#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hx7 s MET 1 N 0.00 4.22 0.10 -0.14 -1.94 -1.26 -5.08 119.30 115.20 3hx7 s MET 1 Ca 0.00 1.14 -0.01 0.00 -1.71 0.00 0.00 55.69 55.11 3hx7 s MET 1 Cb 0.00 -2.20 0.02 0.00 2.01 0.00 0.00 34.83 34.67 3hx7 s MET 1 CO 0.00 -0.04 0.14 0.45 -0.01 0.00 0.00 175.02 175.55 3hx7 n SER 2 N -0.62 0.07 -4.57 3.03 2.88 -1.26 -5.09 113.62 108.06 3hx7 n SER 2 Ca 0.07 -1.09 -0.31 0.00 -1.33 0.00 0.00 58.87 56.22 3hx7 n SER 2 Cb 0.54 -0.10 -0.10 0.00 -0.75 0.00 0.00 64.21 63.80 3hx7 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3hx7 s SER 3 N -1.52 4.39 0.61 -3.46 0.15 -1.26 -5.01 113.70 107.60 3hx7 s SER 3 Ca 0.08 -0.32 0.36 0.00 0.70 0.00 0.00 55.95 56.77 3hx7 s SER 3 Cb -0.00 -0.88 2.00 0.00 -1.71 0.00 0.00 66.02 65.42 3hx7 s SER 3 CO 0.06 0.22 2.27 0.06 1.20 0.00 0.00 173.24 177.04 3hx7 h GLN 4 N 4.02 0.00 0.00 5.44 3.07 -1.98 -2.49 115.11 123.17 3hx7 h GLN 4 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.26 3hx7 h GLN 4 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.72 3hx7 h GLN 4 CO 0.52 0.02 -1.00 0.44 0.09 0.00 0.00 178.83 178.90 3hx7 n ILE 5 N -3.48 0.00 -1.68 1.86 -5.35 -1.26 -4.99 119.36 104.46 3hx7 n ILE 5 Ca -0.03 -0.21 -0.44 0.00 -0.27 0.00 0.00 62.75 61.80 3hx7 n ILE 5 Cb 0.11 0.74 -0.04 0.00 -1.74 0.00 0.00 39.64 38.72 3hx7 n ILE 5 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 3hx7 n ARG 6 N -1.55 2.58 -3.66 6.28 0.63 -0.94 -4.83 116.66 115.16 3hx7 n ARG 6 Ca 0.01 0.94 -0.07 0.00 -0.92 0.00 0.00 57.85 57.81 3hx7 n ARG 6 Cb 0.28 -2.81 -0.09 0.00 0.45 0.00 0.00 32.46 30.29 3hx7 n ARG 6 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 3hx7 s GLN 7 N 2.91 0.37 -1.34 -0.14 0.74 -1.26 -4.89 119.66 116.05 3hx7 s GLN 7 Ca 0.84 1.09 0.00 0.00 0.05 0.00 0.00 55.36 57.34 3hx7 s GLN 7 Cb -0.55 0.39 0.00 0.00 1.10 0.00 0.00 33.01 33.95 3hx7 s GLN 7 CO 0.41 -0.24 0.00 -1.71 -0.55 0.00 0.00 175.29 173.20 3hx7 n ASN 8 N 5.31 -4.51 -4.22 6.67 5.15 -1.26 -4.98 115.26 117.42 3hx7 n ASN 8 Ca -0.10 0.30 -0.42 0.00 -0.60 0.00 0.00 54.58 53.76 3hx7 n ASN 8 Cb 0.50 -3.16 -0.07 0.00 -0.53 0.00 0.00 39.78 36.52 3hx7 n ASN 8 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 3hx7 s TYR 9 N -2.48 3.49 0.49 1.20 5.04 -1.26 -4.80 117.35 119.03 3hx7 s TYR 9 Ca 0.00 -2.06 -0.24 0.00 -2.44 0.00 0.00 57.07 52.33 3hx7 s TYR 9 Cb 0.00 -3.53 -0.07 0.00 0.35 0.00 0.00 41.96 38.71 3hx7 s TYR 9 CO 0.00 -0.96 1.42 -1.13 -1.34 0.00 0.00 175.55 173.54 3hx7 n SER 10 N 4.37 3.17 0.21 4.32 3.41 -1.26 -4.89 113.62 122.94 3hx7 n SER 10 Ca 0.01 1.07 0.06 0.00 -0.26 0.00 0.00 58.87 59.75 3hx7 n SER 10 Cb 0.42 -1.60 0.53 0.00 -0.26 0.00 0.00 64.21 63.29 3hx7 n SER 10 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3hx7 h THR 11 N 2.01 1.10 0.51 6.66 1.35 -1.99 -1.66 112.91 120.88 3hx7 h THR 11 Ca -0.51 -0.45 -0.02 0.00 -0.55 0.00 0.00 66.41 64.88 3hx7 h THR 11 Cb 1.28 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 3hx7 h THR 11 CO 0.60 0.13 -0.24 0.44 -0.25 0.00 0.00 175.52 176.19 3hx7 h ASP 12 N 0.05 -0.58 -0.93 5.36 3.45 -1.99 -1.98 116.42 119.79 3hx7 h ASP 12 Ca 0.01 0.02 0.27 0.00 0.43 0.00 0.00 57.03 57.76 3hx7 h ASP 12 Cb 0.22 0.15 -0.04 0.00 -0.56 0.00 0.00 39.33 39.10 3hx7 h ASP 12 CO 0.01 -0.39 0.67 0.58 -1.57 0.00 0.00 179.24 178.54 3hx7 h VAL 13 N -0.73 0.54 -0.37 -1.35 2.07 -1.91 0.39 116.25 114.89 3hx7 h VAL 13 Ca -0.07 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.35 3hx7 h VAL 13 Cb 0.52 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3hx7 h VAL 13 CO 0.11 0.00 -0.13 -0.08 0.02 0.00 0.00 177.57 177.50 3hx7 h GLU 14 N 0.02 0.74 -0.03 1.57 4.81 -1.11 -1.74 114.58 118.84 3hx7 h GLU 14 Ca 0.45 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3hx7 h GLU 14 Cb 1.76 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 31.10 3hx7 h GLU 14 CO -0.01 0.91 -0.03 0.00 -0.73 0.00 0.00 179.01 179.14 3hx7 h ALA 15 N 0.82 0.05 -0.78 2.92 0.00 0.36 -2.43 119.26 120.20 3hx7 h ALA 15 Ca 0.09 -0.26 0.16 0.00 0.00 0.00 0.00 54.91 54.89 3hx7 h ALA 15 Cb 0.65 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 3hx7 h ALA 15 CO 0.04 -0.18 0.52 0.00 0.00 0.00 0.00 179.25 179.63 3hx7 h ALA 16 N 0.53 2.12 -0.21 0.00 0.00 -0.57 -0.22 119.26 120.91 3hx7 h ALA 16 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.74 3hx7 h ALA 16 Cb 0.53 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3hx7 h ALA 16 CO 0.01 -0.33 -0.57 0.28 0.00 0.00 0.00 179.25 178.64 3hx7 h VAL 17 N 0.42 1.30 -0.49 0.00 2.07 -1.15 0.46 116.25 118.86 3hx7 h VAL 17 Ca 0.38 -1.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.06 3hx7 h VAL 17 Cb 0.88 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 3hx7 h VAL 17 CO -0.13 0.57 0.07 0.78 0.02 0.00 0.00 177.57 178.88 3hx7 h ASN 18 N 0.48 0.71 -0.08 0.57 2.35 -0.68 -1.29 115.58 117.63 3hx7 h ASN 18 Ca -0.01 -0.14 -0.06 0.00 -0.55 0.00 0.00 56.30 55.54 3hx7 h ASN 18 Cb 1.19 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.37 3hx7 h ASN 18 CO 0.12 0.74 -0.17 0.77 -1.65 0.00 0.00 177.43 177.24 3hx7 h SER 19 N 0.73 0.30 0.20 5.81 4.64 -1.00 -2.88 113.55 121.34 3hx7 h SER 19 Ca 0.16 -0.56 -0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3hx7 h SER 19 Cb 0.34 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3hx7 h SER 19 CO 0.01 0.81 -0.00 0.25 -0.87 0.00 0.00 176.83 177.02 3hx7 h LEU 20 N -0.20 0.00 -0.27 5.97 5.85 -0.57 0.27 115.31 126.35 3hx7 h LEU 20 Ca 0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.52 3hx7 h LEU 20 Cb 0.76 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 3hx7 h LEU 20 CO 0.04 0.00 -0.85 0.58 -0.34 0.00 0.00 178.44 177.87 3hx7 h VAL 21 N 0.00 1.40 -0.51 1.05 2.07 -1.09 -2.55 116.25 116.63 3hx7 h VAL 21 Ca -0.00 -2.35 -0.09 0.00 0.82 0.00 0.00 66.70 65.07 3hx7 h VAL 21 Cb 0.10 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 3hx7 h VAL 21 CO 0.00 0.70 -0.06 -1.13 0.02 0.00 0.00 177.57 177.10 3hx7 h ASN 22 N 0.23 0.89 0.08 0.57 -0.73 -0.30 -1.03 115.58 115.30 3hx7 h ASN 22 Ca -0.06 -0.26 -0.00 0.00 1.87 0.00 0.00 56.30 57.85 3hx7 h ASN 22 Cb 1.46 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 39.81 3hx7 h ASN 22 CO 0.14 0.98 -0.05 0.25 -0.37 0.00 0.00 177.43 178.38 3hx7 h LEU 23 N 0.82 -0.14 -1.54 0.34 5.85 -1.16 -1.32 115.31 118.16 3hx7 h LEU 23 Ca 0.14 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 3hx7 h LEU 23 Cb 0.58 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 3hx7 h LEU 23 CO 0.04 -0.09 -0.16 1.88 -0.34 0.00 0.00 178.44 179.76 3hx7 h TYR 24 N -0.14 0.10 -0.57 1.25 -1.99 -1.22 0.23 116.97 114.63 3hx7 h TYR 24 Ca -0.01 -0.01 -0.10 0.00 2.00 0.00 0.00 58.73 60.62 3hx7 h TYR 24 Cb 0.12 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 38.80 3hx7 h TYR 24 CO -0.09 0.26 -0.04 -0.07 -0.00 0.00 0.00 178.16 178.23 3hx7 h LEU 25 N 0.09 1.00 0.68 3.88 3.38 -0.71 -0.08 115.31 123.55 3hx7 h LEU 25 Ca 0.02 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 3hx7 h LEU 25 Cb 0.35 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.83 3hx7 h LEU 25 CO 0.02 1.07 -0.33 -0.61 0.09 0.00 0.00 178.44 178.69 3hx7 h GLN 26 N 0.92 -0.88 -0.97 1.13 4.15 -0.41 -1.77 115.11 117.28 3hx7 h GLN 26 Ca 0.16 0.06 0.28 0.00 0.77 0.00 0.00 58.65 59.92 3hx7 h GLN 26 Cb 0.58 0.20 -0.14 0.00 0.21 0.00 0.00 27.48 28.33 3hx7 h GLN 26 CO 0.03 -0.59 0.48 0.00 -1.93 0.00 0.00 178.83 176.83 3hx7 h ALA 27 N -1.33 1.74 -0.63 3.38 0.00 -0.50 0.81 119.26 122.72 3hx7 h ALA 27 Ca -0.09 0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3hx7 h ALA 27 Cb 0.70 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3hx7 h ALA 27 CO 0.15 -0.49 0.20 1.03 0.00 0.00 0.00 179.25 180.15 3hx7 h SER 28 N 0.34 0.92 0.26 0.00 0.87 -0.90 -1.62 113.55 113.43 3hx7 h SER 28 Ca 0.67 -0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 61.01 3hx7 h SER 28 Cb 1.43 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3hx7 h SER 28 CO -0.59 0.88 -0.13 0.22 -0.53 0.00 0.00 176.83 176.68 3hx7 h TYR 29 N 0.91 -0.33 -0.79 2.24 3.20 0.15 -1.76 116.97 120.59 3hx7 h TYR 29 Ca 0.21 -0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.21 3hx7 h TYR 29 Cb 0.29 0.11 -0.10 0.00 1.54 0.00 0.00 36.73 38.57 3hx7 h TYR 29 CO 0.02 -0.15 0.35 1.15 -1.64 0.00 0.00 178.16 177.89 3hx7 h THR 30 N -0.43 0.68 0.00 1.81 2.02 -0.74 0.46 112.91 116.70 3hx7 h THR 30 Ca -0.04 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.97 3hx7 h THR 30 Cb 0.33 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 3hx7 h THR 30 CO 0.06 0.09 0.00 1.88 0.37 0.00 0.00 175.52 177.92 3hx7 h TYR 31 N 0.50 0.00 -0.01 3.16 0.05 -1.04 -1.67 116.97 117.96 3hx7 h TYR 31 Ca 0.43 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.97 3hx7 h TYR 31 Cb 0.65 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.40 3hx7 h TYR 31 CO -0.14 0.00 -0.98 1.25 -1.05 0.00 0.00 178.16 177.24 3hx7 h LEU 32 N 0.00 0.76 0.74 3.88 5.85 0.80 -1.97 115.31 125.37 3hx7 h LEU 32 Ca 0.00 -0.60 -0.04 0.00 0.84 0.00 0.00 57.88 58.08 3hx7 h LEU 32 Cb 0.48 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 41.28 3hx7 h LEU 32 CO 0.00 1.40 -0.35 -1.28 -0.34 0.00 0.00 178.44 177.87 3hx7 h SER 33 N 0.34 -0.84 -0.71 1.25 0.87 -0.79 -2.58 113.55 111.10 3hx7 h SER 33 Ca -0.10 0.01 0.13 0.00 -1.23 0.00 0.00 61.79 60.60 3hx7 h SER 33 Cb 1.62 0.22 -0.09 0.00 -0.44 0.00 0.00 62.40 63.71 3hx7 h SER 33 CO 0.18 -0.51 0.24 -0.07 -0.53 0.00 0.00 176.83 176.15 3hx7 h LEU 34 N -1.15 0.19 -0.95 2.23 3.38 -1.41 -1.31 115.31 116.28 3hx7 h LEU 34 Ca -0.10 0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3hx7 h LEU 34 Cb 0.78 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 3hx7 h LEU 34 CO 0.17 0.07 0.61 1.23 0.09 0.00 0.00 178.44 180.61 3hx7 h GLY 35 N 0.38 1.42 1.51 0.83 0.00 -1.22 -2.21 103.07 103.79 3hx7 h GLY 35 Ca 0.38 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 3hx7 h GLY 35 CO -0.40 0.34 -0.62 0.74 0.00 0.00 0.00 176.54 176.59 3hx7 h PHE 36 N 1.13 0.00 0.33 5.60 -1.00 -0.97 -3.32 116.94 118.71 3hx7 h PHE 36 Ca 0.40 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.16 3hx7 h PHE 36 Cb 0.12 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.68 3hx7 h PHE 36 CO -0.01 0.16 -0.16 -0.92 -1.61 0.00 0.00 178.31 175.77 3hx7 h TYR 37 N 0.00 -0.41 0.00 -0.55 3.20 -0.64 -1.42 116.97 117.16 3hx7 h TYR 37 Ca -0.02 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.84 3hx7 h TYR 37 Cb 1.14 0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.54 3hx7 h TYR 37 CO 0.00 -0.25 0.00 1.19 -1.64 0.00 0.00 178.16 177.46 3hx7 n PHE 38 N -5.28 0.00 0.47 -3.82 3.72 -1.08 -1.46 117.46 110.02 3hx7 n PHE 38 Ca -0.10 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.35 3hx7 n PHE 38 Cb 0.19 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 3hx7 n PHE 38 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3hx7 n ASP 39 N -0.52 0.94 -4.77 4.37 4.64 -0.55 -1.72 116.55 118.95 3hx7 n ASP 39 Ca 0.01 -0.97 -0.41 0.00 -1.38 0.00 0.00 54.79 52.03 3hx7 n ASP 39 Cb 0.00 0.68 -0.01 0.00 -1.04 0.00 0.00 41.12 40.75 3hx7 n ASP 39 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 3hx7 s ARG 40 N -1.62 4.20 0.57 -0.67 0.52 -0.53 -4.72 118.95 116.69 3hx7 s ARG 40 Ca 0.07 2.44 0.28 0.00 -0.52 0.00 0.00 55.73 58.00 3hx7 s ARG 40 Cb 0.08 -3.02 1.49 0.00 0.52 0.00 0.00 34.95 34.02 3hx7 s ARG 40 CO 0.32 -0.45 1.98 0.38 0.02 0.00 0.00 175.30 177.56 3hx7 h ASP 41 N 3.70 0.00 -0.45 0.23 -0.00 -1.94 0.44 116.42 118.40 3hx7 h ASP 41 Ca -0.49 0.00 -0.04 0.00 -0.00 0.00 0.00 57.03 56.50 3hx7 h ASP 41 Cb 1.23 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.54 3hx7 h ASP 41 CO 0.69 0.00 0.05 -0.90 -0.00 0.00 0.00 179.24 179.08 3hx7 n ASP 42 N -4.00 4.35 0.00 4.15 3.85 -1.26 -4.05 116.55 119.58 3hx7 n ASP 42 Ca 0.08 -2.73 0.00 0.00 -0.71 0.00 0.00 54.79 51.43 3hx7 n ASP 42 Cb 0.58 -0.65 0.00 0.00 -1.35 0.00 0.00 41.12 39.70 3hx7 n ASP 42 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 3hx7 n VAL 43 N 0.33 0.00 -2.95 2.12 0.31 -0.01 -5.09 118.33 113.05 3hx7 n VAL 43 Ca 0.23 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.47 3hx7 n VAL 43 Cb 0.98 -0.14 0.00 0.00 -0.91 0.00 0.00 33.84 33.77 3hx7 n VAL 43 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hx7 n ALA 44 N -1.76 -1.64 -3.37 3.52 0.00 0.13 -4.92 120.51 112.47 3hx7 n ALA 44 Ca 0.00 -0.10 -0.26 0.00 0.00 0.00 0.00 53.44 53.08 3hx7 n ALA 44 Cb 0.04 -0.25 -0.08 0.00 0.00 0.00 0.00 19.45 19.16 3hx7 n ALA 44 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hx7 n LEU 45 N -1.24 2.29 -0.38 0.00 4.77 -0.70 -4.97 117.00 116.77 3hx7 n LEU 45 Ca -0.12 -5.12 0.30 0.00 -0.03 0.00 0.00 56.01 51.04 3hx7 n LEU 45 Cb 0.25 -0.17 0.57 0.00 -2.33 0.00 0.00 43.42 41.74 3hx7 n LEU 45 CO 0.23 2.03 1.20 -0.08 -1.33 0.00 0.00 177.39 179.44 3hx7 h GLU 46 N 4.26 0.21 0.11 3.23 4.81 -1.92 0.27 114.58 125.55 3hx7 h GLU 46 Ca 0.15 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3hx7 h GLU 46 Cb 0.75 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.09 3hx7 h GLU 46 CO 0.68 0.14 -0.05 0.78 -0.73 0.00 0.00 179.01 179.83 3hx7 h GLY 47 N 0.22 -0.15 1.90 1.92 0.00 -1.93 0.21 103.07 105.24 3hx7 h GLY 47 Ca 0.74 0.05 -0.05 0.00 0.00 0.00 0.00 47.33 48.08 3hx7 h GLY 47 CO -0.44 -0.05 -0.17 -2.08 0.00 0.00 0.00 176.54 173.80 3hx7 h VAL 48 N -0.40 1.16 0.13 4.60 2.07 -1.53 -1.72 116.25 120.57 3hx7 h VAL 48 Ca -0.01 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 3hx7 h VAL 48 Cb 0.33 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 3hx7 h VAL 48 CO 0.02 0.22 -0.06 -1.28 0.02 0.00 0.00 177.57 176.50 3hx7 h SER 49 N 0.12 -0.15 -0.78 0.57 0.87 -0.74 -2.65 113.55 110.79 3hx7 h SER 49 Ca 0.02 -0.26 0.04 0.00 -1.23 0.00 0.00 61.79 60.36 3hx7 h SER 49 Cb 0.37 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.32 3hx7 h SER 49 CO 0.02 0.20 0.49 -0.74 -0.53 0.00 0.00 176.83 176.27 3hx7 h HIS 50 N -0.51 0.91 -0.10 2.24 6.17 -0.35 -1.45 115.15 122.06 3hx7 h HIS 50 Ca -0.02 0.03 0.02 0.00 0.71 0.00 0.00 60.37 61.11 3hx7 h HIS 50 Cb 0.40 -0.30 -0.03 0.00 2.52 0.00 0.00 27.41 30.01 3hx7 h HIS 50 CO 0.03 0.50 -0.05 0.35 0.71 0.00 0.00 177.93 179.47 3hx7 h PHE 51 N 0.93 -0.12 0.00 5.26 3.57 -1.28 -1.07 116.94 124.23 3hx7 h PHE 51 Ca 0.32 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.82 3hx7 h PHE 51 Cb 0.07 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 3hx7 h PHE 51 CO -0.04 -0.09 -0.07 0.74 -2.23 0.00 0.00 178.31 176.63 3hx7 h PHE 52 N -0.05 0.00 -0.05 0.41 0.05 -1.10 -1.79 116.94 114.41 3hx7 h PHE 52 Ca 0.06 0.00 -0.24 0.00 3.82 0.00 0.00 57.97 61.61 3hx7 h PHE 52 Cb 0.13 0.00 0.02 0.00 2.00 0.00 0.00 35.95 38.10 3hx7 h PHE 52 CO -0.17 0.07 -0.90 0.00 -0.18 0.00 0.00 178.31 177.13 3hx7 h ARG 53 N 0.00 0.70 -0.47 1.51 3.08 -0.60 -2.28 114.38 116.32 3hx7 h ARG 53 Ca -0.00 -0.68 -0.05 0.00 0.07 0.00 0.00 59.98 59.32 3hx7 h ARG 53 Cb 0.60 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 3hx7 h ARG 53 CO 0.01 1.28 0.11 0.93 -1.07 0.00 0.00 179.97 181.22 3hx7 h GLU 54 N 0.38 0.76 0.00 0.04 5.08 -0.99 -1.89 114.58 117.96 3hx7 h GLU 54 Ca -0.10 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.06 3hx7 h GLU 54 Cb 1.55 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.70 3hx7 h GLU 54 CO 0.18 0.75 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.77 3hx7 h LEU 55 N 0.63 0.00 -0.43 1.33 3.38 -1.32 -0.28 115.31 118.63 3hx7 h LEU 55 Ca 0.15 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 3hx7 h LEU 55 Cb 0.34 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 3hx7 h LEU 55 CO 0.00 0.10 -0.54 0.00 0.09 0.00 0.00 178.44 178.09 3hx7 h ALA 56 N 1.90 0.61 0.00 1.53 0.00 -0.75 -2.81 119.26 119.74 3hx7 h ALA 56 Ca -0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.29 3hx7 h ALA 56 Cb 0.23 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3hx7 h ALA 56 CO 0.01 0.68 -0.53 1.49 0.00 0.00 0.00 179.25 180.90 3hx7 h GLU 57 N 0.53 0.00 -0.14 0.00 4.57 -0.72 -2.73 114.58 116.09 3hx7 h GLU 57 Ca 0.01 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.06 3hx7 h GLU 57 Cb 1.11 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 3hx7 h GLU 57 CO 0.11 0.53 -0.49 0.93 -1.18 0.00 0.00 179.01 178.91 3hx7 h GLU 58 N 0.00 0.36 0.01 1.92 5.08 -0.90 -2.43 114.58 118.62 3hx7 h GLU 58 Ca -0.01 -0.21 -0.21 0.00 -1.00 0.00 0.00 59.36 57.94 3hx7 h GLU 58 Cb 1.07 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3hx7 h GLU 58 CO 0.07 0.78 -0.90 0.87 -1.00 0.00 0.00 179.01 178.82 3hx7 h LYS 59 N 0.29 0.25 -0.33 2.33 1.79 -1.38 -2.52 116.57 117.00 3hx7 h LYS 59 Ca 0.01 -0.28 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 3hx7 h LYS 59 Cb 0.97 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.69 3hx7 h LYS 59 CO 0.08 1.00 0.18 -0.09 -1.08 0.00 0.00 179.45 179.54 3hx7 h ARG 60 N 0.14 0.46 0.00 3.15 2.43 -1.33 -0.82 114.38 118.40 3hx7 h ARG 60 Ca -0.06 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 3hx7 h ARG 60 Cb 1.54 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 31.00 3hx7 h ARG 60 CO 0.14 0.38 -0.03 0.93 -1.51 0.00 0.00 179.97 179.89 3hx7 h GLU 61 N 0.41 0.00 0.13 0.20 5.08 -1.38 -0.69 114.58 118.33 3hx7 h GLU 61 Ca 0.12 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.19 3hx7 h GLU 61 Cb 0.06 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.32 3hx7 h GLU 61 CO -0.02 0.03 -1.25 0.78 -1.00 0.00 0.00 179.01 177.56 3hx7 h GLY 62 N 0.30 0.42 1.23 -3.84 0.00 -0.73 -2.67 103.07 97.78 3hx7 h GLY 62 Ca -0.00 -1.00 0.00 0.00 0.00 0.00 0.00 47.33 46.33 3hx7 h GLY 62 CO 0.00 0.88 -0.55 1.58 0.00 0.00 0.00 176.54 178.45 3hx7 n TYR 63 N -3.62 0.52 0.11 5.60 0.18 -0.68 -2.41 117.16 116.86 3hx7 n TYR 63 Ca -0.10 0.15 0.02 0.00 1.88 0.00 0.00 57.90 59.85 3hx7 n TYR 63 Cb 1.01 -0.64 -0.00 0.00 -0.38 0.00 0.00 39.34 39.33 3hx7 n TYR 63 CO 0.00 0.00 0.00 0.93 -2.08 0.00 0.00 176.86 175.71 3hx7 h GLU 64 N 0.00 0.00 0.08 -3.48 5.08 -1.23 -2.48 114.58 112.56 3hx7 h GLU 64 Ca 0.00 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.11 3hx7 h GLU 64 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3hx7 h GLU 64 CO 0.00 0.47 -1.12 -0.09 -1.00 0.00 0.00 179.01 177.27 3hx7 h ARG 65 N 0.00 0.28 0.00 2.33 2.43 -1.42 -2.63 114.38 115.37 3hx7 h ARG 65 Ca -0.04 -0.41 -0.11 0.00 -0.81 0.00 0.00 59.98 58.61 3hx7 h ARG 65 Cb 1.44 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 31.11 3hx7 h ARG 65 CO 0.06 1.15 -0.53 -0.07 -1.51 0.00 0.00 179.97 179.07 3hx7 h LEU 66 N 0.11 0.00 0.00 3.80 3.38 -1.50 -2.45 115.31 118.65 3hx7 h LEU 66 Ca -0.11 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.60 3hx7 h LEU 66 Cb 1.82 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.59 3hx7 h LEU 66 CO 0.18 0.53 -1.11 -0.07 0.09 0.00 0.00 178.44 178.07 3hx7 h LEU 67 N 0.00 0.74 -0.70 1.67 3.38 -1.43 -2.00 115.31 116.97 3hx7 h LEU 67 Ca -0.01 -0.64 -0.09 0.00 0.09 0.00 0.00 57.88 57.23 3hx7 h LEU 67 Cb 1.20 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3hx7 h LEU 67 CO 0.07 1.45 -0.00 0.50 0.09 0.00 0.00 178.44 180.55 3hx7 h LYS 68 N 0.27 1.00 -0.14 1.13 1.63 -1.48 -2.53 116.57 116.45 3hx7 h LYS 68 Ca -0.14 -0.31 -0.11 0.00 -0.85 0.00 0.00 60.65 59.25 3hx7 h LYS 68 Cb 1.77 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 33.29 3hx7 h LYS 68 CO 0.21 0.98 -0.38 1.98 -3.45 0.00 0.00 179.45 178.79 3hx7 h MET 69 N 0.92 0.30 -0.18 1.90 4.05 -1.43 -1.47 114.93 119.02 3hx7 h MET 69 Ca 0.17 -0.14 -0.01 0.00 -0.28 0.00 0.00 59.70 59.44 3hx7 h MET 69 Cb 0.54 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 3hx7 h MET 69 CO 0.03 0.64 0.09 0.37 0.23 0.00 0.00 176.91 178.27 3hx7 h GLN 70 N 0.26 0.26 -0.55 0.39 5.75 -1.08 -2.15 115.11 117.99 3hx7 h GLN 70 Ca 0.03 -0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.42 3hx7 h GLN 70 Cb 0.79 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.27 3hx7 h GLN 70 CO 0.06 0.29 0.05 -0.91 -2.65 0.00 0.00 178.83 175.68 3hx7 h ASN 71 N 0.16 0.90 0.20 -0.69 2.35 -1.28 0.58 115.58 117.79 3hx7 h ASN 71 Ca 0.06 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 3hx7 h ASN 71 Cb 0.12 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 3hx7 h ASN 71 CO -0.01 0.95 -0.04 1.56 -1.65 0.00 0.00 177.43 178.25 3hx7 h GLN 72 N 0.81 0.00 -0.01 0.81 4.20 -0.99 -1.23 115.11 118.70 3hx7 h GLN 72 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3hx7 h GLN 72 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 3hx7 h GLN 72 CO 0.02 0.04 -0.45 0.54 -0.67 0.00 0.00 178.83 178.31 3hx7 n ARG 73 N -3.51 1.14 -0.26 1.46 5.12 -0.83 -4.95 116.66 114.83 3hx7 n ARG 73 Ca -0.02 -0.91 0.00 0.00 -1.93 0.00 0.00 57.85 54.98 3hx7 n ARG 73 Cb 0.14 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 29.96 3hx7 n ARG 73 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hx7 n GLY 74 N 1.41 0.74 3.78 -0.13 0.00 -0.47 -4.16 105.19 106.36 3hx7 n GLY 74 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3hx7 n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hx7 s GLY 75 N -1.48 2.64 -0.20 -0.02 0.00 0.17 -4.76 107.32 103.67 3hx7 s GLY 75 Ca 0.00 0.75 -0.07 0.00 0.00 0.00 0.00 44.72 45.40 3hx7 s GLY 75 CO 0.00 1.13 0.07 0.50 0.00 0.00 0.00 173.10 174.80 3hx7 s ARG 76 N -2.99 3.92 -0.00 2.90 1.81 -1.26 -3.84 118.95 119.49 3hx7 s ARG 76 Ca 0.66 -0.37 -0.30 0.00 -1.72 0.00 0.00 55.73 54.00 3hx7 s ARG 76 Cb -0.22 -3.24 -0.06 0.00 -0.45 0.00 0.00 34.95 30.98 3hx7 s ARG 76 CO 0.26 0.19 1.57 0.00 -0.68 0.00 0.00 175.30 176.64 3hx7 s ALA 77 N 0.61 3.63 -0.24 2.13 0.00 -1.26 -4.98 121.76 121.64 3hx7 s ALA 77 Ca 0.03 0.99 0.01 0.00 0.00 0.00 0.00 51.96 52.99 3hx7 s ALA 77 Cb -0.13 -3.68 0.06 0.00 0.00 0.00 0.00 23.12 19.37 3hx7 s ALA 77 CO 0.01 -1.16 -0.05 -0.51 0.00 0.00 0.00 175.76 174.06 3hx7 s LEU 78 N 3.11 2.69 0.05 0.00 1.43 -1.26 -5.14 118.68 119.57 3hx7 s LEU 78 Ca 0.70 -1.25 -0.18 0.00 -1.03 0.00 0.00 54.13 52.37 3hx7 s LEU 78 Cb -0.34 -1.20 -0.06 0.00 0.03 0.00 0.00 46.19 44.61 3hx7 s LEU 78 CO 0.29 -0.25 0.53 -0.36 0.23 0.00 0.00 176.35 176.79 3hx7 s PHE 79 N 1.37 3.78 0.51 0.29 0.08 -1.26 -4.83 117.98 117.92 3hx7 s PHE 79 Ca -0.05 1.20 0.06 0.00 0.12 0.00 0.00 56.93 58.26 3hx7 s PHE 79 Cb -0.19 -2.45 0.02 0.00 -0.57 0.00 0.00 43.02 39.83 3hx7 s PHE 79 CO -0.07 0.59 0.35 -0.65 -0.10 0.00 0.00 175.22 175.35 3hx7 s GLN 80 N -1.06 2.28 0.28 0.44 -1.52 -1.26 -5.10 119.66 113.72 3hx7 s GLN 80 Ca 0.28 -1.97 -0.29 0.00 -1.95 0.00 0.00 55.36 51.42 3hx7 s GLN 80 Cb -0.19 -2.08 -0.10 0.00 -0.22 0.00 0.00 33.01 30.42 3hx7 s GLN 80 CO 0.17 -0.50 1.25 -0.51 -0.25 0.00 0.00 175.29 175.46 3hx7 s ASP 81 N -4.20 6.94 -0.32 5.90 -0.00 -1.26 -4.99 116.67 118.74 3hx7 s ASP 81 Ca 0.35 2.49 -0.19 0.00 -0.00 0.00 0.00 52.55 55.20 3hx7 s ASP 81 Cb -0.01 -2.63 -0.01 0.00 -0.00 0.00 0.00 42.92 40.27 3hx7 s ASP 81 CO 0.21 -0.43 0.58 -0.63 -0.00 0.00 0.00 175.17 174.90 3hx7 s ILE 82 N -0.76 4.97 0.51 0.77 1.01 -1.26 -5.05 121.20 121.40 3hx7 s ILE 82 Ca 0.50 0.70 -0.22 0.00 0.00 0.00 0.00 60.65 61.63 3hx7 s ILE 82 Cb -0.37 -3.97 -0.06 0.00 0.01 0.00 0.00 42.46 38.07 3hx7 s ILE 82 CO 0.45 -0.14 1.26 -0.75 0.00 0.00 0.00 174.94 175.76 3hx7 s LYS 83 N 2.53 3.40 0.59 2.79 2.20 -1.26 -5.01 119.74 124.97 3hx7 s LYS 83 Ca 0.23 1.99 -0.16 0.00 -0.36 0.00 0.00 55.97 57.67 3hx7 s LYS 83 Cb -0.15 -2.29 -0.04 0.00 -1.51 0.00 0.00 37.83 33.84 3hx7 s LYS 83 CO 0.12 -0.91 1.05 -1.59 -0.36 0.00 0.00 175.35 173.66 3hx7 s LYS 84 N -2.85 3.36 0.32 4.03 -2.85 -1.26 -4.87 119.74 115.62 3hx7 s LYS 84 Ca 0.69 1.20 -0.29 0.00 -1.00 0.00 0.00 55.97 56.57 3hx7 s LYS 84 Cb -0.34 -2.04 -0.12 0.00 -2.06 0.00 0.00 37.83 33.26 3hx7 s LYS 84 CO 0.41 -0.77 1.33 -2.30 0.10 0.00 0.00 175.35 174.11 3hx7 n PRO 85 N -1.98 2.15 0.02 1.78 -0.02 -1.26 -4.87 135.00 130.83 3hx7 n PRO 85 Ca 0.09 0.76 0.02 0.00 -2.02 0.00 0.00 63.50 62.34 3hx7 n PRO 85 Cb 0.53 -2.36 0.08 0.00 -0.02 0.00 0.00 33.50 31.73 3hx7 n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hx7 n ALA 86 N 0.71 0.94 -2.72 3.55 0.00 -1.26 -4.67 120.51 117.07 3hx7 n ALA 86 Ca 0.06 0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 3hx7 n ALA 86 Cb 0.35 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.72 3hx7 n ALA 86 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hx7 s GLU 87 N -3.03 0.50 -0.17 0.00 0.41 -1.26 -5.02 118.70 110.14 3hx7 s GLU 87 Ca -0.00 -0.76 0.17 0.00 -0.41 0.00 0.00 54.97 53.97 3hx7 s GLU 87 Cb 0.01 0.19 -0.25 0.00 -1.78 0.00 0.00 34.13 32.30 3hx7 s GLU 87 CO 0.03 -0.11 0.19 -0.25 -0.49 0.00 0.00 175.26 174.62 3hx7 n ASP 88 N 0.96 0.16 -4.17 -0.19 8.00 -1.26 -4.92 116.55 115.14 3hx7 n ASP 88 Ca -0.20 0.08 -0.25 0.00 0.71 0.00 0.00 54.79 55.13 3hx7 n ASP 88 Cb 0.58 0.82 -0.15 0.00 -0.02 0.00 0.00 41.12 42.35 3hx7 n ASP 88 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3hx7 s GLU 89 N -2.53 1.44 0.00 -1.24 2.02 -1.26 -4.99 118.70 112.14 3hx7 s GLU 89 Ca -0.09 -0.63 0.18 0.00 0.02 0.00 0.00 54.97 54.46 3hx7 s GLU 89 Cb 0.06 -1.38 0.19 0.00 0.10 0.00 0.00 34.13 33.10 3hx7 s GLU 89 CO 0.83 0.37 1.13 0.91 0.02 0.00 0.00 175.26 178.52 3hx7 n TRP 90 N 2.66 0.09 -4.04 1.61 7.02 -1.26 -5.08 117.44 118.44 3hx7 n TRP 90 Ca -0.15 -0.06 0.00 0.00 -1.02 0.00 0.00 57.50 56.28 3hx7 n TRP 90 Cb 0.54 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.43 3hx7 n TRP 90 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3hx7 n GLY 91 N 1.06 0.22 3.96 6.99 0.00 -1.26 -3.60 105.19 112.56 3hx7 n GLY 91 Ca 0.12 -0.97 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 3hx7 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hx7 s LYS 92 N 0.00 3.40 0.29 1.61 1.02 -1.26 -4.88 119.74 119.91 3hx7 s LYS 92 Ca 0.00 -0.55 -0.03 0.00 0.02 0.00 0.00 55.97 55.41 3hx7 s LYS 92 Cb 0.00 -2.74 0.59 0.00 -0.52 0.00 0.00 37.83 35.16 3hx7 s LYS 92 CO 0.00 0.19 1.54 2.41 -0.92 0.00 0.00 175.35 178.58 3hx7 n THR 93 N -1.68 -0.41 0.10 2.17 -1.04 -1.26 0.25 114.28 112.40 3hx7 n THR 93 Ca -0.05 2.22 0.04 0.00 -2.04 0.00 0.00 64.05 64.22 3hx7 n THR 93 Cb 0.57 -3.15 0.44 0.00 -1.82 0.00 0.00 70.33 66.36 3hx7 n THR 93 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3hx7 h PRO 94 N 0.00 0.32 -0.03 -2.82 0.11 -1.95 -0.83 132.00 126.79 3hx7 h PRO 94 Ca 0.53 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.58 3hx7 h PRO 94 Cb 0.96 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 3hx7 h PRO 94 CO -0.98 0.32 -0.05 -0.44 -0.21 0.00 0.00 178.00 176.64 3hx7 h ASP 95 N 0.31 0.10 0.17 -2.05 3.45 -0.49 -2.09 116.42 115.83 3hx7 h ASP 95 Ca 0.08 -0.54 0.01 0.00 0.43 0.00 0.00 57.03 57.01 3hx7 h ASP 95 Cb 0.16 -0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 38.87 3hx7 h ASP 95 CO -0.00 0.62 -0.30 0.00 -1.57 0.00 0.00 179.24 178.00 3hx7 h ALA 96 N 0.48 -0.54 -0.40 3.45 0.00 -1.20 -1.25 119.26 119.80 3hx7 h ALA 96 Ca 0.00 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.97 3hx7 h ALA 96 Cb 0.60 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3hx7 h ALA 96 CO 0.01 -0.85 0.30 1.98 0.00 0.00 0.00 179.25 180.69 3hx7 h MET 97 N -0.54 0.00 0.00 0.00 -1.53 -1.20 0.32 114.93 111.98 3hx7 h MET 97 Ca 0.02 0.00 -0.18 0.00 -3.44 0.00 0.00 59.70 56.10 3hx7 h MET 97 Cb 0.55 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.57 3hx7 h MET 97 CO -0.14 0.00 -0.85 0.87 0.14 0.00 0.00 176.91 176.92 3hx7 h LYS 98 N 0.00 0.00 -0.09 0.39 1.57 -0.53 -2.11 116.57 115.80 3hx7 h LYS 98 Ca 0.19 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3hx7 h LYS 98 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 3hx7 h LYS 98 CO -0.00 0.86 -0.26 0.00 -0.57 0.00 0.00 179.45 179.47 3hx7 h ALA 99 N 1.14 0.16 -0.48 3.86 0.00 0.54 -1.82 119.26 122.66 3hx7 h ALA 99 Ca -0.01 -0.40 0.08 0.00 0.00 0.00 0.00 54.91 54.57 3hx7 h ALA 99 Cb 1.51 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 3hx7 h ALA 99 CO 0.11 0.16 0.13 0.00 0.00 0.00 0.00 179.25 179.65 3hx7 h ALA 100 N 0.48 0.56 0.00 0.00 0.00 -0.68 0.15 119.26 119.79 3hx7 h ALA 100 Ca -0.01 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3hx7 h ALA 100 Cb 0.87 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3hx7 h ALA 100 CO 0.06 -0.27 -0.35 1.98 0.00 0.00 0.00 179.25 180.66 3hx7 h MET 101 N 0.28 0.00 -0.06 0.00 -1.53 -1.37 -0.65 114.93 111.60 3hx7 h MET 101 Ca 0.24 0.00 -0.16 0.00 -3.44 0.00 0.00 59.70 56.34 3hx7 h MET 101 Cb 0.29 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.33 3hx7 h MET 101 CO -0.28 0.35 -0.66 0.00 0.14 0.00 0.00 176.91 176.45 3hx7 h ALA 102 N 1.65 0.76 0.21 0.39 0.00 -0.13 -1.61 119.26 120.53 3hx7 h ALA 102 Ca -0.00 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 3hx7 h ALA 102 Cb 0.81 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3hx7 h ALA 102 CO 0.05 0.76 -0.10 1.25 0.00 0.00 0.00 179.25 181.21 3hx7 h LEU 103 N 0.18 -0.24 -0.81 0.00 5.85 -0.21 -2.36 115.31 117.72 3hx7 h LEU 103 Ca -0.01 -0.24 0.08 0.00 0.84 0.00 0.00 57.88 58.55 3hx7 h LEU 103 Cb 1.20 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.22 3hx7 h LEU 103 CO 0.10 0.14 0.47 -0.33 -0.34 0.00 0.00 178.44 178.48 3hx7 h GLU 104 N -0.65 0.80 0.00 1.25 4.39 -1.11 0.16 114.58 119.42 3hx7 h GLU 104 Ca -0.03 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 3hx7 h GLU 104 Cb 0.46 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.93 3hx7 h GLU 104 CO 0.05 0.53 -0.16 0.87 -1.16 0.00 0.00 179.01 179.13 3hx7 h LYS 105 N 0.82 0.00 -0.04 2.33 1.57 -1.25 0.18 116.57 120.19 3hx7 h LYS 105 Ca 0.38 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.13 3hx7 h LYS 105 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3hx7 h LYS 105 CO -0.22 0.16 -0.09 -0.22 -0.57 0.00 0.00 179.45 178.51 3hx7 h LYS 106 N 0.00 0.13 0.12 3.15 3.64 -0.18 -2.64 116.57 120.79 3hx7 h LYS 106 Ca -0.00 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 3hx7 h LYS 106 Cb 0.39 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3hx7 h LYS 106 CO 0.02 0.70 -0.06 -0.07 -2.27 0.00 0.00 179.45 177.77 3hx7 h LEU 107 N -0.42 -0.13 -1.08 5.20 3.38 -0.83 -2.10 115.31 119.32 3hx7 h LEU 107 Ca -0.00 -0.03 0.23 0.00 0.09 0.00 0.00 57.88 58.17 3hx7 h LEU 107 Cb 0.70 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.37 3hx7 h LEU 107 CO 0.02 -0.05 0.61 -1.13 0.09 0.00 0.00 178.44 177.98 3hx7 h ASN 108 N -0.20 0.66 -0.08 -0.43 -1.24 -0.71 0.35 115.58 113.93 3hx7 h ASN 108 Ca -0.02 0.11 -0.16 0.00 0.71 0.00 0.00 56.30 56.95 3hx7 h ASN 108 Cb 0.16 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.21 3hx7 h ASN 108 CO 0.03 0.15 -0.50 -0.61 -1.29 0.00 0.00 177.43 175.21 3hx7 h GLN 109 N 0.59 0.64 -0.67 6.67 5.75 -1.15 -1.67 115.11 125.27 3hx7 h GLN 109 Ca 0.62 -0.38 -0.04 0.00 -0.15 0.00 0.00 58.65 58.70 3hx7 h GLN 109 Cb 1.19 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.75 3hx7 h GLN 109 CO -0.41 0.99 0.27 0.00 -2.65 0.00 0.00 178.83 177.03 3hx7 h ALA 110 N 0.94 0.88 0.56 3.38 0.00 0.27 -1.02 119.26 124.27 3hx7 h ALA 110 Ca 0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3hx7 h ALA 110 Cb 1.05 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.58 3hx7 h ALA 110 CO 0.10 0.49 -0.27 -0.07 0.00 0.00 0.00 179.25 179.50 3hx7 h LEU 111 N 0.96 -0.64 -1.76 0.00 3.38 -0.84 -0.80 115.31 115.62 3hx7 h LEU 111 Ca 0.22 -0.02 0.17 0.00 0.09 0.00 0.00 57.88 58.34 3hx7 h LEU 111 Cb 0.21 0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3hx7 h LEU 111 CO -0.02 -0.37 0.49 -0.07 0.09 0.00 0.00 178.44 178.56 3hx7 h LEU 112 N -0.88 0.22 -0.19 1.67 3.38 -1.15 0.16 115.31 118.52 3hx7 h LEU 112 Ca -0.08 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.69 3hx7 h LEU 112 Cb 0.62 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.35 3hx7 h LEU 112 CO 0.13 0.11 -0.78 0.44 0.09 0.00 0.00 178.44 178.43 3hx7 h ASP 113 N 0.23 0.89 -0.48 -0.43 3.45 -0.89 -1.35 116.42 117.85 3hx7 h ASP 113 Ca 0.35 -0.59 -0.13 0.00 0.43 0.00 0.00 57.03 57.09 3hx7 h ASP 113 Cb 1.03 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.53 3hx7 h ASP 113 CO -0.07 1.38 -0.22 0.25 -1.57 0.00 0.00 179.24 179.00 3hx7 h LEU 114 N 0.51 1.02 -0.53 1.55 5.85 0.42 -2.01 115.31 122.11 3hx7 h LEU 114 Ca -0.05 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.22 3hx7 h LEU 114 Cb 1.40 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 3hx7 h LEU 114 CO 0.16 1.19 0.15 -0.74 -0.34 0.00 0.00 178.44 178.85 3hx7 h HIS 115 N 0.84 0.88 0.00 1.25 2.76 -0.71 0.55 115.15 120.72 3hx7 h HIS 115 Ca 0.11 -0.10 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 3hx7 h HIS 115 Cb 0.80 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.51 3hx7 h HIS 115 CO 0.05 0.76 -0.17 0.00 -1.30 0.00 0.00 177.93 177.28 3hx7 h ALA 116 N 1.02 1.29 0.03 5.26 0.00 -1.13 -1.46 119.26 124.26 3hx7 h ALA 116 Ca 0.17 -0.15 -0.22 0.00 0.00 0.00 0.00 54.91 54.71 3hx7 h ALA 116 Cb 0.31 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.10 3hx7 h ALA 116 CO -0.00 0.21 -0.87 1.25 0.00 0.00 0.00 179.25 179.83 3hx7 h LEU 117 N 0.00 0.72 -2.14 0.00 5.85 -0.61 -2.98 115.31 116.15 3hx7 h LEU 117 Ca -0.00 -0.77 -0.01 0.00 0.84 0.00 0.00 57.88 57.93 3hx7 h LEU 117 Cb 0.42 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 3hx7 h LEU 117 CO 0.02 1.41 -0.07 1.23 -0.34 0.00 0.00 178.44 180.69 3hx7 h GLY 118 N 0.12 0.00 1.66 3.75 0.00 -0.14 -0.98 103.07 107.49 3hx7 h GLY 118 Ca -0.12 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 3hx7 h GLY 118 CO 0.17 0.00 -0.62 1.76 0.00 0.00 0.00 176.54 177.85 3hx7 h SER 119 N 0.00 0.00 0.99 0.19 0.02 -1.28 0.11 113.55 113.59 3hx7 h SER 119 Ca -0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 3hx7 h SER 119 Cb 0.16 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 3hx7 h SER 119 CO 0.01 0.32 -0.99 0.00 -1.14 0.00 0.00 176.83 175.02 3hx7 h ALA 120 N 1.68 0.36 -0.57 3.77 0.00 -1.06 -3.03 119.26 120.41 3hx7 h ALA 120 Ca -0.03 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 53.97 3hx7 h ALA 120 Cb 1.27 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3hx7 h ALA 120 CO 0.04 1.24 0.00 0.54 0.00 0.00 0.00 179.25 181.07 3hx7 n ARG 121 N -3.36 3.06 -3.84 0.00 5.12 -0.59 -4.97 116.66 112.08 3hx7 n ARG 121 Ca -0.00 -2.36 -0.29 0.00 -1.93 0.00 0.00 57.85 53.27 3hx7 n ARG 121 Cb 0.93 -1.71 0.00 0.00 -1.16 0.00 0.00 32.46 30.53 3hx7 n ARG 121 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3hx7 n THR 122 N 1.03 -2.91 -3.74 0.55 -2.24 -1.02 -4.93 114.28 101.02 3hx7 n THR 122 Ca 0.21 -0.15 -0.28 0.00 -2.27 0.00 0.00 64.05 61.57 3hx7 n THR 122 Cb 0.70 -2.57 -0.11 0.00 -2.10 0.00 0.00 70.33 66.25 3hx7 n THR 122 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hx7 n ASP 123 N -2.37 2.05 0.31 3.42 -0.08 0.36 -4.98 116.55 115.26 3hx7 n ASP 123 Ca -0.26 -2.98 0.18 0.00 -1.51 0.00 0.00 54.79 50.22 3hx7 n ASP 123 Cb 0.63 -0.70 1.01 0.00 2.34 0.00 0.00 41.12 44.40 3hx7 n ASP 123 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3hx7 h PRO 124 N 5.39 0.00 -0.30 -0.67 0.13 -1.92 -2.44 132.00 132.19 3hx7 h PRO 124 Ca 0.18 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.22 3hx7 h PRO 124 Cb 0.79 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 3hx7 h PRO 124 CO 0.62 0.02 -0.18 1.25 -0.23 0.00 0.00 178.00 179.48 3hx7 h HIS 125 N 0.00 0.76 0.38 1.56 2.76 -1.95 -1.46 115.15 117.20 3hx7 h HIS 125 Ca -0.00 -0.20 -0.02 0.00 -2.20 0.00 0.00 60.37 57.95 3hx7 h HIS 125 Cb 0.09 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 28.89 3hx7 h HIS 125 CO 0.00 0.90 -0.18 1.25 -1.30 0.00 0.00 177.93 178.59 3hx7 h LEU 126 N 0.40 -0.44 -1.63 0.26 5.85 -1.84 -1.13 115.31 116.79 3hx7 h LEU 126 Ca 0.06 -0.07 0.24 0.00 0.84 0.00 0.00 57.88 58.95 3hx7 h LEU 126 Cb 0.72 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.79 3hx7 h LEU 126 CO 0.05 -0.19 0.64 0.00 -0.34 0.00 0.00 178.44 178.60 3hx7 h ASP 128 N 0.28 0.89 -0.31 0.00 3.58 -0.88 -2.51 116.42 117.47 3hx7 h ASP 128 Ca 0.50 -0.76 0.06 0.00 0.42 0.00 0.00 57.03 57.24 3hx7 h ASP 128 Cb 1.46 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 42.18 3hx7 h ASP 128 CO -0.15 1.55 -0.03 0.15 -2.88 0.00 0.00 179.24 177.88 3hx7 h PHE 129 N 0.34 -0.07 0.35 0.28 3.04 0.18 0.10 116.94 121.17 3hx7 h PHE 129 Ca -0.15 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.81 3hx7 h PHE 129 Cb 1.75 0.08 0.00 0.00 2.56 0.00 0.00 35.95 40.34 3hx7 h PHE 129 CO 0.11 -0.08 -0.17 -0.07 -2.02 0.00 0.00 178.31 176.08 3hx7 h LEU 130 N 0.05 -0.40 -0.65 0.59 3.38 -1.41 -1.54 115.31 115.33 3hx7 h LEU 130 Ca 0.15 -0.08 0.12 0.00 0.09 0.00 0.00 57.88 58.16 3hx7 h LEU 130 Cb 0.21 0.10 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 3hx7 h LEU 130 CO -0.27 -0.16 0.18 -0.33 0.09 0.00 0.00 178.44 177.96 3hx7 h GLU 131 N -0.64 0.31 -0.14 1.13 5.08 -1.17 0.25 114.58 119.39 3hx7 h GLU 131 Ca -0.05 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.16 3hx7 h GLU 131 Cb 0.46 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3hx7 h GLU 131 CO 0.08 0.20 -0.43 1.15 -1.00 0.00 0.00 179.01 179.02 3hx7 h THR 132 N 0.32 1.36 -0.01 1.13 2.02 -0.76 -3.37 112.91 113.59 3hx7 h THR 132 Ca 0.35 -1.72 0.00 0.00 0.77 0.00 0.00 66.41 65.81 3hx7 h THR 132 Cb 0.52 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.00 3hx7 h THR 132 CO -0.41 0.52 -0.27 1.41 0.37 0.00 0.00 175.52 177.15 3hx7 n HIS 133 N -4.27 0.00 0.06 3.16 8.25 -0.58 -4.91 115.22 116.93 3hx7 n HIS 133 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 3hx7 n HIS 133 Cb 0.55 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 3hx7 n HIS 133 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3hx7 n PHE 134 N -0.32 -0.62 -0.25 4.41 3.72 0.79 -4.76 117.46 120.44 3hx7 n PHE 134 Ca 0.05 0.11 -0.00 0.00 -0.05 0.00 0.00 57.45 57.55 3hx7 n PHE 134 Cb 0.24 0.17 0.07 0.00 -0.94 0.00 0.00 39.48 39.02 3hx7 n PHE 134 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3hx7 h LEU 135 N 0.00 -0.80 -0.51 4.37 3.38 -1.50 -0.82 115.31 119.44 3hx7 h LEU 135 Ca 0.00 0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 3hx7 h LEU 135 Cb 0.00 0.49 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3hx7 h LEU 135 CO 0.00 -0.26 -0.23 -0.78 0.09 0.00 0.00 178.44 177.26 3hx7 h ASP 136 N -0.03 0.00 0.85 -0.43 1.82 -1.85 -2.57 116.42 114.22 3hx7 h ASP 136 Ca 0.33 0.00 -0.07 0.00 -0.39 0.00 0.00 57.03 56.90 3hx7 h ASP 136 Cb 0.54 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.54 3hx7 h ASP 136 CO -0.75 0.23 -0.34 -0.33 -1.61 0.00 0.00 179.24 176.44 3hx7 h GLU 137 N 0.00 0.00 0.00 0.28 4.39 -1.48 -2.38 114.58 115.40 3hx7 h GLU 137 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 3hx7 h GLU 137 Cb 0.99 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.64 3hx7 h GLU 137 CO 0.03 0.34 -0.06 0.93 -1.16 0.00 0.00 179.01 179.10 3hx7 h GLU 138 N 0.00 0.00 -0.87 2.33 4.39 -1.14 -2.83 114.58 116.47 3hx7 h GLU 138 Ca -0.00 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.87 3hx7 h GLU 138 Cb 0.86 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.41 3hx7 h GLU 138 CO 0.04 0.62 0.42 0.28 -1.16 0.00 0.00 179.01 179.22 3hx7 h VAL 139 N -1.00 0.64 -0.26 3.13 2.07 -1.49 0.58 116.25 119.93 3hx7 h VAL 139 Ca -0.01 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3hx7 h VAL 139 Cb 0.64 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 3hx7 h VAL 139 CO -0.01 0.10 0.04 0.11 0.02 0.00 0.00 177.57 177.83 3hx7 h LYS 140 N 0.55 0.42 -0.55 1.57 1.57 -1.54 -1.88 116.57 116.71 3hx7 h LYS 140 Ca 0.50 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 59.13 3hx7 h LYS 140 Cb 0.80 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 3hx7 h LYS 140 CO -0.42 0.55 0.23 1.25 -0.57 0.00 0.00 179.45 180.48 3hx7 h LEU 141 N 0.23 0.75 -0.94 2.94 5.85 -0.99 -1.41 115.31 121.74 3hx7 h LEU 141 Ca 0.08 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 3hx7 h LEU 141 Cb 0.33 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 3hx7 h LEU 141 CO 0.00 0.71 0.54 0.40 -0.34 0.00 0.00 178.44 179.76 3hx7 h ILE 142 N 0.74 1.26 -0.60 4.05 2.04 -0.84 0.76 117.51 124.92 3hx7 h ILE 142 Ca 0.18 -0.60 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 3hx7 h ILE 142 Cb 0.19 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.20 3hx7 h ILE 142 CO -0.02 0.28 0.24 0.50 0.00 0.00 0.00 178.15 179.16 3hx7 h LYS 143 N 1.29 0.90 -0.50 2.37 1.63 -0.99 -0.14 116.57 121.13 3hx7 h LYS 143 Ca 0.33 -0.16 -0.06 0.00 -0.85 0.00 0.00 60.65 59.92 3hx7 h LYS 143 Cb -0.03 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.44 3hx7 h LYS 143 CO -0.06 0.76 0.08 -0.22 -3.45 0.00 0.00 179.45 176.56 3hx7 h LYS 144 N 0.83 0.78 -0.21 1.90 3.64 -0.49 -1.36 116.57 121.66 3hx7 h LYS 144 Ca 0.20 -0.17 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 3hx7 h LYS 144 Cb 0.20 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3hx7 h LYS 144 CO -0.02 0.73 -0.51 0.52 -2.27 0.00 0.00 179.45 177.91 3hx7 h MET 145 N 0.74 0.72 0.00 1.90 2.86 -0.36 -2.12 114.93 118.67 3hx7 h MET 145 Ca 0.16 -0.49 -0.01 0.00 -2.06 0.00 0.00 59.70 57.30 3hx7 h MET 145 Cb 0.34 0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 3hx7 h MET 145 CO 0.01 1.11 -0.04 0.78 1.06 0.00 0.00 176.91 179.83 3hx7 h GLY 146 N 0.44 0.00 0.63 8.32 0.00 -0.82 -1.62 103.07 110.02 3hx7 h GLY 146 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 3hx7 h GLY 146 CO 0.11 0.00 -0.37 -0.55 0.00 0.00 0.00 176.54 175.73 3hx7 h ASP 147 N 0.00 0.37 -0.82 0.19 5.19 -0.98 -2.81 116.42 117.56 3hx7 h ASP 147 Ca -0.00 -0.72 0.01 0.00 -0.62 0.00 0.00 57.03 55.70 3hx7 h ASP 147 Cb 0.45 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 39.81 3hx7 h ASP 147 CO 0.01 1.04 0.54 0.45 -3.12 0.00 0.00 179.24 178.15 3hx7 h HIS 148 N -0.26 1.02 -0.53 4.55 3.86 -1.00 -2.08 115.15 120.71 3hx7 h HIS 148 Ca -0.04 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 3hx7 h HIS 148 Cb 1.07 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 29.16 3hx7 h HIS 148 CO 0.15 0.63 0.32 -0.07 0.86 0.00 0.00 177.93 179.82 3hx7 h LEU 149 N 1.09 0.51 -1.20 2.43 3.38 -1.33 0.59 115.31 120.78 3hx7 h LEU 149 Ca 0.30 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.20 3hx7 h LEU 149 Cb -0.11 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3hx7 h LEU 149 CO -0.07 0.36 -0.39 0.74 0.09 0.00 0.00 178.44 179.17 3hx7 h THR 150 N 0.63 1.23 0.00 0.22 2.02 -1.22 -1.42 112.91 114.37 3hx7 h THR 150 Ca 0.21 -1.36 -0.07 0.00 0.77 0.00 0.00 66.41 65.96 3hx7 h THR 150 Cb 0.02 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 3hx7 h THR 150 CO -0.10 0.38 -0.55 0.78 0.37 0.00 0.00 175.52 176.40 3hx7 h ASN 151 N 0.00 0.00 0.21 4.18 2.35 -0.70 -3.02 115.58 118.60 3hx7 h ASN 151 Ca -0.00 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.44 3hx7 h ASN 151 Cb 0.71 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.11 3hx7 h ASN 151 CO 0.05 0.28 -1.37 -0.07 -1.65 0.00 0.00 177.43 174.66 3hx7 h LEU 152 N 0.00 0.69 -1.98 1.61 3.38 -0.62 -2.87 115.31 115.52 3hx7 h LEU 152 Ca -0.03 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 57.00 3hx7 h LEU 152 Cb 1.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.76 3hx7 h LEU 152 CO 0.03 1.65 -0.08 -0.74 0.09 0.00 0.00 178.44 179.39 3hx7 h HIS 153 N -0.01 0.00 0.00 1.13 2.76 -1.36 -1.54 115.15 116.14 3hx7 h HIS 153 Ca -0.25 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 57.70 3hx7 h HIS 153 Cb 2.01 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.94 3hx7 h HIS 153 CO 0.14 0.08 -1.09 -0.09 -1.30 0.00 0.00 177.93 175.67 3hx7 h ARG 154 N 0.00 0.00 -1.41 5.26 2.43 -1.55 -3.31 114.38 115.80 3hx7 h ARG 154 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3hx7 h ARG 154 Cb 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3hx7 h ARG 154 CO 0.01 0.87 0.00 1.28 -1.51 0.00 0.00 179.97 180.62 3hx7 n LEU 155 N -3.28 2.95 -3.17 3.80 4.32 -0.58 -3.66 117.00 117.38 3hx7 n LEU 155 Ca -0.03 -1.42 -0.20 0.00 -0.02 0.00 0.00 56.01 54.34 3hx7 n LEU 155 Cb 0.94 -0.55 -0.04 0.00 -1.62 0.00 0.00 43.42 42.15 3hx7 n LEU 155 CO 0.46 0.52 -0.24 0.61 -1.22 0.00 0.00 177.39 177.52 3hx7 n GLY 156 N 0.87 3.11 0.00 -0.72 0.00 -1.25 -5.00 105.19 102.20 3hx7 n GLY 156 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.47 3hx7 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hx7 n GLY 157 N 0.83 -0.09 0.28 -0.02 0.00 -1.24 -4.98 105.19 99.98 3hx7 n GLY 157 Ca 0.22 -1.20 -0.06 0.00 0.00 0.00 0.00 46.02 44.98 3hx7 n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hx7 h PRO 158 N 0.00 0.95 -0.19 1.61 0.13 -1.99 -3.04 132.00 129.48 3hx7 h PRO 158 Ca 0.00 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 3hx7 h PRO 158 Cb 0.00 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 30.95 3hx7 h PRO 158 CO 0.00 0.74 0.00 0.39 -0.23 0.00 0.00 178.00 178.90 3hx7 n GLU 159 N -4.49 0.45 -0.36 0.86 1.02 -1.26 -4.18 120.64 112.68 3hx7 n GLU 159 Ca 0.05 0.00 0.29 0.00 -0.02 0.00 0.00 57.16 57.48 3hx7 n GLU 159 Cb 0.11 -1.09 0.59 0.00 -0.02 0.00 0.00 31.44 31.03 3hx7 n GLU 159 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hx7 h ALA 160 N 1.71 2.52 0.00 0.62 0.00 -1.65 -3.45 119.26 119.01 3hx7 h ALA 160 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3hx7 h ALA 160 Cb 0.09 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3hx7 h ALA 160 CO 0.00 -0.98 0.00 0.41 0.00 0.00 0.00 179.25 178.68