1u6r h ILE 262 N 0.32 1.19 -0.77 2.32 2.04 -0.45 -1.48 117.51 120.68 1u6r h ILE 262 Ca 0.20 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 1u6r h ILE 262 Cb 0.19 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 1u6r h ILE 262 CO -0.20 0.19 0.31 -0.26 0.00 0.00 0.00 178.15 178.18 1u6r h PHE 263 N 0.12 1.18 -0.25 1.37 -1.00 -0.90 -1.31 116.94 116.15 1u6r h PHE 263 Ca 0.06 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.73 1u6r h PHE 263 Cb 0.24 -0.35 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 1u6r h PHE 263 CO 0.00 0.89 0.08 0.87 -1.61 0.00 0.00 178.31 178.55 1u6r h LYS 264 N 1.12 0.40 -0.59 1.51 1.57 -1.00 0.17 116.57 119.75 1u6r h LYS 264 Ca 0.26 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1u6r h LYS 264 Cb 0.22 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1u6r h LYS 264 CO -0.02 0.47 0.38 -0.22 -0.57 0.00 0.00 179.45 179.49 1u6r h LYS 265 N 0.25 0.78 0.00 3.15 3.64 -1.08 -1.20 116.57 122.11 1u6r h LYS 265 Ca 0.08 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1u6r h LYS 265 Cb 0.24 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1u6r h LYS 265 CO -0.00 0.52 0.00 0.00 -2.27 0.00 0.00 179.45 177.70 1u6r n ALA 266 N -2.45 2.32 -1.12 5.00 0.00 -0.51 -4.89 120.51 118.86 1u6r n ALA 266 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1u6r n ALA 266 Cb 0.05 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.09 1u6r n ALA 266 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u6r n GLY 267 N 0.80 0.49 2.53 0.00 0.00 -0.45 -5.00 105.19 103.55 1u6r n GLY 267 Ca 0.14 -0.92 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 1u6r n GLY 267 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1u6r n HIS 268 N -3.09 2.77 -1.29 1.61 8.25 0.56 -5.01 115.22 119.02 1u6r n HIS 268 Ca 0.00 -3.98 -0.30 0.00 -0.26 0.00 0.00 57.72 53.19 1u6r n HIS 268 Cb 0.12 -0.49 0.13 0.00 1.12 0.00 0.00 29.99 30.87 1u6r n HIS 268 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1u6r s PRO 269 N -2.60 1.41 0.38 -0.41 0.04 -1.25 -4.37 135.00 128.19 1u6r s PRO 269 Ca 0.42 0.76 -0.08 0.00 0.04 0.00 0.00 61.00 62.14 1u6r s PRO 269 Cb 0.22 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.87 1u6r s PRO 269 CO -0.08 -2.12 0.71 -0.06 0.04 0.00 0.00 177.00 175.49 1u6r s PHE 270 N -2.99 3.48 0.09 0.56 0.08 -1.26 -1.06 117.98 116.87 1u6r s PHE 270 Ca 0.63 0.90 -0.31 0.00 0.12 0.00 0.00 56.93 58.27 1u6r s PHE 270 Cb -0.17 -2.32 -0.08 0.00 -0.57 0.00 0.00 43.02 39.87 1u6r s PHE 270 CO 0.56 -0.04 1.56 -1.64 -0.10 0.00 0.00 175.22 175.57 1u6r s MET 271 N -3.84 4.23 -0.23 0.44 -1.94 -0.06 -4.57 119.30 113.33 1u6r s MET 271 Ca 0.49 2.25 -0.26 0.00 -1.71 0.00 0.00 55.69 56.46 1u6r s MET 271 Cb -0.10 -3.45 0.07 0.00 2.01 0.00 0.00 34.83 33.36 1u6r s MET 271 CO 0.32 -0.65 0.73 -0.46 -0.01 0.00 0.00 175.02 174.96 1u6r s TRP 272 N 2.08 -0.74 0.12 -0.03 -0.00 -1.26 -1.94 118.94 117.16 1u6r s TRP 272 Ca 0.70 1.73 -0.05 0.00 -0.00 0.00 0.00 56.10 58.49 1u6r s TRP 272 Cb -0.39 0.30 -0.02 0.00 -0.00 0.00 0.00 33.47 33.36 1u6r s TRP 272 CO 0.31 -0.41 0.13 0.54 -0.00 0.00 0.00 176.95 177.52 1u6r s ASN 273 N 0.08 0.23 0.53 5.86 2.20 -0.53 -4.99 114.94 118.32 1u6r s ASN 273 Ca -0.02 -0.97 0.28 0.00 -0.94 0.00 0.00 52.86 51.21 1u6r s ASN 273 Cb -0.04 0.33 1.51 0.00 -2.00 0.00 0.00 41.25 41.05 1u6r s ASN 273 CO 0.02 -0.76 2.10 1.05 -2.94 0.00 0.00 177.10 176.58 1u6r h GLU 274 N 2.80 0.00 0.00 3.55 -0.00 -1.98 0.14 114.58 119.09 1u6r h GLU 274 Ca -0.34 0.00 -0.03 0.00 -0.00 0.00 0.00 59.36 59.00 1u6r h GLU 274 Cb 1.20 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1u6r h GLU 274 CO 0.57 0.10 -0.26 1.25 -0.00 0.00 0.00 179.01 180.67 1u6r h HIS 275 N 0.00 0.00 -0.00 2.06 2.76 -1.93 -2.69 115.15 115.35 1u6r h HIS 275 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1u6r h HIS 275 Cb 0.28 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.24 1u6r h HIS 275 CO 0.00 0.42 -0.33 1.28 -1.30 0.00 0.00 177.93 177.99 1u6r n LEU 276 N -4.66 0.73 0.00 0.26 4.77 -1.21 -2.29 117.00 114.59 1u6r n LEU 276 Ca -0.08 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1u6r n LEU 276 Cb 0.25 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1u6r n LEU 276 CO 0.13 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1u6r n GLY 277 N 1.41 2.23 3.71 -0.72 0.00 0.48 -0.57 105.19 111.73 1u6r n GLY 277 Ca 0.09 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1u6r n GLY 277 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u6r s TYR 278 N 0.00 3.49 -0.09 1.61 2.02 -0.60 -1.46 117.35 122.32 1u6r s TYR 278 Ca 0.00 1.41 -0.21 0.00 -0.37 0.00 0.00 57.07 57.90 1u6r s TYR 278 Cb 0.00 -3.34 -0.04 0.00 -0.40 0.00 0.00 41.96 38.19 1u6r s TYR 278 CO 0.00 -0.92 0.61 0.08 -1.57 0.00 0.00 175.55 173.75 1u6r s VAL 279 N 1.09 5.10 0.27 0.71 1.01 -0.82 -3.32 120.40 124.44 1u6r s VAL 279 Ca 0.57 1.25 0.02 0.00 0.00 0.00 0.00 61.98 63.82 1u6r s VAL 279 Cb -0.27 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1u6r s VAL 279 CO 0.29 0.28 0.17 -0.76 0.00 0.00 0.00 175.10 175.07 1u6r s LEU 280 N 0.76 1.52 0.07 3.92 1.43 -1.26 -3.94 118.68 121.18 1u6r s LEU 280 Ca 0.33 -1.53 -0.24 0.00 -1.03 0.00 0.00 54.13 51.66 1u6r s LEU 280 Cb -0.17 0.31 -0.16 0.00 0.03 0.00 0.00 46.19 46.21 1u6r s LEU 280 CO 0.15 -0.89 1.67 0.74 0.23 0.00 0.00 176.35 178.24 1u6r h THR 281 N 2.34 1.01 -3.39 5.49 2.02 -1.85 -3.42 112.91 115.11 1u6r h THR 281 Ca -0.33 -0.15 -0.59 0.00 0.77 0.00 0.00 66.41 66.11 1u6r h THR 281 Cb 1.25 1.11 -0.10 0.00 -1.74 0.00 0.00 68.15 68.66 1u6r h THR 281 CO 0.50 0.04 -0.20 0.00 0.37 0.00 0.00 175.52 176.23 1u6r h PRO 283 N 7.03 0.00 0.00 0.00 0.11 -1.81 0.50 132.00 137.84 1u6r h PRO 283 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1u6r h PRO 283 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1u6r h PRO 283 CO 0.74 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.19 1u6r h SER 284 N 0.00 0.00 -0.49 -2.05 4.64 -1.94 -2.99 113.55 110.72 1u6r h SER 284 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1u6r h SER 284 Cb 2.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.09 1u6r h SER 284 CO -0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 1u6r n ASN 285 N -2.92 3.69 -3.64 4.97 3.02 0.17 -4.63 115.26 115.93 1u6r n ASN 285 Ca -0.01 -2.24 -0.30 0.00 -0.03 0.00 0.00 54.58 51.99 1u6r n ASN 285 Cb 0.15 -0.41 0.25 0.00 -0.61 0.00 0.00 39.78 39.17 1u6r n ASN 285 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1u6r s LEU 286 N -1.44 0.40 0.00 3.41 1.43 -1.13 -3.35 118.68 118.00 1u6r s LEU 286 Ca 0.38 0.57 0.00 0.00 -1.03 0.00 0.00 54.13 54.04 1u6r s LEU 286 Cb 0.23 -2.20 0.00 0.00 0.03 0.00 0.00 46.19 44.24 1u6r s LEU 286 CO 0.21 -4.39 0.00 0.61 0.23 0.00 0.00 176.35 173.01 1u6r n GLY 287 N -0.72 1.82 0.05 -3.19 0.00 0.26 -2.22 105.19 101.19 1u6r n GLY 287 Ca 0.14 -0.27 0.12 0.00 0.00 0.00 0.00 46.02 46.01 1u6r n GLY 287 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u6r n THR 288 N 0.00 0.28 -0.85 2.61 -2.24 -0.74 -1.56 114.28 111.78 1u6r n THR 288 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1u6r n THR 288 Cb 0.00 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1u6r n THR 288 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u6r n GLY 289 N 1.37 0.16 3.71 3.38 0.00 -0.94 -4.71 105.19 108.17 1u6r n GLY 289 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1u6r n GLY 289 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1u6r s LEU 290 N 0.00 4.35 -0.29 0.99 0.20 -1.26 -4.06 118.68 118.62 1u6r s LEU 290 Ca 0.00 1.44 0.01 0.00 0.69 0.00 0.00 54.13 56.28 1u6r s LEU 290 Cb 0.00 -3.34 0.08 0.00 -0.43 0.00 0.00 46.19 42.50 1u6r s LEU 290 CO 0.00 -0.19 0.02 -0.60 -0.29 0.00 0.00 176.35 175.29 1u6r s ARG 291 N 0.88 1.36 -0.10 1.98 3.52 0.42 -4.78 118.95 122.23 1u6r s ARG 291 Ca 0.45 -1.29 -0.02 0.00 -0.13 0.00 0.00 55.73 54.74 1u6r s ARG 291 Cb -0.20 -2.63 -0.03 0.00 -1.56 0.00 0.00 34.95 30.53 1u6r s ARG 291 CO 0.23 -0.80 -0.02 0.20 -0.81 0.00 0.00 175.30 174.11 1u6r s GLY 292 N 1.29 1.80 0.08 8.12 0.00 -1.26 -1.48 107.32 115.87 1u6r s GLY 292 Ca 0.03 -0.82 -0.18 0.00 0.00 0.00 0.00 44.72 43.75 1u6r s GLY 292 CO -0.12 -0.46 0.83 0.61 0.00 0.00 0.00 173.10 173.97 1u6r n GLY 293 N 2.49 0.60 3.21 0.20 0.00 0.17 -2.38 105.19 109.49 1u6r n GLY 293 Ca -0.18 -1.05 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 1u6r n GLY 293 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u6r s VAL 294 N -2.14 1.15 -0.35 1.61 -7.23 -0.54 -1.17 120.40 111.73 1u6r s VAL 294 Ca 0.19 -1.72 -0.20 0.00 -1.81 0.00 0.00 61.98 58.44 1u6r s VAL 294 Cb -0.01 -1.49 -0.00 0.00 0.56 0.00 0.00 36.38 35.44 1u6r s VAL 294 CO 0.02 -0.51 0.61 -1.00 -0.31 0.00 0.00 175.10 173.91 1u6r s HIS 295 N -2.38 3.16 -0.05 2.82 3.76 -0.51 -1.42 115.29 120.67 1u6r s HIS 295 Ca 0.08 0.34 0.02 0.00 -0.15 0.00 0.00 55.06 55.35 1u6r s HIS 295 Cb -0.03 -3.08 0.01 0.00 1.11 0.00 0.00 32.58 30.59 1u6r s HIS 295 CO 0.02 -0.59 -0.10 0.54 -0.85 0.00 0.00 174.74 173.75 1u6r s VAL 296 N 2.63 0.94 -0.35 -0.90 0.11 0.21 -0.42 120.40 122.63 1u6r s VAL 296 Ca 0.23 -0.39 -0.27 0.00 -2.93 0.00 0.00 61.98 58.63 1u6r s VAL 296 Cb -0.15 -0.86 0.01 0.00 -1.53 0.00 0.00 36.38 33.85 1u6r s VAL 296 CO 0.14 0.30 0.97 -0.75 -3.33 0.00 0.00 175.10 172.43 1u6r s LYS 297 N 0.56 3.93 -0.48 1.54 2.20 -0.13 -1.09 119.74 126.26 1u6r s LYS 297 Ca -0.11 0.76 0.08 0.00 -0.36 0.00 0.00 55.97 56.34 1u6r s LYS 297 Cb -0.14 -3.77 0.34 0.00 -1.51 0.00 0.00 37.83 32.76 1u6r s LYS 297 CO 0.02 -0.91 0.85 1.28 -0.36 0.00 0.00 175.35 176.23 1u6r n LEU 298 N 6.77 2.79 -0.18 5.43 4.77 -0.39 -4.87 117.00 131.32 1u6r n LEU 298 Ca 0.09 -5.37 -0.04 0.00 -0.03 0.00 0.00 56.01 50.65 1u6r n LEU 298 Cb 0.48 0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.66 1u6r n LEU 298 CO 0.58 2.33 1.04 0.00 -1.33 0.00 0.00 177.39 180.00 1u6r h ALA 299 N 2.99 0.69 0.00 -1.18 0.00 -1.91 -1.75 119.26 118.10 1u6r h ALA 299 Ca 0.12 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1u6r h ALA 299 Cb 0.72 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1u6r h ALA 299 CO 0.67 -0.05 -0.28 0.45 0.00 0.00 0.00 179.25 180.03 1u6r h HIS 300 N 0.55 0.00 -0.36 0.00 3.86 -1.92 -3.38 115.15 113.90 1u6r h HIS 300 Ca 0.23 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.42 1u6r h HIS 300 Cb 0.13 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.58 1u6r h HIS 300 CO -0.09 1.11 0.10 1.25 0.86 0.00 0.00 177.93 181.16 1u6r h LEU 301 N -1.00 0.47 -1.76 2.43 5.85 -1.90 -1.55 115.31 117.86 1u6r h LEU 301 Ca -0.08 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1u6r h LEU 301 Cb 1.06 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1u6r h LEU 301 CO -0.05 0.46 0.00 0.77 -0.34 0.00 0.00 178.44 179.28 1u6r h SER 302 N 0.51 0.00 -0.00 1.25 4.64 -1.50 -2.08 113.55 116.37 1u6r h SER 302 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1u6r h SER 302 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1u6r h SER 302 CO -0.01 0.00 -0.45 0.29 -0.87 0.00 0.00 176.83 175.80 1u6r n LYS 303 N -2.85 1.23 -2.31 4.77 5.02 -0.60 -4.93 118.16 118.50 1u6r n LYS 303 Ca -0.00 -1.00 -0.41 0.00 -2.02 0.00 0.00 58.31 54.87 1u6r n LYS 303 Cb 0.20 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 1u6r n LYS 303 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1u6r s HIS 304 N -2.46 3.34 0.64 2.13 2.46 -0.78 -4.93 115.29 115.69 1u6r s HIS 304 Ca 0.19 1.47 0.35 0.00 0.47 0.00 0.00 55.06 57.55 1u6r s HIS 304 Cb 0.18 -3.48 1.96 0.00 -0.13 0.00 0.00 32.58 31.11 1u6r s HIS 304 CO 0.56 -1.29 2.17 -1.35 -2.47 0.00 0.00 174.74 172.36 1u6r h PRO 305 N 4.30 0.00 -0.63 2.88 0.11 -1.93 -2.06 132.00 134.67 1u6r h PRO 305 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1u6r h PRO 305 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1u6r h PRO 305 CO 0.70 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.12 1u6r n LYS 306 N -3.32 3.49 0.01 1.05 5.02 -1.26 -4.66 118.16 118.50 1u6r n LYS 306 Ca -0.01 -2.81 -0.10 0.00 -2.02 0.00 0.00 58.31 53.37 1u6r n LYS 306 Cb 0.22 -1.80 -0.03 0.00 -0.02 0.00 0.00 35.03 33.40 1u6r n LYS 306 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1u6r h PHE 307 N 3.91 -0.61 -0.43 2.13 -0.00 -1.60 0.70 116.94 121.05 1u6r h PHE 307 Ca 0.00 0.03 -0.10 0.00 -0.00 0.00 0.00 57.97 57.90 1u6r h PHE 307 Cb 1.33 0.29 -0.02 0.00 -0.00 0.00 0.00 35.95 37.55 1u6r h PHE 307 CO 0.68 -0.31 -0.14 0.93 -0.00 0.00 0.00 178.31 179.46 1u6r h GLU 308 N -0.31 0.79 -0.52 1.11 4.39 -1.84 -1.99 114.58 116.22 1u6r h GLU 308 Ca 0.09 -0.28 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 1u6r h GLU 308 Cb 0.44 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1u6r h GLU 308 CO -0.28 0.89 0.16 1.49 -1.16 0.00 0.00 179.01 180.12 1u6r h GLU 309 N 0.71 0.80 -0.53 2.33 4.81 -1.76 -1.34 114.58 119.60 1u6r h GLU 309 Ca 0.11 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1u6r h GLU 309 Cb 0.64 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 1u6r h GLU 309 CO 0.04 0.74 0.31 0.82 -0.73 0.00 0.00 179.01 180.19 1u6r h ILE 310 N 0.70 1.04 -0.43 2.32 2.04 -0.59 0.89 117.51 123.50 1u6r h ILE 310 Ca 0.17 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1u6r h ILE 310 Cb 0.27 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 1u6r h ILE 310 CO -0.01 0.11 0.26 -0.07 0.00 0.00 0.00 178.15 178.45 1u6r h LEU 311 N 0.61 0.43 -0.61 1.44 3.38 -1.07 -1.16 115.31 118.32 1u6r h LEU 311 Ca 0.21 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.20 1u6r h LEU 311 Cb 0.04 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1u6r h LEU 311 CO -0.10 0.31 0.38 0.74 0.09 0.00 0.00 178.44 179.86 1u6r h THR 312 N 0.53 1.10 -0.86 0.22 2.02 -0.78 -1.19 112.91 113.95 1u6r h THR 312 Ca 0.17 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1u6r h THR 312 Cb -0.01 0.26 -0.04 0.00 -1.74 0.00 0.00 68.15 66.62 1u6r h THR 312 CO -0.06 0.14 0.54 0.03 0.37 0.00 0.00 175.52 176.54 1u6r h ARG 313 N 0.77 1.15 -0.00 6.66 2.47 -0.29 -2.16 114.38 122.97 1u6r h ARG 313 Ca 0.24 -0.09 0.00 0.00 -1.26 0.00 0.00 59.98 58.87 1u6r h ARG 313 Cb -0.01 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 28.06 1u6r h ARG 313 CO -0.09 0.78 -0.05 1.28 0.56 0.00 0.00 179.97 182.45 1u6r n LEU 314 N -4.38 0.52 -3.81 3.04 4.77 -0.49 -0.47 117.00 116.17 1u6r n LEU 314 Ca 0.10 -0.08 -0.27 0.00 -0.03 0.00 0.00 56.01 55.73 1u6r n LEU 314 Cb 0.04 -0.10 0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1u6r n LEU 314 CO 0.37 0.09 0.06 0.54 -1.33 0.00 0.00 177.39 177.13 1u6r n ARG 315 N -0.77 -5.57 -4.26 3.23 1.74 -0.71 -4.93 116.66 105.38 1u6r n ARG 315 Ca 0.18 0.63 -0.31 0.00 -0.77 0.00 0.00 57.85 57.58 1u6r n ARG 315 Cb 0.25 -5.43 -0.09 0.00 -1.02 0.00 0.00 32.46 26.16 1u6r n ARG 315 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1u6r s LEU 316 N -7.08 3.24 0.03 0.55 1.43 -0.53 -1.99 118.68 114.33 1u6r s LEU 316 Ca 0.43 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.33 1u6r s LEU 316 Cb -0.21 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 1u6r s LEU 316 CO 0.81 0.21 -0.04 -1.58 0.23 0.00 0.00 176.35 175.98 1u6r s GLN 317 N -2.00 2.58 -0.11 1.70 0.74 0.24 -4.37 119.66 118.43 1u6r s GLN 317 Ca 0.22 -0.74 -0.01 0.00 0.05 0.00 0.00 55.36 54.87 1u6r s GLN 317 Cb -0.11 -2.54 -0.03 0.00 1.10 0.00 0.00 33.01 31.43 1u6r s GLN 317 CO 0.13 0.59 -0.05 0.21 -0.55 0.00 0.00 175.29 175.62 1u6r s LYS 318 N -1.69 3.20 0.25 1.67 2.20 -1.26 -1.79 119.74 122.31 1u6r s LYS 318 Ca 0.20 -0.53 0.01 0.00 -0.36 0.00 0.00 55.97 55.28 1u6r s LYS 318 Cb -0.11 -2.74 -0.05 0.00 -1.51 0.00 0.00 37.83 33.42 1u6r s LYS 318 CO 0.11 0.46 0.11 1.03 -0.36 0.00 0.00 175.35 176.70 1u6r s ARG 319 N -0.25 1.37 0.94 4.03 0.52 0.35 -4.82 118.95 121.09 1u6r s ARG 319 Ca 0.04 -1.74 -0.14 0.00 -0.52 0.00 0.00 55.73 53.37 1u6r s ARG 319 Cb -0.13 -0.11 0.16 0.00 0.52 0.00 0.00 34.95 35.39 1u6r s ARG 319 CO 0.02 -0.33 1.16 0.20 0.02 0.00 0.00 175.30 176.38 1u6r s GLY 320 N -3.28 1.61 0.37 -3.53 0.00 -0.99 -1.14 107.32 100.36 1u6r s GLY 320 Ca 0.38 -0.68 0.06 0.00 0.00 0.00 0.00 44.72 44.48 1u6r s GLY 320 CO 0.14 -0.06 1.93 -0.84 0.00 0.00 0.00 173.10 174.27 1u6r h THR 321 N -1.59 1.17 -0.50 0.90 2.02 -1.58 -1.49 112.91 111.83 1u6r h THR 321 Ca -0.49 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.08 1u6r h THR 321 Cb 1.31 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 1u6r h THR 321 CO 0.56 0.22 0.00 0.61 0.37 0.00 0.00 175.52 177.28 1u6r n GLY 322 N -1.05 2.24 0.00 2.16 0.00 -1.26 -4.96 105.19 102.32 1u6r n GLY 322 Ca 0.02 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1u6r n GLY 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6r n GLY 323 N 0.89 -1.56 0.35 -0.02 0.00 -0.56 -4.75 105.19 99.54 1u6r n GLY 323 Ca 0.21 -2.13 0.17 0.00 0.00 0.00 0.00 46.02 44.27 1u6r n GLY 323 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1u6r h VAL 324 N 0.00 0.68 -0.58 1.61 3.04 -1.94 -1.27 116.25 117.78 1u6r h VAL 324 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1u6r h VAL 324 Cb 0.00 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 30.09 1u6r h VAL 324 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 177.03 1u6r n ASP 325 N -4.19 5.42 -4.33 3.17 8.00 -1.26 -4.70 116.55 118.66 1u6r n ASP 325 Ca 0.05 -2.80 -0.17 0.00 0.71 0.00 0.00 54.79 52.58 1u6r n ASP 325 Cb 0.43 -0.66 -0.10 0.00 -0.02 0.00 0.00 41.12 40.77 1u6r n ASP 325 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1u6r s THR 326 N -2.52 0.96 0.34 -3.53 -4.23 -0.50 -5.06 115.64 101.10 1u6r s THR 326 Ca 0.53 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1u6r s THR 326 Cb 0.39 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.79 1u6r s THR 326 CO 0.18 -0.27 0.55 0.00 -0.54 0.00 0.00 174.62 174.54 1u6r s ALA 327 N -3.47 3.70 0.17 3.99 0.00 -1.26 -2.34 121.76 122.54 1u6r s ALA 327 Ca 0.30 -0.90 -0.31 0.00 0.00 0.00 0.00 51.96 51.04 1u6r s ALA 327 Cb 0.06 -2.11 -0.09 0.00 0.00 0.00 0.00 23.12 20.98 1u6r s ALA 327 CO 0.10 -0.01 1.47 0.00 0.00 0.00 0.00 175.76 177.31 1u6r s ALA 328 N -2.31 3.68 -0.09 0.00 0.00 -1.26 -2.54 121.76 119.23 1u6r s ALA 328 Ca 0.40 1.27 -0.00 0.00 0.00 0.00 0.00 51.96 53.63 1u6r s ALA 328 Cb -0.10 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.42 1u6r s ALA 328 CO 0.36 -0.71 -0.07 0.08 0.00 0.00 0.00 175.76 175.43 1u6r s VAL 329 N 0.84 3.69 -1.43 0.00 1.01 -1.25 -4.55 120.40 118.70 1u6r s VAL 329 Ca 0.65 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 1u6r s VAL 329 Cb -0.41 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.45 1u6r s VAL 329 CO 0.34 0.57 0.21 0.61 0.00 0.00 0.00 175.10 176.82 1u6r n GLY 330 N 2.63 -0.50 2.47 4.51 0.00 -1.26 -1.33 105.19 111.70 1u6r n GLY 330 Ca -0.18 0.04 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 1u6r n GLY 330 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u6r n SER 331 N -2.10 -5.78 -4.47 1.61 7.64 -1.26 -4.85 113.62 104.40 1u6r n SER 331 Ca -0.15 0.16 -0.43 0.00 1.01 0.00 0.00 58.87 59.46 1u6r n SER 331 Cb 0.63 -4.91 -0.09 0.00 -1.01 0.00 0.00 64.21 58.83 1u6r n SER 331 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1u6r s VAL 332 N -2.95 5.18 -0.03 0.44 1.01 -0.44 -1.27 120.40 122.35 1u6r s VAL 332 Ca 0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 1u6r s VAL 332 Cb 0.00 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1u6r s VAL 332 CO 0.00 -0.37 0.07 -0.36 0.00 0.00 0.00 175.10 174.43 1u6r s PHE 333 N 1.87 3.27 -0.40 5.22 0.40 -0.25 -3.77 117.98 124.32 1u6r s PHE 333 Ca 0.08 0.22 -0.22 0.00 -0.60 0.00 0.00 56.93 56.41 1u6r s PHE 333 Cb -0.18 -1.76 0.02 0.00 0.51 0.00 0.00 43.02 41.60 1u6r s PHE 333 CO 0.11 0.55 0.74 0.34 0.70 0.00 0.00 175.22 177.66 1u6r s ASP 334 N -1.52 6.45 -0.18 1.36 3.68 -0.29 -0.62 116.67 125.55 1u6r s ASP 334 Ca 0.20 0.06 -0.00 0.00 2.13 0.00 0.00 52.55 54.94 1u6r s ASP 334 Cb -0.12 -2.37 0.00 0.00 -1.45 0.00 0.00 42.92 38.99 1u6r s ASP 334 CO 0.11 -0.78 -0.15 -0.63 0.13 0.00 0.00 175.17 173.85 1u6r s ILE 335 N 3.06 2.58 0.15 4.11 -1.09 -0.51 -0.49 121.20 129.01 1u6r s ILE 335 Ca 0.28 -0.78 -0.06 0.00 -2.23 0.00 0.00 60.65 57.86 1u6r s ILE 335 Cb -0.13 -2.10 -0.02 0.00 -1.58 0.00 0.00 42.46 38.63 1u6r s ILE 335 CO 0.19 0.51 0.20 -0.94 -1.23 0.00 0.00 174.94 173.66 1u6r s SER 336 N 1.10 0.14 0.25 3.58 1.04 -0.74 -1.46 113.70 117.61 1u6r s SER 336 Ca 0.00 -1.00 -0.30 0.00 0.48 0.00 0.00 55.95 55.13 1u6r s SER 336 Cb -0.14 0.38 -0.10 0.00 0.10 0.00 0.00 66.02 66.26 1u6r s SER 336 CO -0.05 -0.83 1.49 0.54 0.98 0.00 0.00 173.24 175.36 1u6r s ASN 337 N -3.00 6.58 0.09 7.02 4.22 -1.00 -0.59 114.94 128.26 1u6r s ASN 337 Ca 0.20 2.73 -0.06 0.00 -2.14 0.00 0.00 52.86 53.59 1u6r s ASN 337 Cb 0.05 -2.62 -0.24 0.00 1.28 0.00 0.00 41.25 39.72 1u6r s ASN 337 CO 0.01 -0.76 1.17 0.00 -2.04 0.00 0.00 177.10 175.48 1u6r h ALA 338 N 5.14 0.14 -3.26 3.54 0.00 -1.70 -3.44 119.26 119.69 1u6r h ALA 338 Ca -0.46 -0.83 -0.65 0.00 0.00 0.00 0.00 54.91 52.97 1u6r h ALA 338 Cb 1.22 0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 1u6r h ALA 338 CO 0.79 0.89 -0.62 -0.51 0.00 0.00 0.00 179.25 179.80 1u6r s ASP 339 N -7.19 5.33 0.00 0.00 1.01 -1.26 -5.00 116.67 109.56 1u6r s ASP 339 Ca -0.05 -0.01 0.00 0.00 0.71 0.00 0.00 52.55 53.20 1u6r s ASP 339 Cb 0.07 -1.41 0.00 0.00 1.01 0.00 0.00 42.92 42.59 1u6r s ASP 339 CO 0.89 0.23 0.00 0.54 0.21 0.00 0.00 175.17 177.04 1u6r n ARG 340 N 0.95 3.16 -5.04 8.23 1.74 -1.26 -4.96 116.66 119.48 1u6r n ARG 340 Ca -0.12 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.65 1u6r n ARG 340 Cb 0.52 -0.37 -0.17 0.00 -1.02 0.00 0.00 32.46 31.42 1u6r n ARG 340 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1u6r s LEU 341 N -0.57 2.02 0.00 0.55 2.96 -1.26 -1.79 118.68 120.59 1u6r s LEU 341 Ca 0.00 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.38 1u6r s LEU 341 Cb 0.00 -1.33 0.00 0.00 0.50 0.00 0.00 46.19 45.36 1u6r s LEU 341 CO 0.00 0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.77 1u6r n GLY 342 N 3.65 0.60 3.23 7.98 0.00 -1.26 -4.84 105.19 114.54 1u6r n GLY 342 Ca -0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1u6r n GLY 342 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u6r s SER 343 N -2.43 0.20 0.53 1.61 1.04 -1.26 -4.83 113.70 108.56 1u6r s SER 343 Ca 0.00 -1.11 0.02 0.00 0.48 0.00 0.00 55.95 55.33 1u6r s SER 343 Cb 0.00 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.51 1u6r s SER 343 CO 0.00 -0.80 0.75 -0.94 0.98 0.00 0.00 173.24 173.23 1u6r s SER 344 N -3.03 5.34 0.17 7.02 1.04 -1.25 -4.44 113.70 118.53 1u6r s SER 344 Ca 0.24 -0.03 -0.15 0.00 0.48 0.00 0.00 55.95 56.49 1u6r s SER 344 Cb 0.06 -0.89 0.06 0.00 0.10 0.00 0.00 66.02 65.35 1u6r s SER 344 CO 0.03 -1.09 1.82 -0.33 0.98 0.00 0.00 173.24 174.65 1u6r h GLU 345 N 0.14 0.61 -0.61 4.02 3.07 -1.86 -0.74 114.58 119.20 1u6r h GLU 345 Ca -0.42 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 58.38 1u6r h GLU 345 Cb 1.29 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 1u6r h GLU 345 CO 0.52 0.40 0.30 0.28 -1.40 0.00 0.00 179.01 179.11 1u6r h VAL 346 N 0.63 1.21 -0.84 3.13 2.07 -1.91 -0.32 116.25 120.21 1u6r h VAL 346 Ca 0.19 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 67.12 1u6r h VAL 346 Cb -0.04 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 1u6r h VAL 346 CO -0.06 0.24 0.55 -0.33 0.02 0.00 0.00 177.57 177.99 1u6r h GLU 347 N 0.84 1.12 -0.12 1.57 5.08 -1.86 -0.23 114.58 120.97 1u6r h GLU 347 Ca 0.21 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1u6r h GLU 347 Cb 0.10 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 1u6r h GLU 347 CO -0.03 0.75 0.01 1.96 -1.00 0.00 0.00 179.01 180.71 1u6r h GLN 348 N 1.15 0.21 -0.18 2.33 4.20 -0.60 -0.85 115.11 121.37 1u6r h GLN 348 Ca 0.31 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.85 1u6r h GLN 348 Cb -0.11 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1u6r h GLN 348 CO -0.06 0.42 -0.36 0.28 -0.67 0.00 0.00 178.83 178.43 1u6r h VAL 349 N -0.03 1.29 -0.70 -0.54 2.07 -1.00 -1.77 116.25 115.57 1u6r h VAL 349 Ca 0.04 -1.45 -0.05 0.00 0.82 0.00 0.00 66.70 66.06 1u6r h VAL 349 Cb 0.32 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1u6r h VAL 349 CO 0.00 0.45 0.26 -0.61 0.02 0.00 0.00 177.57 177.69 1u6r h GLN 350 N 0.32 1.06 -0.80 1.57 5.75 -0.91 0.56 115.11 122.65 1u6r h GLN 350 Ca 0.04 -0.20 -0.02 0.00 -0.15 0.00 0.00 58.65 58.31 1u6r h GLN 350 Cb 0.79 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 29.14 1u6r h GLN 350 CO 0.06 0.89 0.40 1.25 -2.65 0.00 0.00 178.83 178.78 1u6r h LEU 351 N 1.00 1.02 0.01 -2.39 6.46 -0.74 0.52 115.31 121.19 1u6r h LEU 351 Ca 0.23 -0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.88 1u6r h LEU 351 Cb 0.24 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 39.91 1u6r h LEU 351 CO -0.02 0.85 -0.00 0.58 -0.62 0.00 0.00 178.44 179.23 1u6r h VAL 352 N 1.13 1.23 -0.36 1.05 2.07 -0.82 -0.97 116.25 119.58 1u6r h VAL 352 Ca 0.28 -0.70 0.04 0.00 0.82 0.00 0.00 66.70 67.14 1u6r h VAL 352 Cb 0.08 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 1u6r h VAL 352 CO -0.04 0.18 0.13 0.58 0.02 0.00 0.00 177.57 178.44 1u6r h VAL 353 N -0.31 0.90 -0.31 2.57 2.07 -0.64 0.15 116.25 120.68 1u6r h VAL 353 Ca -0.00 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 1u6r h VAL 353 Cb 0.30 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1u6r h VAL 353 CO 0.00 0.05 0.04 0.44 0.02 0.00 0.00 177.57 178.12 1u6r h ASP 354 N 0.28 0.50 -0.33 0.57 3.32 -0.88 -1.02 116.42 118.86 1u6r h ASP 354 Ca 0.16 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 1u6r h ASP 354 Cb 0.14 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1u6r h ASP 354 CO -0.17 0.65 0.04 1.23 -1.72 0.00 0.00 179.24 179.28 1u6r h GLY 355 N 0.34 0.59 1.11 2.75 0.00 -0.98 -2.22 103.07 104.66 1u6r h GLY 355 Ca 0.09 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 1u6r h GLY 355 CO 0.01 0.37 0.05 -2.08 0.00 0.00 0.00 176.54 174.89 1u6r h VAL 356 N 0.37 1.26 -0.85 4.60 2.07 -0.66 -1.21 116.25 121.83 1u6r h VAL 356 Ca 0.10 -1.09 -0.00 0.00 0.82 0.00 0.00 66.70 66.52 1u6r h VAL 356 Cb 0.37 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1u6r h VAL 356 CO 0.01 0.40 0.52 0.11 0.02 0.00 0.00 177.57 178.63 1u6r h LYS 357 N 1.00 1.14 -0.51 1.57 1.57 -1.10 -0.65 116.57 119.59 1u6r h LYS 357 Ca 0.19 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1u6r h LYS 357 Cb 0.50 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1u6r h LYS 357 CO 0.02 0.79 0.18 1.25 -0.57 0.00 0.00 179.45 181.13 1u6r h LEU 358 N 1.16 0.72 -0.91 2.94 5.85 -1.05 -1.39 115.31 122.62 1u6r h LEU 358 Ca 0.31 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.78 1u6r h LEU 358 Cb -0.07 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1u6r h LEU 358 CO -0.06 0.71 0.13 0.24 -0.34 0.00 0.00 178.44 179.12 1u6r h MET 359 N 0.68 0.93 -0.49 1.25 2.86 -0.68 -0.14 114.93 119.34 1u6r h MET 359 Ca 0.17 -0.21 -0.07 0.00 -2.06 0.00 0.00 59.70 57.53 1u6r h MET 359 Cb 0.23 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1u6r h MET 359 CO -0.01 0.84 0.03 0.28 1.06 0.00 0.00 176.91 179.11 1u6r h VAL 360 N 0.89 1.26 -0.62 -2.22 2.07 -0.97 -0.28 116.25 116.38 1u6r h VAL 360 Ca 0.19 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1u6r h VAL 360 Cb 0.34 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1u6r h VAL 360 CO 0.00 0.36 0.31 -0.33 0.02 0.00 0.00 177.57 177.93 1u6r h GLU 361 N 0.72 0.87 -0.27 1.57 5.08 -0.62 -1.15 114.58 120.78 1u6r h GLU 361 Ca 0.14 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1u6r h GLU 361 Cb 0.48 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1u6r h GLU 361 CO 0.02 0.67 0.10 0.52 -1.00 0.00 0.00 179.01 179.32 1u6r h MET 362 N 0.88 0.41 -0.58 2.33 2.86 -0.64 -2.14 114.93 118.05 1u6r h MET 362 Ca 0.22 -0.08 0.06 0.00 -2.06 0.00 0.00 59.70 57.84 1u6r h MET 362 Cb 0.08 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.62 1u6r h MET 362 CO -0.03 0.46 0.29 1.49 1.06 0.00 0.00 176.91 180.17 1u6r h GLU 363 N 0.28 0.52 -0.64 1.72 4.57 -0.55 -0.96 114.58 119.53 1u6r h GLU 363 Ca 0.09 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1u6r h GLU 363 Cb 0.21 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1u6r h GLU 363 CO -0.01 0.35 0.29 0.87 -1.18 0.00 0.00 179.01 179.33 1u6r h LYS 364 N 0.54 0.93 -0.46 1.92 1.57 -1.12 -0.96 116.57 118.99 1u6r h LYS 364 Ca 0.27 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1u6r h LYS 364 Cb 0.21 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1u6r h LYS 364 CO -0.20 0.76 0.28 0.87 -0.57 0.00 0.00 179.45 180.59 1u6r h LYS 365 N 0.89 0.63 -0.46 3.15 1.57 -0.90 -2.71 116.57 118.73 1u6r h LYS 365 Ca 0.22 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.87 1u6r h LYS 365 Cb 0.15 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1u6r h LYS 365 CO -0.02 0.46 0.01 -0.07 -0.57 0.00 0.00 179.45 179.25 1u6r h LEU 366 N 0.61 0.71 -1.70 2.94 3.38 -0.82 -0.95 115.31 119.48 1u6r h LEU 366 Ca 0.17 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u6r h LEU 366 Cb -0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1u6r h LEU 366 CO -0.03 0.77 0.18 -0.33 0.09 0.00 0.00 178.44 179.12 1u6r h GLU 367 N 0.70 0.37 -0.11 1.13 5.08 -1.01 -2.33 114.58 118.41 1u6r h GLU 367 Ca 0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1u6r h GLU 367 Cb 0.42 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1u6r h GLU 367 CO 0.02 0.26 0.00 1.63 -1.00 0.00 0.00 179.01 179.91 1u6r n LYS 368 N -4.48 1.60 -1.11 2.33 5.02 -0.85 -4.91 118.16 115.75 1u6r n LYS 368 Ca 0.01 -0.90 0.00 0.00 -2.02 0.00 0.00 58.31 55.40 1u6r n LYS 368 Cb 0.08 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1u6r n LYS 368 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u6r n GLY 369 N 1.09 0.40 3.93 0.72 0.00 -0.88 -5.06 105.19 105.39 1u6r n GLY 369 Ca 0.17 -1.04 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 1u6r n GLY 369 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1u6r s GLN 370 N -2.23 2.47 0.29 1.61 -0.21 -0.42 -5.02 119.66 116.15 1u6r s GLN 370 Ca 0.00 -1.62 0.08 0.00 0.02 0.00 0.00 55.36 53.84 1u6r s GLN 370 Cb 0.00 -2.42 -0.04 0.00 1.00 0.00 0.00 33.01 31.55 1u6r s GLN 370 CO 0.00 -0.42 0.12 -1.12 -2.12 0.00 0.00 175.29 171.74 1u6r s SER 371 N -4.29 4.92 -0.07 5.90 0.01 -1.26 -3.98 113.70 114.92 1u6r s SER 371 Ca 0.48 -0.55 0.11 0.00 1.31 0.00 0.00 55.95 57.30 1u6r s SER 371 Cb -0.04 -0.98 0.24 0.00 0.21 0.00 0.00 66.02 65.44 1u6r s SER 371 CO 0.29 -0.12 1.17 2.30 0.41 0.00 0.00 173.24 177.29 1u6r n ILE 372 N -1.08 1.50 -0.02 1.44 -5.35 -1.26 -4.75 119.36 109.84 1u6r n ILE 372 Ca -0.06 -1.54 0.13 0.00 -0.27 0.00 0.00 62.75 61.01 1u6r n ILE 372 Cb 0.59 0.14 0.55 0.00 -1.74 0.00 0.00 39.64 39.18 1u6r n ILE 372 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1u6r h ASP 373 N 0.70 0.26 0.15 7.28 3.45 -2.01 -1.15 116.42 125.10 1u6r h ASP 373 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1u6r h ASP 373 Cb 0.86 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.58 1u6r h ASP 373 CO 0.04 0.16 -0.10 0.47 -1.57 0.00 0.00 179.24 178.23 1u6r n ASP 374 N -4.46 0.97 -0.03 6.45 8.00 -1.26 -4.11 116.55 122.10 1u6r n ASP 374 Ca 0.08 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.54 1u6r n ASP 374 Cb 0.37 0.02 0.01 0.00 -0.02 0.00 0.00 41.12 41.50 1u6r n ASP 374 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1u6r n MET 375 N -0.46 1.12 -1.94 -1.24 2.81 -0.44 -5.01 117.12 111.96 1u6r n MET 375 Ca 0.16 -1.05 -0.42 0.00 -1.81 0.00 0.00 57.70 54.58 1u6r n MET 375 Cb 0.31 -1.01 -0.03 0.00 -0.71 0.00 0.00 33.22 31.78 1u6r n MET 375 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1u6r s ILE 376 N -0.54 3.08 0.50 2.02 -1.09 -1.21 -4.93 121.20 119.03 1u6r s ILE 376 Ca 0.01 0.51 -0.20 0.00 -2.23 0.00 0.00 60.65 58.75 1u6r s ILE 376 Cb 0.01 -3.33 -0.08 0.00 -1.58 0.00 0.00 42.46 37.48 1u6r s ILE 376 CO 0.01 -0.00 1.04 -2.16 -1.23 0.00 0.00 174.94 172.60 1u6r s PRO 377 N 2.71 3.73 0.73 2.79 0.04 -1.26 -5.01 135.00 138.73 1u6r s PRO 377 Ca 0.74 1.35 -0.16 0.00 0.04 0.00 0.00 61.00 62.97 1u6r s PRO 377 Cb -0.39 -2.08 0.04 0.00 0.04 0.00 0.00 34.50 32.10 1u6r s PRO 377 CO 0.32 -0.49 1.25 0.00 0.04 0.00 0.00 177.00 178.11 1u6r s ALA 378 N -2.03 2.11 0.04 8.56 0.00 -1.26 -4.90 121.76 124.28 1u6r s ALA 378 Ca 0.67 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 53.34 1u6r s ALA 378 Cb -0.17 -3.52 -0.08 0.00 0.00 0.00 0.00 23.12 19.36 1u6r s ALA 378 CO 0.22 -1.93 1.67 -1.14 0.00 0.00 0.00 175.76 174.58 1u6r s GLN 379 N -3.77 4.19 0.00 0.00 2.00 -1.26 -4.64 119.66 116.18 1u6r s GLN 379 Ca 0.77 2.31 0.29 0.00 -2.00 0.00 0.00 55.36 56.73 1u6r s GLN 379 Cb -0.33 -3.73 1.27 0.00 0.80 0.00 0.00 33.01 31.02 1u6r s GLN 379 CO 0.45 -0.77 1.87 1.63 -0.50 0.00 0.00 175.29 177.96