#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xz1 h GLN 3 N 0.00 0.00 0.00 -1.46 4.20 -2.00 -2.64 115.11 113.21 1xz1 h GLN 3 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1xz1 h GLN 3 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1xz1 h GLN 3 CO 0.00 0.00 -1.49 0.44 -0.67 0.00 0.00 178.83 177.11 1xz1 n ILE 4 N -3.75 0.00 -2.01 2.54 -5.35 -1.26 -5.00 119.36 104.53 1xz1 n ILE 4 Ca 0.06 -0.25 -0.42 0.00 -0.27 0.00 0.00 62.75 61.87 1xz1 n ILE 4 Cb 0.55 0.50 -0.03 0.00 -1.74 0.00 0.00 39.64 38.93 1xz1 n ILE 4 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1xz1 s ARG 5 N -3.24 4.25 -0.23 6.28 3.52 -1.00 -4.87 118.95 123.66 1xz1 s ARG 5 Ca 0.00 2.26 -0.08 0.00 -0.13 0.00 0.00 55.73 57.79 1xz1 s ARG 5 Cb 0.15 -3.23 0.10 0.00 -1.56 0.00 0.00 34.95 30.41 1xz1 s ARG 5 CO 0.88 -0.57 0.49 -1.14 -0.81 0.00 0.00 175.30 174.15 1xz1 s GLN 6 N 1.28 0.40 -1.47 5.12 0.74 -1.26 -4.91 119.66 119.56 1xz1 s GLN 6 Ca 0.69 1.15 -0.02 0.00 0.05 0.00 0.00 55.36 57.22 1xz1 s GLN 6 Cb -0.41 0.48 0.00 0.00 1.10 0.00 0.00 33.01 34.18 1xz1 s GLN 6 CO 0.31 -0.25 0.27 -1.71 -0.55 0.00 0.00 175.29 173.36 1xz1 n ASN 7 N 5.41 -5.47 -3.99 6.67 4.05 -1.26 -4.98 115.26 115.70 1xz1 n ASN 7 Ca -0.09 -0.14 -0.31 0.00 0.45 0.00 0.00 54.58 54.49 1xz1 n ASN 7 Cb 0.49 -4.42 -0.15 0.00 1.23 0.00 0.00 39.78 36.94 1xz1 n ASN 7 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1xz1 s TYR 8 N -3.01 3.52 0.31 1.20 5.04 -1.26 -4.82 117.35 118.32 1xz1 s TYR 8 Ca 0.14 -2.88 -0.29 0.00 -2.44 0.00 0.00 57.07 51.59 1xz1 s TYR 8 Cb -0.06 -2.79 -0.10 0.00 0.35 0.00 0.00 41.96 39.36 1xz1 s TYR 8 CO 0.17 -0.93 1.21 -1.54 -1.34 0.00 0.00 175.55 173.12 1xz1 s SER 9 N 0.91 7.00 0.30 4.32 1.04 -1.26 -4.90 113.70 121.12 1xz1 s SER 9 Ca 0.11 2.49 0.13 0.00 0.48 0.00 0.00 55.95 59.17 1xz1 s SER 9 Cb -0.19 -2.64 1.00 0.00 0.10 0.00 0.00 66.02 64.29 1xz1 s SER 9 CO -0.09 -0.35 1.33 0.35 0.98 0.00 0.00 173.24 175.45 1xz1 n THR 10 N 1.01 -0.35 -0.11 2.02 -2.24 -1.26 -1.88 114.28 111.47 1xz1 n THR 10 Ca -0.00 1.75 -0.10 0.00 -2.27 0.00 0.00 64.05 63.43 1xz1 n THR 10 Cb 0.43 -2.76 -0.02 0.00 -2.10 0.00 0.00 70.33 65.89 1xz1 n THR 10 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1xz1 h GLU 11 N 0.00 0.51 -0.31 -0.78 3.07 -1.99 -0.28 114.58 114.80 1xz1 h GLU 11 Ca 0.66 -0.09 -0.03 0.00 -0.50 0.00 0.00 59.36 59.40 1xz1 h GLU 11 Cb 1.66 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 29.48 1xz1 h GLU 11 CO -0.69 0.51 0.08 0.28 -1.40 0.00 0.00 179.01 177.79 1xz1 h VAL 12 N 0.40 1.21 -0.45 3.13 2.07 -1.90 -1.57 116.25 119.15 1xz1 h VAL 12 Ca 0.11 -0.71 0.08 0.00 0.82 0.00 0.00 66.70 67.00 1xz1 h VAL 12 Cb 0.19 1.10 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1xz1 h VAL 12 CO -0.01 0.24 0.06 -0.08 0.02 0.00 0.00 177.57 177.80 1xz1 h GLU 13 N 0.34 0.18 -0.64 1.57 4.81 -1.10 0.11 114.58 119.85 1xz1 h GLU 13 Ca 0.10 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 1xz1 h GLU 13 Cb 0.28 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1xz1 h GLU 13 CO 0.00 0.12 0.11 0.00 -0.73 0.00 0.00 179.01 178.50 1xz1 h ALA 14 N 1.36 0.99 -0.18 2.92 0.00 -0.94 -2.15 119.26 121.25 1xz1 h ALA 14 Ca 0.22 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1xz1 h ALA 14 Cb 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1xz1 h ALA 14 CO -0.32 0.64 -0.41 0.00 0.00 0.00 0.00 179.25 179.16 1xz1 h ALA 15 N 1.13 0.96 -0.42 0.00 0.00 -0.64 -1.73 119.26 118.56 1xz1 h ALA 15 Ca 0.20 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1xz1 h ALA 15 Cb 0.41 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1xz1 h ALA 15 CO 0.01 0.62 0.15 0.28 0.00 0.00 0.00 179.25 180.31 1xz1 h VAL 16 N 0.35 1.21 -0.84 0.00 2.07 -0.59 -0.56 116.25 117.88 1xz1 h VAL 16 Ca 0.03 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 1xz1 h VAL 16 Cb 0.87 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 1xz1 h VAL 16 CO 0.07 0.24 0.51 0.78 0.02 0.00 0.00 177.57 179.20 1xz1 h ASN 17 N 0.53 1.01 -0.32 0.57 2.35 -1.05 -0.33 115.58 118.34 1xz1 h ASN 17 Ca 0.14 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.72 1xz1 h ASN 17 Cb 0.23 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1xz1 h ASN 17 CO -0.01 0.77 -0.20 0.03 -1.65 0.00 0.00 177.43 176.37 1xz1 h ARG 18 N 1.16 0.79 -0.33 0.81 3.08 -1.07 -2.57 114.38 116.25 1xz1 h ARG 18 Ca 0.30 -0.31 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1xz1 h ARG 18 Cb -0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1xz1 h ARG 18 CO -0.06 0.92 -0.24 1.25 -1.07 0.00 0.00 179.97 180.78 1xz1 h LEU 19 N 0.69 0.66 -0.50 3.04 5.85 -0.43 -1.49 115.31 123.12 1xz1 h LEU 19 Ca 0.10 -0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.63 1xz1 h LEU 19 Cb 0.71 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1xz1 h LEU 19 CO 0.05 0.88 0.26 0.58 -0.34 0.00 0.00 178.44 179.87 1xz1 h VAL 20 N 0.57 0.96 -0.64 1.05 2.07 -0.91 -0.01 116.25 119.34 1xz1 h VAL 20 Ca 0.08 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 1xz1 h VAL 20 Cb 0.71 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1xz1 h VAL 20 CO 0.05 0.09 0.21 -1.13 0.02 0.00 0.00 177.57 176.81 1xz1 h ASN 21 N 0.50 0.91 -0.43 0.57 -0.73 -1.02 -0.53 115.58 114.85 1xz1 h ASN 21 Ca 0.22 -0.15 -0.05 0.00 1.87 0.00 0.00 56.30 58.19 1xz1 h ASN 21 Cb 0.13 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.46 1xz1 h ASN 21 CO -0.15 0.84 0.08 -0.07 -0.37 0.00 0.00 177.43 177.76 1xz1 h LEU 22 N 0.95 0.67 -0.50 0.34 4.07 -0.76 -0.32 115.31 119.76 1xz1 h LEU 22 Ca 0.21 -0.25 -0.11 0.00 0.08 0.00 0.00 57.88 57.81 1xz1 h LEU 22 Cb 0.26 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 1xz1 h LEU 22 CO -0.01 0.75 -0.11 1.88 -1.08 0.00 0.00 178.44 179.87 1xz1 h TYR 23 N 0.56 1.07 -0.65 1.13 0.05 -0.69 -1.02 116.97 117.43 1xz1 h TYR 23 Ca 0.13 -0.23 -0.05 0.00 0.05 0.00 0.00 58.73 58.64 1xz1 h TYR 23 Cb 0.35 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 1xz1 h TYR 23 CO 0.02 1.02 0.22 -0.07 -1.05 0.00 0.00 178.16 178.30 1xz1 h LEU 24 N 0.81 0.92 -0.82 3.88 3.38 -0.96 -0.10 115.31 122.43 1xz1 h LEU 24 Ca 0.13 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1xz1 h LEU 24 Cb 0.66 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 1xz1 h LEU 24 CO 0.05 0.87 0.52 0.03 0.09 0.00 0.00 178.44 179.99 1xz1 h ARG 25 N 0.92 1.10 -0.52 1.13 3.08 -0.93 -1.36 114.38 117.80 1xz1 h ARG 25 Ca 0.21 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 1xz1 h ARG 25 Cb 0.26 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1xz1 h ARG 25 CO -0.01 0.75 0.13 0.00 -1.07 0.00 0.00 179.97 179.77 1xz1 h ALA 26 N 1.28 0.69 -0.60 0.04 0.00 -0.88 -0.53 119.26 119.25 1xz1 h ALA 26 Ca 0.30 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1xz1 h ALA 26 Cb -0.08 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 1xz1 h ALA 26 CO -0.06 0.38 0.31 1.03 0.00 0.00 0.00 179.25 180.91 1xz1 h SER 27 N 0.73 0.43 -0.58 0.00 0.87 -0.66 -1.38 113.55 112.96 1xz1 h SER 27 Ca 0.16 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.73 1xz1 h SER 27 Cb 0.33 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 1xz1 h SER 27 CO 0.00 0.28 0.26 0.22 -0.53 0.00 0.00 176.83 177.06 1xz1 h TYR 28 N 0.57 0.87 -0.66 2.24 3.20 -0.97 -0.71 116.97 121.51 1xz1 h TYR 28 Ca 0.28 -0.05 0.02 0.00 3.14 0.00 0.00 58.73 62.12 1xz1 h TYR 28 Cb 0.21 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 1xz1 h TYR 28 CO -0.10 0.68 0.42 1.15 -1.64 0.00 0.00 178.16 178.67 1xz1 h THR 29 N 0.80 1.10 0.00 1.81 2.02 -0.66 -2.01 112.91 115.96 1xz1 h THR 29 Ca 0.20 -0.28 -0.12 0.00 0.77 0.00 0.00 66.41 66.97 1xz1 h THR 29 Cb 0.16 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 1xz1 h THR 29 CO -0.02 0.15 -0.59 1.88 0.37 0.00 0.00 175.52 177.31 1xz1 h TYR 30 N 0.83 0.00 -0.30 3.16 0.05 -0.92 -0.37 116.97 119.42 1xz1 h TYR 30 Ca 0.26 0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.05 1xz1 h TYR 30 Cb -0.00 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 1xz1 h TYR 30 CO -0.04 0.59 0.18 1.25 -1.05 0.00 0.00 178.16 179.08 1xz1 h LEU 31 N 0.00 0.29 -0.36 3.88 5.85 -0.83 -0.24 115.31 123.89 1xz1 h LEU 31 Ca -0.01 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1xz1 h LEU 31 Cb 1.06 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 1xz1 h LEU 31 CO 0.08 0.21 0.12 -1.28 -0.34 0.00 0.00 178.44 177.23 1xz1 h SER 32 N 0.36 0.52 -0.33 1.25 0.87 -0.91 -1.84 113.55 113.47 1xz1 h SER 32 Ca 0.12 -0.19 0.04 0.00 -1.23 0.00 0.00 61.79 60.53 1xz1 h SER 32 Cb -0.01 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 61.78 1xz1 h SER 32 CO -0.05 0.57 0.09 -0.07 -0.53 0.00 0.00 176.83 176.84 1xz1 h LEU 33 N 0.44 0.06 -0.10 2.23 3.38 -0.99 -1.34 115.31 118.99 1xz1 h LEU 33 Ca 0.12 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1xz1 h LEU 33 Cb 0.23 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1xz1 h LEU 33 CO -0.01 0.07 0.01 1.23 0.09 0.00 0.00 178.44 179.84 1xz1 h GLY 34 N 0.22 0.10 2.00 0.83 0.00 -0.86 -2.79 103.07 102.58 1xz1 h GLY 34 Ca 0.15 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.40 1xz1 h GLY 34 CO -0.18 -0.00 -0.39 0.74 0.00 0.00 0.00 176.54 176.71 1xz1 h PHE 35 N 0.05 0.00 -0.64 5.60 0.04 -1.24 -2.56 116.94 118.19 1xz1 h PHE 35 Ca 0.04 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.83 1xz1 h PHE 35 Cb 0.04 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 1xz1 h PHE 35 CO -0.12 0.39 0.41 -0.92 -0.60 0.00 0.00 178.31 177.48 1xz1 h TYR 36 N 0.00 0.78 0.00 -0.55 3.20 -1.03 -2.46 116.97 116.91 1xz1 h TYR 36 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1xz1 h TYR 36 Cb 0.93 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.94 1xz1 h TYR 36 CO 0.00 0.47 0.00 1.19 -1.64 0.00 0.00 178.16 178.18 1xz1 n PHE 37 N -4.67 0.09 1.15 -3.82 3.72 -0.99 -1.93 117.46 111.01 1xz1 n PHE 37 Ca 0.06 0.03 0.13 0.00 -0.05 0.00 0.00 57.45 57.62 1xz1 n PHE 37 Cb 0.05 -0.55 0.46 0.00 -0.94 0.00 0.00 39.48 38.50 1xz1 n PHE 37 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1xz1 n ASP 38 N -1.58 0.42 -4.75 4.37 2.03 -0.94 -1.65 116.55 114.44 1xz1 n ASP 38 Ca 0.05 -0.22 -0.39 0.00 0.52 0.00 0.00 54.79 54.75 1xz1 n ASP 38 Cb 0.26 -0.04 0.04 0.00 -0.72 0.00 0.00 41.12 40.65 1xz1 n ASP 38 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1xz1 s ARG 39 N -2.79 3.28 0.51 -0.67 0.52 -0.81 -4.71 118.95 114.27 1xz1 s ARG 39 Ca 0.18 2.31 0.23 0.00 -0.52 0.00 0.00 55.73 57.92 1xz1 s ARG 39 Cb 0.19 -2.37 1.35 0.00 0.52 0.00 0.00 34.95 34.64 1xz1 s ARG 39 CO 0.57 -1.10 2.08 0.38 0.02 0.00 0.00 175.30 177.26 1xz1 h ASP 40 N 1.70 0.00 -0.52 0.23 2.03 -1.91 0.22 116.42 118.16 1xz1 h ASP 40 Ca -0.51 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.79 1xz1 h ASP 40 Cb 1.29 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.79 1xz1 h ASP 40 CO 0.58 0.11 0.00 -0.90 -1.03 0.00 0.00 179.24 178.00 1xz1 n ASP 41 N -3.98 2.87 0.05 4.15 5.75 -1.26 -4.44 116.55 119.69 1xz1 n ASP 41 Ca -0.02 -2.03 0.00 0.00 -0.01 0.00 0.00 54.79 52.73 1xz1 n ASP 41 Cb 0.20 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 39.93 1xz1 n ASP 41 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1xz1 n VAL 42 N 1.01 0.74 -3.40 2.12 0.31 -0.63 -5.09 118.33 113.40 1xz1 n VAL 42 Ca 0.18 0.25 -0.20 0.00 -0.01 0.00 0.00 64.34 64.55 1xz1 n VAL 42 Cb 0.46 -1.22 0.06 0.00 -0.91 0.00 0.00 33.84 32.23 1xz1 n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xz1 n ALA 43 N -3.26 -2.45 -3.82 3.52 0.00 0.68 -4.98 120.51 110.20 1xz1 n ALA 43 Ca 0.00 0.01 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 1xz1 n ALA 43 Cb 0.00 -4.95 -0.13 0.00 0.00 0.00 0.00 19.45 14.37 1xz1 n ALA 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xz1 s LEU 44 N -5.81 3.58 0.21 0.00 1.43 -0.66 -5.00 118.68 112.44 1xz1 s LEU 44 Ca 0.41 -2.96 -0.10 0.00 -1.03 0.00 0.00 54.13 50.45 1xz1 s LEU 44 Cb -0.08 -1.34 0.19 0.00 0.03 0.00 0.00 46.19 44.99 1xz1 s LEU 44 CO 0.78 -0.22 1.87 -0.08 0.23 0.00 0.00 176.35 178.93 1xz1 h GLU 45 N 6.42 0.97 -0.67 1.70 4.81 -1.94 -1.58 114.58 124.29 1xz1 h GLU 45 Ca -0.01 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1xz1 h GLU 45 Cb 0.89 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 1xz1 h GLU 45 CO 0.59 0.64 0.40 0.78 -0.73 0.00 0.00 179.01 180.69 1xz1 h GLY 46 N 1.00 0.97 0.82 1.92 0.00 -1.89 0.26 103.07 106.14 1xz1 h GLY 46 Ca 0.29 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 1xz1 h GLY 46 CO -0.08 0.39 -0.25 -2.08 0.00 0.00 0.00 176.54 174.52 1xz1 h VAL 47 N 0.92 1.35 -0.33 4.60 2.07 -1.70 -1.72 116.25 121.44 1xz1 h VAL 47 Ca 0.24 -1.46 0.07 0.00 0.82 0.00 0.00 66.70 66.36 1xz1 h VAL 47 Cb -0.03 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.56 1xz1 h VAL 47 CO -0.04 0.44 -0.09 0.00 0.02 0.00 0.00 177.57 177.89 1xz1 h HIS 49 N -0.02 1.04 -0.41 0.00 6.17 -0.91 -0.59 115.15 120.44 1xz1 h HIS 49 Ca 0.16 -0.13 0.07 0.00 0.71 0.00 0.00 60.37 61.18 1xz1 h HIS 49 Cb 0.26 -0.29 -0.06 0.00 2.52 0.00 0.00 27.41 29.84 1xz1 h HIS 49 CO -0.31 0.89 0.04 0.35 0.71 0.00 0.00 177.93 179.60 1xz1 h PHE 50 N 0.93 0.05 0.05 5.26 3.57 -1.03 -1.16 116.94 124.60 1xz1 h PHE 50 Ca 0.19 0.03 -0.23 0.00 3.53 0.00 0.00 57.97 61.48 1xz1 h PHE 50 Cb 0.41 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1xz1 h PHE 50 CO 0.03 -0.04 -1.05 0.74 -2.23 0.00 0.00 178.31 175.75 1xz1 h PHE 51 N 0.15 0.27 -0.53 0.41 0.04 -1.18 -2.65 116.94 113.45 1xz1 h PHE 51 Ca 0.20 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.70 1xz1 h PHE 51 Cb 0.27 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 1xz1 h PHE 51 CO -0.24 1.10 -0.04 0.00 -0.60 0.00 0.00 178.31 178.53 1xz1 h ARG 52 N 0.06 0.93 -0.74 1.51 3.08 -0.93 -0.59 114.38 117.70 1xz1 h ARG 52 Ca -0.07 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 59.66 1xz1 h ARG 52 Cb 1.77 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 31.70 1xz1 h ARG 52 CO 0.16 0.95 0.34 0.93 -1.07 0.00 0.00 179.97 181.28 1xz1 h GLU 53 N 0.85 1.08 -0.60 0.04 4.39 -1.22 -2.42 114.58 116.70 1xz1 h GLU 53 Ca 0.15 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1xz1 h GLU 53 Cb 0.55 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 1xz1 h GLU 53 CO 0.03 0.85 0.26 -0.07 -1.16 0.00 0.00 179.01 178.93 1xz1 h LEU 54 N 1.05 0.78 -0.61 1.33 3.38 -1.08 -1.64 115.31 118.52 1xz1 h LEU 54 Ca 0.25 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1xz1 h LEU 54 Cb 0.14 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1xz1 h LEU 54 CO -0.03 0.68 0.36 0.00 0.09 0.00 0.00 178.44 179.54 1xz1 h ALA 55 N 1.44 0.80 -0.44 1.53 0.00 -0.66 -0.84 119.26 121.08 1xz1 h ALA 55 Ca 0.21 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1xz1 h ALA 55 Cb 0.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xz1 h ALA 55 CO -0.02 0.08 0.10 1.49 0.00 0.00 0.00 179.25 180.90 1xz1 h GLU 56 N 0.70 0.71 -0.72 0.00 4.81 -1.10 -2.09 114.58 116.90 1xz1 h GLU 56 Ca 0.25 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1xz1 h GLU 56 Cb 0.07 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1xz1 h GLU 56 CO -0.12 0.72 0.42 0.93 -0.73 0.00 0.00 179.01 180.22 1xz1 h GLU 57 N 0.58 0.98 -0.41 1.92 5.08 -0.82 -0.39 114.58 121.53 1xz1 h GLU 57 Ca 0.14 -0.10 -0.15 0.00 -1.00 0.00 0.00 59.36 58.25 1xz1 h GLU 57 Cb 0.33 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1xz1 h GLU 57 CO 0.00 0.71 -0.32 0.87 -1.00 0.00 0.00 179.01 179.27 1xz1 h LYS 58 N 0.98 0.93 -0.43 2.33 1.79 -1.04 -0.99 116.57 120.14 1xz1 h LYS 58 Ca 0.25 -0.45 0.00 0.00 -2.18 0.00 0.00 60.65 58.27 1xz1 h LYS 58 Cb -0.01 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 1xz1 h LYS 58 CO -0.05 1.11 0.28 -0.09 -1.08 0.00 0.00 179.45 179.63 1xz1 h ARG 59 N 0.78 0.57 -0.69 3.15 2.43 -1.10 -1.34 114.38 118.18 1xz1 h ARG 59 Ca 0.08 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1xz1 h ARG 59 Cb 0.91 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 1xz1 h ARG 59 CO 0.08 0.39 0.46 0.93 -1.51 0.00 0.00 179.97 180.32 1xz1 h GLU 60 N 0.58 0.91 -0.41 0.20 5.08 -0.87 -1.52 114.58 118.55 1xz1 h GLU 60 Ca 0.16 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1xz1 h GLU 60 Cb -0.05 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 1xz1 h GLU 60 CO -0.03 0.61 0.25 0.78 -1.00 0.00 0.00 179.01 179.61 1xz1 h GLY 61 N 0.94 0.59 0.80 -3.84 0.00 -0.64 -1.50 103.07 99.43 1xz1 h GLY 61 Ca 0.25 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.38 1xz1 h GLY 61 CO -0.05 0.24 0.40 0.00 0.00 0.00 0.00 176.54 177.12 1xz1 h ALA 62 N 1.11 0.87 -0.63 3.60 0.00 -0.69 -1.64 119.26 121.88 1xz1 h ALA 62 Ca 0.15 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1xz1 h ALA 62 Cb 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1xz1 h ALA 62 CO -0.03 0.12 0.19 0.93 0.00 0.00 0.00 179.25 180.47 1xz1 h GLU 63 N 0.76 0.96 -0.57 0.00 5.08 -1.09 -0.73 114.58 118.99 1xz1 h GLU 63 Ca 0.28 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 1xz1 h GLU 63 Cb 0.08 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1xz1 h GLU 63 CO -0.13 0.82 0.11 0.00 -1.00 0.00 0.00 179.01 178.81 1xz1 h ARG 64 N 0.92 0.93 -0.85 2.33 3.08 -0.87 -0.37 114.38 119.55 1xz1 h ARG 64 Ca 0.21 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1xz1 h ARG 64 Cb 0.27 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 1xz1 h ARG 64 CO -0.01 0.88 0.45 -0.07 -1.07 0.00 0.00 179.97 180.15 1xz1 h LEU 65 N 0.83 1.08 -0.55 3.04 3.38 -0.99 -1.41 115.31 120.69 1xz1 h LEU 65 Ca 0.18 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1xz1 h LEU 65 Cb 0.39 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1xz1 h LEU 65 CO 0.01 0.89 0.05 -0.07 0.09 0.00 0.00 178.44 179.40 1xz1 h LEU 66 N 1.20 0.91 -0.58 1.67 3.38 -0.77 -0.03 115.31 121.09 1xz1 h LEU 66 Ca 0.30 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1xz1 h LEU 66 Cb 0.06 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1xz1 h LEU 66 CO -0.04 0.96 0.35 0.50 0.09 0.00 0.00 178.44 180.30 1xz1 h LYS 67 N 0.82 0.80 -0.50 1.13 3.64 -0.87 -2.29 116.57 119.29 1xz1 h LYS 67 Ca 0.16 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1xz1 h LYS 67 Cb 0.47 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1xz1 h LYS 67 CO 0.02 0.57 0.11 1.98 -2.27 0.00 0.00 179.45 179.87 1xz1 h MET 68 N 0.79 0.80 -0.36 1.90 4.05 -1.05 -0.92 114.93 120.14 1xz1 h MET 68 Ca 0.21 -0.20 0.08 0.00 -0.28 0.00 0.00 59.70 59.51 1xz1 h MET 68 Cb -0.01 -0.10 -0.08 0.00 -0.80 0.00 0.00 31.60 30.60 1xz1 h MET 68 CO -0.04 0.78 -0.18 0.37 0.23 0.00 0.00 176.91 178.07 1xz1 h GLN 69 N 0.69 -0.12 -0.59 0.39 5.75 -0.76 -1.37 115.11 119.09 1xz1 h GLN 69 Ca 0.15 0.01 -0.07 0.00 -0.15 0.00 0.00 58.65 58.59 1xz1 h GLN 69 Cb 0.34 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 1xz1 h GLN 69 CO 0.00 -0.08 0.08 -0.91 -2.65 0.00 0.00 178.83 175.27 1xz1 h ASN 70 N -0.12 0.93 -0.18 -0.69 -0.26 -1.22 0.60 115.58 114.64 1xz1 h ASN 70 Ca 0.18 -0.22 -0.01 0.00 -0.56 0.00 0.00 56.30 55.69 1xz1 h ASN 70 Cb 0.40 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.40 1xz1 h ASN 70 CO -0.44 0.94 0.08 1.56 -1.06 0.00 0.00 177.43 178.52 1xz1 h GLN 71 N 0.91 0.32 0.00 0.81 4.20 -0.31 -1.97 115.11 119.07 1xz1 h GLN 71 Ca 0.18 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1xz1 h GLN 71 Cb 0.43 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1xz1 h GLN 71 CO 0.01 0.28 -0.52 0.54 -0.67 0.00 0.00 178.83 178.47 1xz1 n ARG 72 N -4.43 0.02 -0.50 1.46 5.12 -0.60 -4.95 116.66 112.78 1xz1 n ARG 72 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.93 1xz1 n ARG 72 Cb 0.13 -1.51 0.00 0.00 -1.16 0.00 0.00 32.46 29.92 1xz1 n ARG 72 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1xz1 n GLY 73 N 1.49 0.74 3.87 -0.13 0.00 -0.74 -4.17 105.19 106.24 1xz1 n GLY 73 Ca 0.05 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1xz1 n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xz1 s GLY 74 N -2.11 1.60 -0.16 -0.02 0.00 0.14 -4.62 107.32 102.15 1xz1 s GLY 74 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 44.72 44.06 1xz1 s GLY 74 CO 0.00 -0.13 -0.15 0.50 0.00 0.00 0.00 173.10 173.32 1xz1 s ARG 75 N -5.52 2.42 0.24 2.90 1.81 -1.26 -4.22 118.95 115.32 1xz1 s ARG 75 Ca 0.64 -0.67 -0.31 0.00 -1.72 0.00 0.00 55.73 53.66 1xz1 s ARG 75 Cb -0.11 -2.27 -0.12 0.00 -0.45 0.00 0.00 34.95 32.00 1xz1 s ARG 75 CO 0.51 -0.26 1.68 0.00 -0.68 0.00 0.00 175.30 176.54 1xz1 s ALA 76 N 1.42 3.87 -0.10 2.13 0.00 -1.26 -4.98 121.76 122.85 1xz1 s ALA 76 Ca 0.04 1.58 -0.01 0.00 0.00 0.00 0.00 51.96 53.57 1xz1 s ALA 76 Cb -0.13 -3.68 0.03 0.00 0.00 0.00 0.00 23.12 19.34 1xz1 s ALA 76 CO -0.11 -0.94 -0.02 -0.51 0.00 0.00 0.00 175.76 174.18 1xz1 s LEU 77 N 0.61 0.84 0.04 0.00 1.43 -1.26 -5.14 118.68 115.20 1xz1 s LEU 77 Ca 0.71 -0.22 -0.07 0.00 -1.03 0.00 0.00 54.13 53.52 1xz1 s LEU 77 Cb -0.49 -0.58 -0.05 0.00 0.03 0.00 0.00 46.19 45.10 1xz1 s LEU 77 CO 0.37 -0.18 0.31 -0.36 0.23 0.00 0.00 176.35 176.72 1xz1 s PHE 78 N 1.88 3.57 0.36 0.29 0.08 -1.26 -4.88 117.98 118.02 1xz1 s PHE 78 Ca 0.04 0.61 0.07 0.00 0.12 0.00 0.00 56.93 57.78 1xz1 s PHE 78 Cb -0.13 -2.03 -0.07 0.00 -0.57 0.00 0.00 43.02 40.23 1xz1 s PHE 78 CO -0.06 0.57 -0.02 -0.65 -0.10 0.00 0.00 175.22 174.96 1xz1 s GLN 79 N -1.89 1.83 0.37 0.44 -1.52 -1.26 -5.11 119.66 112.51 1xz1 s GLN 79 Ca 0.30 -2.00 -0.26 0.00 -1.95 0.00 0.00 55.36 51.46 1xz1 s GLN 79 Cb -0.13 -1.49 -0.12 0.00 -0.22 0.00 0.00 33.01 31.05 1xz1 s GLN 79 CO 0.18 -0.01 1.07 -0.25 -0.25 0.00 0.00 175.29 176.04 1xz1 n ASP 80 N -0.83 1.62 -4.46 5.90 8.00 -1.26 -4.96 116.55 120.56 1xz1 n ASP 80 Ca -0.05 1.11 -0.40 0.00 0.71 0.00 0.00 54.79 56.16 1xz1 n ASP 80 Cb 0.66 -1.37 -0.11 0.00 -0.02 0.00 0.00 41.12 40.28 1xz1 n ASP 80 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xz1 s LEU 81 N -0.40 4.47 0.45 0.64 1.43 -1.26 -5.07 118.68 118.93 1xz1 s LEU 81 Ca 0.60 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.83 1xz1 s LEU 81 Cb -0.60 -2.07 -0.08 0.00 0.03 0.00 0.00 46.19 43.48 1xz1 s LEU 81 CO 0.59 -0.27 1.23 0.00 0.23 0.00 0.00 176.35 178.12 1xz1 s GLN 82 N 1.64 3.78 0.75 1.70 -2.07 -1.26 -5.00 119.66 119.21 1xz1 s GLN 82 Ca 0.05 1.95 -0.12 0.00 -1.82 0.00 0.00 55.36 55.42 1xz1 s GLN 82 Cb -0.18 -2.53 0.05 0.00 -1.09 0.00 0.00 33.01 29.26 1xz1 s GLN 82 CO 0.08 -0.58 1.10 -1.59 -1.32 0.00 0.00 175.29 172.98 1xz1 s LYS 83 N -2.53 2.29 0.90 9.60 -2.85 -1.26 -4.90 119.74 120.99 1xz1 s LYS 83 Ca 0.62 1.27 -0.10 0.00 -1.00 0.00 0.00 55.97 56.75 1xz1 s LYS 83 Cb -0.33 -1.90 0.14 0.00 -2.06 0.00 0.00 37.83 33.68 1xz1 s LYS 83 CO 0.41 -1.63 1.15 -2.14 0.10 0.00 0.00 175.35 173.24 1xz1 s PRO 84 N -4.66 1.14 0.55 1.78 0.02 -1.26 -4.90 135.00 127.66 1xz1 s PRO 84 Ca 0.63 1.54 0.34 0.00 0.02 0.00 0.00 61.00 63.53 1xz1 s PRO 84 Cb -0.19 -1.74 1.38 0.00 0.02 0.00 0.00 34.50 33.97 1xz1 s PRO 84 CO 0.52 -2.54 1.99 0.66 -0.33 0.00 0.00 177.00 177.30 1xz1 h SER 85 N -1.76 0.00 -4.70 2.53 4.64 -1.98 -3.43 113.55 108.85 1xz1 h SER 85 Ca -0.43 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.62 1xz1 h SER 85 Cb 1.27 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.16 1xz1 h SER 85 CO 0.42 0.01 -0.73 -1.10 -0.87 0.00 0.00 176.83 174.56 1xz1 s GLN 86 N -3.68 0.62 -0.08 4.77 -0.21 -1.26 -5.04 119.66 114.78 1xz1 s GLN 86 Ca 0.01 -0.91 0.12 0.00 0.02 0.00 0.00 55.36 54.60 1xz1 s GLN 86 Cb 0.09 -0.31 -0.23 0.00 1.00 0.00 0.00 33.01 33.56 1xz1 s GLN 86 CO 0.54 0.04 0.54 -0.25 -2.12 0.00 0.00 175.29 174.04 1xz1 n ASP 87 N 1.08 0.84 -4.16 5.90 8.00 -1.26 -4.94 116.55 122.00 1xz1 n ASP 87 Ca -0.20 0.33 -0.24 0.00 0.71 0.00 0.00 54.79 55.38 1xz1 n ASP 87 Cb 0.56 0.04 -0.15 0.00 -0.02 0.00 0.00 41.12 41.55 1xz1 n ASP 87 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1xz1 s GLU 88 N -2.58 1.37 0.00 -1.24 2.02 -1.26 -4.97 118.70 112.04 1xz1 s GLU 88 Ca -0.07 -0.64 0.10 0.00 0.02 0.00 0.00 54.97 54.38 1xz1 s GLU 88 Cb 0.08 -1.33 0.16 0.00 0.10 0.00 0.00 34.13 33.14 1xz1 s GLU 88 CO 0.82 0.36 1.00 0.91 0.02 0.00 0.00 175.26 178.37 1xz1 n TRP 89 N 2.58 0.18 -3.21 1.61 7.02 -1.26 -5.09 117.44 119.27 1xz1 n TRP 89 Ca -0.15 -0.22 0.00 0.00 -1.02 0.00 0.00 57.50 56.11 1xz1 n TRP 89 Cb 0.54 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 29.42 1xz1 n TRP 89 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1xz1 n GLY 90 N 0.50 1.10 3.95 6.99 0.00 -1.26 -3.62 105.19 112.85 1xz1 n GLY 90 Ca 0.08 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.12 1xz1 n GLY 90 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xz1 s THR 91 N 0.00 2.16 0.23 2.61 -4.23 -1.26 -4.87 115.64 110.28 1xz1 s THR 91 Ca 0.00 -0.28 -0.07 0.00 -1.18 0.00 0.00 61.69 60.16 1xz1 s THR 91 Cb 0.00 -2.88 0.21 0.00 1.34 0.00 0.00 72.50 71.17 1xz1 s THR 91 CO 0.00 0.00 1.88 0.74 -0.54 0.00 0.00 174.62 176.70 1xz1 h THR 92 N -0.87 1.13 0.02 3.99 2.02 -1.98 -0.56 112.91 116.67 1xz1 h THR 92 Ca -0.42 -0.37 0.01 0.00 0.77 0.00 0.00 66.41 66.40 1xz1 h THR 92 Cb 1.28 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1xz1 h THR 92 CO 0.49 0.20 -0.06 0.25 0.37 0.00 0.00 175.52 176.77 1xz1 h LEU 93 N 1.07 -0.16 -0.60 2.58 5.85 -1.94 0.12 115.31 122.23 1xz1 h LEU 93 Ca 0.34 0.02 0.08 0.00 0.84 0.00 0.00 57.88 59.17 1xz1 h LEU 93 Cb 0.01 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 1xz1 h LEU 93 CO -0.12 -0.09 0.24 0.44 -0.34 0.00 0.00 178.44 178.58 1xz1 h ASP 94 N -0.11 0.27 -0.35 1.25 3.32 -1.71 -1.24 116.42 117.86 1xz1 h ASP 94 Ca 0.02 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 1xz1 h ASP 94 Cb 0.13 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1xz1 h ASP 94 CO -0.05 0.17 -0.03 0.00 -1.72 0.00 0.00 179.24 177.61 1xz1 h ALA 95 N 1.39 0.47 -0.28 3.45 0.00 -0.80 -1.76 119.26 121.74 1xz1 h ALA 95 Ca 0.30 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1xz1 h ALA 95 Cb 0.33 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1xz1 h ALA 95 CO -0.28 0.27 -0.15 1.98 0.00 0.00 0.00 179.25 181.07 1xz1 h MET 96 N 0.44 0.49 -0.49 0.00 1.85 -0.74 -0.29 114.93 116.18 1xz1 h MET 96 Ca 0.09 -0.15 -0.06 0.00 -0.61 0.00 0.00 59.70 58.98 1xz1 h MET 96 Cb 0.51 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.47 1xz1 h MET 96 CO 0.02 0.63 0.08 0.87 -0.40 0.00 0.00 176.91 178.12 1xz1 h LYS 97 N 0.45 0.81 -0.60 0.39 1.57 -1.04 -1.38 116.57 116.77 1xz1 h LYS 97 Ca 0.08 -0.22 -0.07 0.00 -1.87 0.00 0.00 60.65 58.57 1xz1 h LYS 97 Cb 0.53 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1xz1 h LYS 97 CO 0.03 0.81 0.08 0.00 -0.57 0.00 0.00 179.45 179.81 1xz1 h ALA 98 N 0.97 1.01 -0.49 3.86 0.00 -0.90 -2.12 119.26 121.59 1xz1 h ALA 98 Ca 0.15 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1xz1 h ALA 98 Cb 0.39 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1xz1 h ALA 98 CO 0.01 0.63 0.07 0.00 0.00 0.00 0.00 179.25 179.95 1xz1 h ALA 99 N 1.16 0.66 -0.26 0.00 0.00 -0.85 -1.81 119.26 118.15 1xz1 h ALA 99 Ca 0.18 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1xz1 h ALA 99 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1xz1 h ALA 99 CO 0.01 0.40 -0.32 0.97 0.00 0.00 0.00 179.25 180.31 1xz1 h ILE 100 N 0.70 1.28 -0.68 0.00 2.10 -1.05 -0.18 117.51 119.68 1xz1 h ILE 100 Ca 0.15 -1.42 0.03 0.00 1.08 0.00 0.00 64.86 64.69 1xz1 h ILE 100 Cb 0.41 1.43 -0.04 0.00 -1.09 0.00 0.00 36.82 37.53 1xz1 h ILE 100 CO 0.01 0.45 0.43 0.58 -1.08 0.00 0.00 178.15 178.54 1xz1 h VAL 101 N 0.47 1.10 -0.22 2.19 2.07 -1.24 -1.21 116.25 119.42 1xz1 h VAL 101 Ca 0.06 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1xz1 h VAL 101 Cb 0.79 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1xz1 h VAL 101 CO 0.06 0.15 0.03 0.25 0.02 0.00 0.00 177.57 178.09 1xz1 h LEU 102 N 0.85 0.35 -0.98 2.57 5.85 -0.92 -1.65 115.31 121.38 1xz1 h LEU 102 Ca 0.27 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1xz1 h LEU 102 Cb -0.00 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1xz1 h LEU 102 CO -0.10 0.53 0.09 -0.33 -0.34 0.00 0.00 178.44 178.30 1xz1 h GLU 103 N 0.16 0.83 -0.53 1.25 4.39 -0.86 -1.82 114.58 118.02 1xz1 h GLU 103 Ca 0.07 -0.19 -0.07 0.00 0.34 0.00 0.00 59.36 59.51 1xz1 h GLU 103 Cb 0.33 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1xz1 h GLU 103 CO 0.01 0.78 0.04 0.87 -1.16 0.00 0.00 179.01 179.54 1xz1 h LYS 104 N 0.80 0.86 -0.68 2.33 1.57 -1.11 0.11 116.57 120.45 1xz1 h LYS 104 Ca 0.17 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1xz1 h LYS 104 Cb 0.35 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1xz1 h LYS 104 CO 0.01 0.84 0.22 0.66 -0.57 0.00 0.00 179.45 180.60 1xz1 h SER 105 N 0.81 0.97 -0.32 0.86 4.64 -0.94 -0.42 113.55 119.14 1xz1 h SER 105 Ca 0.16 -0.17 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 1xz1 h SER 105 Cb 0.43 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1xz1 h SER 105 CO 0.02 0.90 -0.34 -0.07 -0.87 0.00 0.00 176.83 176.46 1xz1 h LEU 106 N 1.00 0.86 -0.71 5.97 3.38 -0.93 -1.99 115.31 122.89 1xz1 h LEU 106 Ca 0.22 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1xz1 h LEU 106 Cb 0.28 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1xz1 h LEU 106 CO -0.01 1.16 0.40 -1.13 0.09 0.00 0.00 178.44 178.95 1xz1 h ASN 107 N 0.58 0.88 -0.76 -0.43 -0.00 -0.63 -0.82 115.58 114.40 1xz1 h ASN 107 Ca 0.05 -0.09 -0.05 0.00 -0.00 0.00 0.00 56.30 56.21 1xz1 h ASN 107 Cb 0.93 -0.22 -0.03 0.00 -0.00 0.00 0.00 38.32 38.99 1xz1 h ASN 107 CO 0.08 0.72 0.28 -0.61 -0.00 0.00 0.00 177.43 177.90 1xz1 h GLN 108 N 0.98 1.16 -0.77 6.67 5.75 -0.94 0.16 115.11 128.11 1xz1 h GLN 108 Ca 0.25 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 1xz1 h GLN 108 Cb 0.03 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.36 1xz1 h GLN 108 CO -0.04 0.95 0.40 0.00 -2.65 0.00 0.00 178.83 177.49 1xz1 h ALA 109 N 1.18 1.00 -0.62 3.38 0.00 -0.87 0.85 119.26 124.18 1xz1 h ALA 109 Ca 0.25 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1xz1 h ALA 109 Cb 0.25 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1xz1 h ALA 109 CO -0.02 0.53 0.31 -0.07 0.00 0.00 0.00 179.25 180.01 1xz1 h LEU 110 N 1.08 0.80 -0.65 0.00 3.38 -0.62 -1.21 115.31 118.09 1xz1 h LEU 110 Ca 0.27 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1xz1 h LEU 110 Cb 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1xz1 h LEU 110 CO -0.04 0.69 0.04 -0.07 0.09 0.00 0.00 178.44 179.15 1xz1 h LEU 111 N 0.84 1.06 -0.79 1.67 3.38 -0.60 -0.42 115.31 120.45 1xz1 h LEU 111 Ca 0.21 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1xz1 h LEU 111 Cb 0.10 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1xz1 h LEU 111 CO -0.03 1.08 0.28 0.44 0.09 0.00 0.00 178.44 180.30 1xz1 h ASP 112 N 1.00 1.10 -0.42 -0.43 3.32 -0.64 -1.37 116.42 118.99 1xz1 h ASP 112 Ca 0.18 -0.19 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1xz1 h ASP 112 Cb 0.52 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1xz1 h ASP 112 CO 0.02 0.99 -0.15 0.25 -1.72 0.00 0.00 179.24 178.64 1xz1 h LEU 113 N 1.14 0.90 -0.73 1.55 5.85 -0.92 -0.87 115.31 122.23 1xz1 h LEU 113 Ca 0.25 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1xz1 h LEU 113 Cb 0.26 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1xz1 h LEU 113 CO -0.02 1.04 0.34 -0.74 -0.34 0.00 0.00 178.44 178.73 1xz1 h HIS 114 N 0.79 1.06 -0.56 1.25 2.76 -0.84 0.60 115.15 120.20 1xz1 h HIS 114 Ca 0.12 -0.06 -0.10 0.00 -2.20 0.00 0.00 60.37 58.13 1xz1 h HIS 114 Cb 0.68 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 29.29 1xz1 h HIS 114 CO 0.04 0.79 -0.04 0.00 -1.30 0.00 0.00 177.93 177.42 1xz1 h ALA 115 N 1.17 0.86 -0.25 5.26 0.00 -0.90 0.45 119.26 125.85 1xz1 h ALA 115 Ca 0.25 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1xz1 h ALA 115 Cb 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xz1 h ALA 115 CO -0.03 0.66 0.10 1.25 0.00 0.00 0.00 179.25 181.22 1xz1 h LEU 116 N 0.92 0.35 -0.50 0.00 5.85 -0.79 -0.15 115.31 120.98 1xz1 h LEU 116 Ca 0.16 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.75 1xz1 h LEU 116 Cb 0.59 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1xz1 h LEU 116 CO 0.04 0.43 0.25 1.23 -0.34 0.00 0.00 178.44 180.05 1xz1 h GLY 117 N 0.25 0.70 1.00 3.75 0.00 -0.59 -0.16 103.07 108.02 1xz1 h GLY 117 Ca 0.08 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1xz1 h GLY 117 CO -0.01 0.10 0.32 1.76 0.00 0.00 0.00 176.54 178.72 1xz1 h SER 118 N 0.49 0.57 -0.29 0.19 0.02 -0.63 -0.96 113.55 112.93 1xz1 h SER 118 Ca 0.22 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 1xz1 h SER 118 Cb 0.14 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1xz1 h SER 118 CO -0.16 0.41 0.13 0.00 -1.14 0.00 0.00 176.83 176.07 1xz1 h ALA 119 N 1.18 1.60 -0.20 3.77 0.00 -0.58 -2.23 119.26 122.79 1xz1 h ALA 119 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xz1 h ALA 119 Cb -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1xz1 h ALA 119 CO -0.04 0.32 0.00 1.04 0.00 0.00 0.00 179.25 180.57 1xz1 n GLN 120 N -4.40 1.75 -3.69 0.00 3.00 -0.11 -4.96 117.38 108.97 1xz1 n GLN 120 Ca 0.02 -1.13 -0.30 0.00 -0.01 0.00 0.00 57.00 55.58 1xz1 n GLN 120 Cb 0.14 -1.38 0.03 0.00 0.00 0.00 0.00 30.24 29.04 1xz1 n GLN 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xz1 n ALA 121 N 0.36 -2.59 -3.72 -1.58 0.00 -0.59 -4.95 120.51 107.45 1xz1 n ALA 121 Ca 0.16 -0.26 -0.28 0.00 0.00 0.00 0.00 53.44 53.06 1xz1 n ALA 121 Cb 0.33 -3.44 -0.11 0.00 0.00 0.00 0.00 19.45 16.23 1xz1 n ALA 121 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xz1 n ASP 122 N -2.54 2.88 0.24 0.00 -0.08 -0.47 -4.96 116.55 111.62 1xz1 n ASP 122 Ca -0.11 -3.20 0.09 0.00 -1.51 0.00 0.00 54.79 50.07 1xz1 n ASP 122 Cb 0.59 -0.72 0.61 0.00 2.34 0.00 0.00 41.12 43.94 1xz1 n ASP 122 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1xz1 h PRO 123 N 5.06 0.00 -0.43 -0.67 0.13 -1.93 -2.46 132.00 131.70 1xz1 h PRO 123 Ca 0.17 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.24 1xz1 h PRO 123 Cb 0.74 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 1xz1 h PRO 123 CO 0.72 0.18 0.05 1.25 -0.23 0.00 0.00 178.00 179.96 1xz1 h HIS 124 N 0.00 0.78 -0.16 1.56 -0.00 -1.96 -1.33 115.15 114.03 1xz1 h HIS 124 Ca -0.00 -0.12 0.01 0.00 -0.00 0.00 0.00 60.37 60.26 1xz1 h HIS 124 Cb 0.39 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 1xz1 h HIS 124 CO 0.00 0.75 0.09 1.25 -0.00 0.00 0.00 177.93 180.02 1xz1 h LEU 125 N 0.58 0.13 -0.74 0.26 5.85 -1.87 -0.54 115.31 118.99 1xz1 h LEU 125 Ca 0.13 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1xz1 h LEU 125 Cb 0.41 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 1xz1 h LEU 125 CO 0.01 0.10 0.45 0.00 -0.34 0.00 0.00 178.44 178.66 1xz1 h ASP 127 N 0.86 0.97 -0.57 0.00 1.82 -1.07 -1.61 116.42 116.82 1xz1 h ASP 127 Ca 0.31 -0.38 0.02 0.00 -0.39 0.00 0.00 57.03 56.59 1xz1 h ASP 127 Cb 0.09 -0.27 -0.04 0.00 0.68 0.00 0.00 39.33 39.80 1xz1 h ASP 127 CO -0.14 1.16 0.36 0.15 -1.61 0.00 0.00 179.24 179.16 1xz1 h PHE 128 N 0.81 0.67 -0.47 0.28 3.57 -0.54 -0.66 116.94 120.58 1xz1 h PHE 128 Ca 0.10 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.49 1xz1 h PHE 128 Cb 0.82 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1xz1 h PHE 128 CO 0.05 0.39 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.23 1xz1 h LEU 129 N 0.71 1.00 -0.86 0.59 4.07 -1.06 -2.62 115.31 117.14 1xz1 h LEU 129 Ca 0.23 -0.38 -0.12 0.00 0.08 0.00 0.00 57.88 57.69 1xz1 h LEU 129 Cb 0.00 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.45 1xz1 h LEU 129 CO -0.09 1.17 -0.55 -0.33 -1.08 0.00 0.00 178.44 177.55 1xz1 h GLU 130 N 0.84 0.00 0.03 1.13 5.08 -0.96 -1.43 114.58 119.28 1xz1 h GLU 130 Ca 0.11 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.19 1xz1 h GLU 130 Cb 0.79 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 1xz1 h GLU 130 CO 0.07 0.55 -1.49 0.77 -1.00 0.00 0.00 179.01 177.91 1xz1 h SER 131 N 0.00 0.11 -0.00 1.42 0.02 -1.08 -3.39 113.55 110.63 1xz1 h SER 131 Ca -0.01 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1xz1 h SER 131 Cb 1.00 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.51 1xz1 h SER 131 CO 0.07 1.15 -0.01 1.41 -1.14 0.00 0.00 176.83 178.31 1xz1 n HIS 132 N -3.25 0.00 0.00 3.45 8.25 -0.99 -4.93 115.22 117.75 1xz1 n HIS 132 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1xz1 n HIS 132 Cb 1.02 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.13 1xz1 n HIS 132 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1xz1 n PHE 133 N -0.48 0.00 0.02 4.41 3.72 -0.84 -4.78 117.46 119.51 1xz1 n PHE 133 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.29 1xz1 n PHE 133 Cb 0.01 0.40 -0.07 0.00 -0.94 0.00 0.00 39.48 38.88 1xz1 n PHE 133 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1xz1 h LEU 134 N 0.00 0.05 -0.61 4.37 4.07 -1.50 -0.60 115.31 121.09 1xz1 h LEU 134 Ca 0.00 -0.05 -0.15 0.00 0.08 0.00 0.00 57.88 57.76 1xz1 h LEU 134 Cb 0.20 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 1xz1 h LEU 134 CO 0.00 0.09 -0.65 -0.78 -1.08 0.00 0.00 178.44 176.02 1xz1 h ASP 135 N 0.01 0.21 -0.64 -0.43 3.58 -1.84 -2.14 116.42 115.17 1xz1 h ASP 135 Ca 0.02 -0.13 -0.08 0.00 0.42 0.00 0.00 57.03 57.25 1xz1 h ASP 135 Cb 0.05 -0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 1xz1 h ASP 135 CO -0.00 0.80 0.08 -0.08 -2.88 0.00 0.00 179.24 177.16 1xz1 h GLU 136 N 0.13 1.09 -0.18 0.28 4.81 -1.81 -1.27 114.58 117.63 1xz1 h GLU 136 Ca -0.01 -0.30 -0.03 0.00 -0.13 0.00 0.00 59.36 58.89 1xz1 h GLU 136 Cb 1.17 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1xz1 h GLU 136 CO 0.10 1.01 0.00 0.93 -0.73 0.00 0.00 179.01 180.32 1xz1 h GLU 137 N 1.01 0.32 -0.49 1.92 4.39 -0.98 -1.55 114.58 119.19 1xz1 h GLU 137 Ca 0.20 -0.10 0.04 0.00 0.34 0.00 0.00 59.36 59.84 1xz1 h GLU 137 Cb 0.46 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.04 1xz1 h GLU 137 CO 0.02 0.53 0.25 0.28 -1.16 0.00 0.00 179.01 178.92 1xz1 h VAL 138 N 0.08 0.97 -0.75 3.13 2.07 -1.25 -0.68 116.25 119.81 1xz1 h VAL 138 Ca 0.05 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 1xz1 h VAL 138 Cb 0.38 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1xz1 h VAL 138 CO 0.01 0.09 0.33 0.11 0.02 0.00 0.00 177.57 178.13 1xz1 h LYS 139 N 0.50 1.10 -0.36 1.57 1.57 -1.15 -1.53 116.57 118.26 1xz1 h LYS 139 Ca 0.21 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1xz1 h LYS 139 Cb 0.12 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1xz1 h LYS 139 CO -0.15 0.88 -0.16 1.25 -0.57 0.00 0.00 179.45 180.70 1xz1 h LEU 140 N 1.06 0.77 -0.75 2.94 5.85 -0.95 -1.79 115.31 122.44 1xz1 h LEU 140 Ca 0.25 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.51 1xz1 h LEU 140 Cb 0.17 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1xz1 h LEU 140 CO -0.03 1.00 0.23 0.40 -0.34 0.00 0.00 178.44 179.71 1xz1 h ILE 141 N 0.54 1.26 -0.52 4.05 2.04 -1.03 -0.61 117.51 123.25 1xz1 h ILE 141 Ca 0.08 -0.92 0.02 0.00 1.00 0.00 0.00 64.86 65.05 1xz1 h ILE 141 Cb 0.70 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1xz1 h ILE 141 CO 0.05 0.36 0.31 0.50 0.00 0.00 0.00 178.15 179.37 1xz1 h LYS 142 N 1.12 0.60 -0.55 2.37 1.63 -1.14 -0.46 116.57 120.14 1xz1 h LYS 142 Ca 0.24 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.96 1xz1 h LYS 142 Cb 0.31 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.79 1xz1 h LYS 142 CO -0.01 0.40 0.18 -0.22 -3.45 0.00 0.00 179.45 176.35 1xz1 h LYS 143 N 0.62 0.85 -0.48 1.90 3.64 -0.93 0.01 116.57 122.17 1xz1 h LYS 143 Ca 0.21 -0.18 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 1xz1 h LYS 143 Cb 0.02 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1xz1 h LYS 143 CO -0.09 0.77 -0.07 0.52 -2.27 0.00 0.00 179.45 178.31 1xz1 h MET 144 N 0.77 0.85 -0.68 1.90 2.86 -0.94 -0.57 114.93 119.13 1xz1 h MET 144 Ca 0.18 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1xz1 h MET 144 Cb 0.27 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1xz1 h MET 144 CO -0.01 0.90 0.40 0.78 1.06 0.00 0.00 176.91 180.04 1xz1 h GLY 145 N 0.98 0.99 0.98 8.32 0.00 -0.66 0.27 103.07 113.95 1xz1 h GLY 145 Ca 0.13 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 1xz1 h GLY 145 CO 0.03 0.41 0.29 -0.55 0.00 0.00 0.00 176.54 176.72 1xz1 h ASP 146 N 0.92 0.61 -0.34 0.19 3.32 -0.55 -1.53 116.42 119.05 1xz1 h ASP 146 Ca 0.24 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1xz1 h ASP 146 Cb -0.01 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1xz1 h ASP 146 CO -0.04 0.51 0.17 0.45 -1.72 0.00 0.00 179.24 178.61 1xz1 h HIS 147 N 0.67 0.48 -0.66 4.55 3.86 -0.78 -2.14 115.15 121.13 1xz1 h HIS 147 Ca 0.18 -0.02 0.06 0.00 -1.16 0.00 0.00 60.37 59.43 1xz1 h HIS 147 Cb 0.02 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.29 1xz1 h HIS 147 CO -0.02 0.41 0.36 -0.07 0.86 0.00 0.00 177.93 179.47 1xz1 h LEU 148 N 0.41 0.52 -0.63 2.43 3.38 -0.67 0.14 115.31 120.90 1xz1 h LEU 148 Ca 0.12 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1xz1 h LEU 148 Cb 0.11 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1xz1 h LEU 148 CO -0.02 0.33 0.35 0.74 0.09 0.00 0.00 178.44 179.94 1xz1 h THR 149 N 0.66 1.20 -0.30 0.22 2.02 -1.09 -0.70 112.91 114.92 1xz1 h THR 149 Ca 0.30 -0.50 -0.14 0.00 0.77 0.00 0.00 66.41 66.84 1xz1 h THR 149 Cb 0.21 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1xz1 h THR 149 CO -0.19 0.22 -0.36 0.78 0.37 0.00 0.00 175.52 176.34 1xz1 h ASN 150 N 0.86 0.83 -0.36 4.18 2.35 -0.71 -1.38 115.58 121.34 1xz1 h ASN 150 Ca 0.22 -0.49 0.04 0.00 -0.55 0.00 0.00 56.30 55.53 1xz1 h ASN 150 Cb 0.04 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.14 1xz1 h ASN 150 CO -0.04 1.15 0.13 0.40 -1.65 0.00 0.00 177.43 177.42 1xz1 h ILE 151 N 0.52 0.90 -0.67 2.81 2.04 -0.61 -2.22 117.51 120.27 1xz1 h ILE 151 Ca 0.04 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1xz1 h ILE 151 Cb 0.94 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1xz1 h ILE 151 CO 0.09 0.05 0.40 1.56 0.00 0.00 0.00 178.15 180.25 1xz1 h GLN 152 N 0.28 0.92 -0.44 2.37 4.20 -1.01 -1.83 115.11 119.60 1xz1 h GLN 152 Ca 0.17 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1xz1 h GLN 152 Cb 0.14 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 1xz1 h GLN 152 CO -0.17 0.66 0.27 -0.09 -0.67 0.00 0.00 178.83 178.82 1xz1 h ARG 153 N 0.92 0.59 0.00 1.46 2.43 -1.05 -2.77 114.38 115.94 1xz1 h ARG 153 Ca 0.24 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1xz1 h ARG 153 Cb -0.02 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1xz1 h ARG 153 CO -0.04 0.41 0.00 -0.07 -1.51 0.00 0.00 179.97 178.76 1xz1 h LEU 154 N 0.60 0.00 -9.07 3.80 3.38 -0.72 -3.52 115.31 109.78 1xz1 h LEU 154 Ca 0.16 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.57 1xz1 h LEU 154 Cb -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1xz1 h LEU 154 CO -0.03 0.00 1.16 0.68 0.09 0.00 0.00 178.44 180.33 1xz1 s VAL 155 N -3.16 3.60 0.00 1.22 -7.23 -0.93 -4.18 120.40 109.71 1xz1 s VAL 155 Ca 0.09 0.68 0.00 0.00 -1.81 0.00 0.00 61.98 60.94 1xz1 s VAL 155 Cb 0.09 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.44 1xz1 s VAL 155 CO 0.62 -0.23 0.00 0.00 -0.31 0.00 0.00 175.10 175.17 1xz1 n GLN 158 N 7.68 -0.00 -0.25 4.82 1.13 -1.26 -5.06 117.38 124.43 1xz1 n GLN 158 Ca 0.19 -0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.18 1xz1 n GLN 158 Cb 0.45 0.00 0.05 0.00 0.11 0.00 0.00 30.24 30.85 1xz1 n GLN 158 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xz1 h ALA 159 N 0.86 0.93 -0.16 -1.58 0.00 -2.00 -2.20 119.26 115.11 1xz1 h ALA 159 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1xz1 h ALA 159 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1xz1 h ALA 159 CO 0.00 0.66 0.08 0.78 0.00 0.00 0.00 179.25 180.76 1xz1 h GLY 160 N 1.07 0.25 0.97 0.00 0.00 -2.00 -1.62 103.07 101.75 1xz1 h GLY 160 Ca 0.22 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.43 1xz1 h GLY 160 CO 0.00 0.12 0.16 -2.00 0.00 0.00 0.00 176.54 174.83 1xz1 h LEU 161 N 0.13 0.27 -0.77 3.11 5.85 -1.92 -1.97 115.31 120.01 1xz1 h LEU 161 Ca 0.06 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1xz1 h LEU 161 Cb 0.13 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 1xz1 h LEU 161 CO -0.01 0.20 0.48 1.23 -0.34 0.00 0.00 178.44 180.00 1xz1 h GLY 162 N 0.33 1.12 1.06 3.75 0.00 -1.24 -1.08 103.07 107.00 1xz1 h GLY 162 Ca 0.10 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 46.98 1xz1 h GLY 162 CO -0.03 0.29 0.02 -2.09 0.00 0.00 0.00 176.54 174.73 1xz1 h GLU 163 N 0.93 1.01 -0.22 4.80 4.81 -1.00 -1.49 114.58 123.42 1xz1 h GLU 163 Ca 0.31 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1xz1 h GLU 163 Cb 0.05 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1xz1 h GLU 163 CO -0.12 0.99 0.12 -0.92 -0.73 0.00 0.00 179.01 178.35 1xz1 h TYR 164 N 0.90 0.31 -0.52 0.92 3.20 -1.11 -2.44 116.97 118.24 1xz1 h TYR 164 Ca 0.17 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.92 1xz1 h TYR 164 Cb 0.52 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 1xz1 h TYR 164 CO 0.04 0.29 -0.09 -0.07 -1.64 0.00 0.00 178.16 176.69 1xz1 h LEU 165 N 0.25 0.94 -0.40 2.82 3.38 -0.99 -1.38 115.31 119.92 1xz1 h LEU 165 Ca 0.08 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1xz1 h LEU 165 Cb 0.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1xz1 h LEU 165 CO -0.01 1.05 0.17 0.15 0.09 0.00 0.00 178.44 179.89 1xz1 h PHE 166 N 0.85 0.60 -0.82 1.13 3.57 -1.25 0.29 116.94 121.31 1xz1 h PHE 166 Ca 0.14 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1xz1 h PHE 166 Cb 0.63 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1xz1 h PHE 166 CO 0.04 0.52 0.44 1.49 -2.23 0.00 0.00 178.31 178.58 1xz1 h GLU 167 N 0.50 1.15 -0.15 1.11 4.22 -1.15 -0.64 114.58 119.62 1xz1 h GLU 167 Ca 0.13 -0.14 -0.22 0.00 0.08 0.00 0.00 59.36 59.22 1xz1 h GLU 167 Cb 0.17 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.21 1xz1 h GLU 167 CO -0.01 0.85 -0.77 0.00 -2.18 0.00 0.00 179.01 176.89 1xz1 h ARG 168 N 1.14 0.79 0.00 1.92 2.47 -1.05 -3.13 114.38 116.52 1xz1 h ARG 168 Ca 0.29 -0.65 0.00 0.00 -1.26 0.00 0.00 59.98 58.36 1xz1 h ARG 168 Cb 0.04 0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 1xz1 h ARG 168 CO -0.05 1.25 -1.42 1.28 0.56 0.00 0.00 179.97 181.60 1xz1 n LEU 169 N -3.95 0.07 -0.09 3.04 4.77 0.07 -4.64 117.00 116.26 1xz1 n LEU 169 Ca -0.08 -0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.65 1xz1 n LEU 169 Cb 0.74 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.76 1xz1 n LEU 169 CO 0.53 0.02 -1.14 0.41 -1.33 0.00 0.00 177.39 175.88 1xz1 n THR 170 N -1.83 1.03 1.51 -5.08 -1.04 -0.28 -5.05 114.28 103.53 1xz1 n THR 170 Ca -0.02 -0.28 0.14 0.00 -2.04 0.00 0.00 64.05 61.85 1xz1 n THR 170 Cb 0.29 -1.66 0.53 0.00 -1.82 0.00 0.00 70.33 67.67 1xz1 n THR 170 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61