#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nrz s GLN 3 N 0.00 3.53 -0.43 0.03 0.74 0.50 -4.93 119.66 119.10 1nrz s GLN 3 Ca 0.00 -0.58 -0.21 0.00 0.05 0.00 0.00 55.36 54.61 1nrz s GLN 3 Cb 0.00 -3.54 0.02 0.00 1.10 0.00 0.00 33.01 30.60 1nrz s GLN 3 CO 0.00 -0.32 0.67 0.42 -0.55 0.00 0.00 175.29 175.51 1nrz s ILE 4 N 1.65 4.80 -0.43 -2.34 1.01 -1.26 -0.91 121.20 123.72 1nrz s ILE 4 Ca 0.06 0.21 0.23 0.00 0.00 0.00 0.00 60.65 61.14 1nrz s ILE 4 Cb -0.16 -4.22 -0.14 0.00 0.01 0.00 0.00 42.46 37.95 1nrz s ILE 4 CO 0.07 -0.60 0.92 0.35 0.00 0.00 0.00 174.94 175.67 1nrz n THR 5 N 5.89 0.22 -3.68 2.92 -2.24 -0.48 -4.89 114.28 112.01 1nrz n THR 5 Ca -0.01 -0.35 -0.10 0.00 -2.27 0.00 0.00 64.05 61.32 1nrz n THR 5 Cb 0.48 0.08 -0.09 0.00 -2.10 0.00 0.00 70.33 68.69 1nrz n THR 5 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1nrz s LEU 6 N -4.32 -0.28 -0.12 3.22 0.20 -1.21 -4.84 118.68 111.33 1nrz s LEU 6 Ca 0.01 1.09 -0.01 0.00 0.69 0.00 0.00 54.13 55.91 1nrz s LEU 6 Cb 0.13 1.71 0.03 0.00 -0.43 0.00 0.00 46.19 47.63 1nrz s LEU 6 CO 0.82 -0.20 -0.06 0.00 -0.29 0.00 0.00 176.35 176.62 1nrz s ALA 7 N 1.20 1.27 -0.05 5.97 0.00 -1.26 -0.69 121.76 128.21 1nrz s ALA 7 Ca -0.07 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.33 1nrz s ALA 7 Cb -0.06 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 22.12 1nrz s ALA 7 CO -0.12 -0.54 -0.08 0.50 0.00 0.00 0.00 175.76 175.53 1nrz s ARG 8 N 1.73 1.16 -0.40 0.00 3.52 -0.49 0.04 118.95 124.50 1nrz s ARG 8 Ca 0.04 -0.24 -0.23 0.00 -0.13 0.00 0.00 55.73 55.16 1nrz s ARG 8 Cb -0.13 -1.04 0.02 0.00 -1.56 0.00 0.00 34.95 32.23 1nrz s ARG 8 CO -0.08 -0.01 0.80 0.42 -0.81 0.00 0.00 175.30 175.62 1nrz s ILE 9 N 0.72 4.68 -0.28 4.11 1.01 0.01 -1.33 121.20 130.11 1nrz s ILE 9 Ca -0.12 0.72 0.01 0.00 0.00 0.00 0.00 60.65 61.27 1nrz s ILE 9 Cb -0.14 -4.27 0.16 0.00 0.01 0.00 0.00 42.46 38.22 1nrz s ILE 9 CO 0.02 -0.57 0.42 -0.62 0.00 0.00 0.00 174.94 174.19 1nrz s ASP 10 N 1.98 0.14 0.00 3.58 -1.08 -0.26 -0.61 116.67 120.42 1nrz s ASP 10 Ca 0.31 -0.17 0.24 0.00 -0.52 0.00 0.00 52.55 52.41 1nrz s ASP 10 Cb -0.12 1.22 1.38 0.00 -1.46 0.00 0.00 42.92 43.93 1nrz s ASP 10 CO 0.20 -0.34 1.77 -0.90 0.52 0.00 0.00 175.17 176.42 1nrz n ASP 11 N 5.36 0.00 -0.91 -0.34 5.68 -0.47 -0.68 116.55 125.20 1nrz n ASP 11 Ca 0.00 -0.66 0.11 0.00 -0.50 0.00 0.00 54.79 53.73 1nrz n ASP 11 Cb 0.50 -0.03 0.27 0.00 -1.14 0.00 0.00 41.12 40.72 1nrz n ASP 11 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1nrz n ARG 12 N -1.03 2.18 0.00 0.11 1.74 -1.26 -5.00 116.66 113.40 1nrz n ARG 12 Ca 0.17 -1.79 0.00 0.00 -0.77 0.00 0.00 57.85 55.46 1nrz n ARG 12 Cb 0.09 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1nrz n ARG 12 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1nrz n LEU 13 N 0.99 0.00 -4.56 0.55 4.77 0.14 -4.10 117.00 114.80 1nrz n LEU 13 Ca 0.18 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.75 1nrz n LEU 13 Cb 0.48 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 1nrz n LEU 13 CO 0.14 0.00 0.19 -0.63 -1.33 0.00 0.00 177.39 175.76 1nrz s ILE 14 N 0.00 5.05 -0.40 -0.08 1.01 -1.26 -4.92 121.20 120.60 1nrz s ILE 14 Ca 0.00 0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.98 1nrz s ILE 14 Cb 0.00 -3.93 0.16 0.00 0.01 0.00 0.00 42.46 38.70 1nrz s ILE 14 CO 0.00 -0.18 0.33 -1.38 0.00 0.00 0.00 174.94 173.71 1nrz s HIS 15 N 2.32 0.68 0.00 3.97 -3.43 -1.26 -5.06 115.29 112.51 1nrz s HIS 15 Ca 0.17 -1.88 0.00 0.00 -0.80 0.00 0.00 55.06 52.56 1nrz s HIS 15 Cb -0.16 -0.79 0.00 0.00 -1.43 0.00 0.00 32.58 30.21 1nrz s HIS 15 CO 0.13 -0.87 0.00 0.41 -2.00 0.00 0.00 174.74 172.41 1nrz n GLY 16 N 3.33 0.37 0.37 -1.38 0.00 -1.26 -4.00 105.19 102.61 1nrz n GLY 16 Ca 0.22 -0.86 0.11 0.00 0.00 0.00 0.00 46.02 45.50 1nrz n GLY 16 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1nrz h GLN 17 N 0.00 0.60 -0.57 1.61 4.20 -2.00 -1.65 115.11 117.30 1nrz h GLN 17 Ca 0.00 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.70 1nrz h GLN 17 Cb 0.00 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.61 1nrz h GLN 17 CO 0.00 0.40 0.35 0.28 -0.67 0.00 0.00 178.83 179.18 1nrz h VAL 18 N 0.62 1.06 -0.26 -0.54 2.07 -2.01 -0.10 116.25 117.09 1nrz h VAL 18 Ca 0.39 -0.23 -0.14 0.00 0.82 0.00 0.00 66.70 67.53 1nrz h VAL 18 Cb 0.63 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1nrz h VAL 18 CO -0.15 0.12 -0.42 0.74 0.02 0.00 0.00 177.57 177.88 1nrz h THR 19 N 0.68 1.30 -0.75 2.57 2.02 -1.46 -2.21 112.91 115.06 1nrz h THR 19 Ca 0.23 -1.60 -0.03 0.00 0.77 0.00 0.00 66.41 65.78 1nrz h THR 19 Cb 0.03 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 1nrz h THR 19 CO -0.10 0.51 0.37 0.74 0.37 0.00 0.00 175.52 177.41 1nrz h THR 20 N 0.52 1.24 -0.64 3.16 2.02 -1.00 0.12 112.91 118.32 1nrz h THR 20 Ca 0.04 -0.66 -0.03 0.00 0.77 0.00 0.00 66.41 66.53 1nrz h THR 20 Cb 0.95 0.30 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 1nrz h THR 20 CO 0.09 0.28 0.27 0.58 0.37 0.00 0.00 175.52 177.11 1nrz h VAL 21 N 1.05 1.23 -0.70 3.16 2.07 -0.85 -0.94 116.25 121.27 1nrz h VAL 21 Ca 0.26 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 67.01 1nrz h VAL 21 Cb 0.10 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1nrz h VAL 21 CO -0.03 0.28 0.21 -0.50 0.02 0.00 0.00 177.57 177.54 1nrz h TRP 22 N 0.90 1.13 -0.69 1.57 4.06 -1.10 -2.21 115.95 119.61 1nrz h TRP 22 Ca 0.22 -0.12 -0.01 0.00 2.06 0.00 0.00 58.89 61.04 1nrz h TRP 22 Cb 0.18 -0.33 -0.03 0.00 -1.00 0.00 0.00 29.16 27.98 1nrz h TRP 22 CO 0.01 0.91 0.41 1.03 -3.56 0.00 0.00 178.44 177.24 1nrz h SER 23 N 1.03 0.83 -0.20 -3.49 0.87 -0.28 -0.59 113.55 111.72 1nrz h SER 23 Ca 0.22 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.63 1nrz h SER 23 Cb 0.32 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1nrz h SER 23 CO -0.00 0.65 -0.24 0.11 -0.53 0.00 0.00 176.83 176.81 1nrz h LYS 24 N 0.96 0.66 -0.58 2.24 1.57 -0.92 -1.43 116.57 119.07 1nrz h LYS 24 Ca 0.25 -0.26 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1nrz h LYS 24 Cb -0.02 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1nrz h LYS 24 CO -0.05 0.84 0.10 0.28 -0.57 0.00 0.00 179.45 180.05 1nrz h VAL 25 N 0.58 1.26 -0.24 0.50 2.07 -0.69 -3.05 116.25 116.68 1nrz h VAL 25 Ca 0.08 -0.98 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 1nrz h VAL 25 Cb 0.71 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1nrz h VAL 25 CO 0.05 0.36 -0.19 0.00 0.02 0.00 0.00 177.57 177.82 1nrz h ALA 26 N 1.01 1.23 -6.50 1.67 0.00 -0.83 -3.47 119.26 112.36 1nrz h ALA 26 Ca 0.18 -0.29 -0.50 0.00 0.00 0.00 0.00 54.91 54.29 1nrz h ALA 26 Cb 0.41 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1nrz h ALA 26 CO 0.01 0.50 -0.88 -1.71 0.00 0.00 0.00 179.25 177.17 1nrz n ASN 27 N -4.17 -0.69 -4.82 0.00 4.05 -0.57 -4.80 115.26 104.25 1nrz n ASN 27 Ca -0.00 -1.00 -0.23 0.00 0.45 0.00 0.00 54.58 53.81 1nrz n ASN 27 Cb 0.35 -3.07 -0.05 0.00 1.23 0.00 0.00 39.78 38.24 1nrz n ASN 27 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nrz s ALA 28 N -3.88 3.88 -0.12 5.20 0.00 -1.26 -4.98 121.76 120.60 1nrz s ALA 28 Ca 0.08 -1.95 0.21 0.00 0.00 0.00 0.00 51.96 50.30 1nrz s ALA 28 Cb -0.05 -0.73 -0.20 0.00 0.00 0.00 0.00 23.12 22.14 1nrz s ALA 28 CO 0.89 -0.21 0.65 1.04 0.00 0.00 0.00 175.76 178.12 1nrz n GLN 29 N -1.43 0.64 -3.77 0.00 6.02 -0.55 -4.93 117.38 113.37 1nrz n GLN 29 Ca 0.01 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 1nrz n GLN 29 Cb 0.63 -1.66 -0.13 0.00 1.02 0.00 0.00 30.24 30.11 1nrz n GLN 29 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1nrz s ARG 30 N -3.25 0.22 -0.24 -1.09 3.52 -1.06 -2.36 118.95 114.69 1nrz s ARG 30 Ca -0.05 0.39 -0.10 0.00 -0.13 0.00 0.00 55.73 55.84 1nrz s ARG 30 Cb 0.11 0.01 -0.05 0.00 -1.56 0.00 0.00 34.95 33.46 1nrz s ARG 30 CO 0.85 -0.09 0.15 0.42 -0.81 0.00 0.00 175.30 175.82 1nrz s ILE 31 N 0.61 5.19 -0.23 4.11 1.01 0.42 -1.14 121.20 131.16 1nrz s ILE 31 Ca -0.04 0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.72 1nrz s ILE 31 Cb -0.05 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 39.02 1nrz s ILE 31 CO -0.03 0.34 -0.09 -0.63 0.00 0.00 0.00 174.94 174.52 1nrz s ILE 32 N 1.16 2.65 -0.29 2.92 1.01 -0.31 -1.26 121.20 127.08 1nrz s ILE 32 Ca 0.07 -1.05 -0.22 0.00 0.00 0.00 0.00 60.65 59.45 1nrz s ILE 32 Cb -0.14 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 1nrz s ILE 32 CO 0.05 0.26 0.71 -0.63 0.00 0.00 0.00 174.94 175.32 1nrz s ILE 33 N 1.30 4.88 -0.50 2.92 1.09 0.14 -1.20 121.20 129.83 1nrz s ILE 33 Ca 0.00 1.11 -0.13 0.00 -1.10 0.00 0.00 60.65 60.53 1nrz s ILE 33 Cb -0.16 -4.05 0.11 0.00 -1.06 0.00 0.00 42.46 37.30 1nrz s ILE 33 CO -0.06 -0.14 0.41 0.00 -0.10 0.00 0.00 174.94 175.06 1nrz s ASN 35 N 3.01 -0.61 0.14 0.00 3.84 -0.14 -4.61 114.94 116.57 1nrz s ASN 35 Ca 0.04 0.89 -0.19 0.00 0.21 0.00 0.00 52.86 53.81 1nrz s ASN 35 Cb -0.27 1.53 0.00 0.00 -0.55 0.00 0.00 41.25 41.96 1nrz s ASN 35 CO 0.03 -0.13 1.71 0.44 -2.79 0.00 0.00 177.10 176.36 1nrz h ASP 36 N 6.97 -0.13 0.51 -4.21 3.32 -1.90 -2.60 116.42 118.39 1nrz h ASP 36 Ca -0.21 0.06 -0.23 0.00 0.02 0.00 0.00 57.03 56.67 1nrz h ASP 36 Cb 1.15 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.81 1nrz h ASP 36 CO 0.13 -0.03 -1.00 0.44 -1.72 0.00 0.00 179.24 177.05 1nrz h ASP 37 N 0.06 0.40 -0.45 6.45 5.19 -1.97 -3.04 116.42 123.06 1nrz h ASP 37 Ca 0.12 -0.35 -0.04 0.00 -0.62 0.00 0.00 57.03 56.13 1nrz h ASP 37 Cb 0.16 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 1nrz h ASP 37 CO -0.21 1.18 0.14 0.58 -3.12 0.00 0.00 179.24 177.80 1nrz h VAL 38 N 0.14 1.21 -0.07 -1.35 2.07 -1.93 -1.68 116.25 114.65 1nrz h VAL 38 Ca -0.08 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 66.71 1nrz h VAL 38 Cb 1.66 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1nrz h VAL 38 CO 0.16 0.28 0.05 0.15 0.02 0.00 0.00 177.57 178.23 1nrz h PHE 39 N 0.74 0.00 -0.07 1.57 3.57 -1.35 -2.05 116.94 119.36 1nrz h PHE 39 Ca 0.17 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.67 1nrz h PHE 39 Cb 0.26 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1nrz h PHE 39 CO 0.01 0.00 0.00 0.09 -2.23 0.00 0.00 178.31 176.18 1nrz n ASN 40 N -4.30 2.10 -4.27 0.41 3.02 -0.64 -4.76 115.26 106.82 1nrz n ASN 40 Ca -0.01 -1.71 -0.41 0.00 -0.03 0.00 0.00 54.58 52.42 1nrz n ASN 40 Cb 0.16 -0.03 -0.09 0.00 -0.61 0.00 0.00 39.78 39.20 1nrz n ASN 40 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1nrz s ASP 41 N -1.91 5.72 0.22 6.41 -1.08 -0.77 -4.97 116.67 120.29 1nrz s ASP 41 Ca 0.34 -1.55 -0.09 0.00 -0.52 0.00 0.00 52.55 50.73 1nrz s ASP 41 Cb 0.20 -2.02 0.18 0.00 -1.46 0.00 0.00 42.92 39.82 1nrz s ASP 41 CO 0.31 -0.58 1.86 -0.33 0.52 0.00 0.00 175.17 176.95 1nrz h GLU 42 N 8.46 1.12 -0.11 4.34 5.08 -1.85 -0.56 114.58 131.06 1nrz h GLU 42 Ca -0.23 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 1nrz h GLU 42 Cb 1.08 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 1nrz h GLU 42 CO 0.79 0.80 -0.01 0.28 -1.00 0.00 0.00 179.01 179.87 1nrz h VAL 43 N 1.13 1.27 -0.67 3.13 2.07 -1.95 -1.50 116.25 119.74 1nrz h VAL 43 Ca 0.29 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 1nrz h VAL 43 Cb -0.03 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1nrz h VAL 43 CO -0.05 0.26 0.27 -0.09 0.02 0.00 0.00 177.57 177.98 1nrz h ARG 44 N -0.09 0.99 -0.79 1.57 2.43 -1.86 0.37 114.38 117.00 1nrz h ARG 44 Ca 0.03 -0.17 -0.05 0.00 -0.81 0.00 0.00 59.98 58.98 1nrz h ARG 44 Cb 0.40 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1nrz h ARG 44 CO 0.01 0.82 0.31 -0.09 -1.51 0.00 0.00 179.97 179.50 1nrz h ARG 45 N 0.94 1.19 -0.32 0.20 2.43 -1.08 -0.39 114.38 117.34 1nrz h ARG 45 Ca 0.22 -0.22 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1nrz h ARG 45 Cb 0.19 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1nrz h ARG 45 CO -0.02 0.97 -0.06 1.15 -1.51 0.00 0.00 179.97 180.49 1nrz h THR 46 N 1.15 1.28 -0.90 0.20 2.02 -0.85 -2.25 112.91 113.56 1nrz h THR 46 Ca 0.26 -1.10 0.06 0.00 0.77 0.00 0.00 66.41 66.41 1nrz h THR 46 Cb 0.23 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.92 1nrz h THR 46 CO -0.02 0.35 0.57 -0.07 0.37 0.00 0.00 175.52 176.72 1nrz h LEU 47 N 0.38 0.90 -0.15 2.58 4.07 -0.56 -1.68 115.31 120.85 1nrz h LEU 47 Ca 0.08 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.05 1nrz h LEU 47 Cb 0.55 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.11 1nrz h LEU 47 CO 0.03 0.58 0.08 -0.07 -1.08 0.00 0.00 178.44 177.97 1nrz h LEU 48 N 1.03 0.19 -0.68 1.67 3.38 -0.85 -1.37 115.31 118.68 1nrz h LEU 48 Ca 0.39 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.26 1nrz h LEU 48 Cb 0.16 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1nrz h LEU 48 CO -0.17 0.24 0.44 -0.09 0.09 0.00 0.00 178.44 178.96 1nrz h ARG 49 N 0.12 0.87 0.00 1.13 9.65 -1.15 -1.82 114.38 123.19 1nrz h ARG 49 Ca 0.05 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1nrz h ARG 49 Cb 0.10 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.48 1nrz h ARG 49 CO -0.01 0.58 0.00 1.96 2.80 0.00 0.00 179.97 185.30 1nrz h GLN 50 N 0.90 0.00 -0.64 0.20 4.20 -1.02 -2.78 115.11 115.97 1nrz h GLN 50 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1nrz h GLN 50 Cb -0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1nrz h GLN 50 CO -0.07 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.09 1nrz n ALA 51 N -1.84 3.11 -1.79 3.87 0.00 -0.54 -4.98 120.51 118.34 1nrz n ALA 51 Ca 0.02 -1.36 -0.42 0.00 0.00 0.00 0.00 53.44 51.68 1nrz n ALA 51 Cb 0.26 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 1nrz n ALA 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nrz s ALA 52 N -1.91 3.83 0.62 0.00 0.00 -1.05 -4.94 121.76 118.31 1nrz s ALA 52 Ca 0.43 1.47 -0.18 0.00 0.00 0.00 0.00 51.96 53.67 1nrz s ALA 52 Cb 0.29 -3.70 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 1nrz s ALA 52 CO 0.19 -1.00 1.12 -2.30 0.00 0.00 0.00 175.76 173.78 1nrz n PRO 53 N 4.62 1.01 -1.58 0.00 -0.02 -1.26 -4.87 135.00 132.91 1nrz n PRO 53 Ca 0.16 0.39 -0.49 0.00 -2.02 0.00 0.00 63.50 61.54 1nrz n PRO 53 Cb 0.37 -2.34 -0.04 0.00 -0.02 0.00 0.00 33.50 31.47 1nrz n PRO 53 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nrz n PRO 54 N -1.41 1.13 -0.95 0.52 -0.02 -1.26 -1.51 135.00 131.50 1nrz n PRO 54 Ca 0.15 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1nrz n PRO 54 Cb 0.48 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1nrz n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nrz n GLY 55 N 2.09 0.63 3.59 -1.23 0.00 -1.26 -5.01 105.19 103.99 1nrz n GLY 55 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1nrz n GLY 55 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nrz s MET 56 N -0.27 2.56 0.16 1.61 -1.94 -0.57 -4.96 119.30 115.89 1nrz s MET 56 Ca 0.00 -0.71 -0.06 0.00 -1.71 0.00 0.00 55.69 53.21 1nrz s MET 56 Cb 0.00 -2.50 -0.06 0.00 2.01 0.00 0.00 34.83 34.28 1nrz s MET 56 CO 0.00 0.61 0.42 0.15 -0.01 0.00 0.00 175.02 176.18 1nrz s LYS 57 N -1.33 3.66 -0.05 2.03 1.02 -1.00 -4.68 119.74 119.39 1nrz s LYS 57 Ca 0.16 -0.00 0.02 0.00 0.02 0.00 0.00 55.97 56.17 1nrz s LYS 57 Cb -0.11 -2.80 0.02 0.00 -0.52 0.00 0.00 37.83 34.41 1nrz s LYS 57 CO 0.07 0.43 -0.09 0.08 -0.92 0.00 0.00 175.35 174.92 1nrz s VAL 58 N -1.69 0.89 0.05 3.17 1.01 -1.26 -0.44 120.40 122.13 1nrz s VAL 58 Ca 0.42 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 62.10 1nrz s VAL 58 Cb -0.12 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1nrz s VAL 58 CO 0.24 0.30 -0.12 0.20 0.00 0.00 0.00 175.10 175.72 1nrz s ASN 59 N 0.72 1.37 -0.13 3.32 -0.87 -0.39 -4.83 114.94 114.13 1nrz s ASN 59 Ca -0.13 -0.50 0.01 0.00 -1.57 0.00 0.00 52.86 50.68 1nrz s ASN 59 Cb -0.15 -0.05 -0.01 0.00 -0.02 0.00 0.00 41.25 41.02 1nrz s ASN 59 CO 0.02 -0.06 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.64 1nrz s VAL 60 N -1.04 2.65 0.05 1.60 1.01 -1.26 -0.69 120.40 122.72 1nrz s VAL 60 Ca -0.02 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1nrz s VAL 60 Cb -0.08 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1nrz s VAL 60 CO 0.01 0.53 -0.06 0.68 0.00 0.00 0.00 175.10 176.26 1nrz s VAL 61 N 0.55 0.47 0.92 2.92 -7.23 -0.03 -4.90 120.40 113.09 1nrz s VAL 61 Ca -0.10 -1.26 -0.12 0.00 -1.81 0.00 0.00 61.98 58.69 1nrz s VAL 61 Cb -0.16 -0.81 0.14 0.00 0.56 0.00 0.00 36.38 36.11 1nrz s VAL 61 CO 0.04 -0.54 1.09 -0.94 -0.31 0.00 0.00 175.10 174.44 1nrz s SER 62 N -1.93 3.30 0.25 4.85 1.04 -1.26 -0.97 113.70 118.99 1nrz s SER 62 Ca -0.06 1.45 -0.05 0.00 0.48 0.00 0.00 55.95 57.77 1nrz s SER 62 Cb -0.06 -2.13 0.29 0.00 0.10 0.00 0.00 66.02 64.22 1nrz s SER 62 CO -0.02 -2.74 1.89 -0.07 0.98 0.00 0.00 173.24 173.28 1nrz h LEU 63 N -1.62 1.07 -0.27 2.42 4.07 -1.90 0.48 115.31 119.56 1nrz h LEU 63 Ca -0.50 -0.07 0.01 0.00 0.08 0.00 0.00 57.88 57.39 1nrz h LEU 63 Cb 1.29 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.74 1nrz h LEU 63 CO 0.55 0.83 0.16 -0.08 -1.08 0.00 0.00 178.44 178.82 1nrz h GLU 64 N 1.22 0.32 -0.31 1.13 4.81 -2.00 -1.69 114.58 118.05 1nrz h GLU 64 Ca 0.31 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.39 1nrz h GLU 64 Cb -0.02 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1nrz h GLU 64 CO -0.06 0.21 -0.36 -0.22 -0.73 0.00 0.00 179.01 177.86 1nrz h LYS 65 N 0.33 0.71 -0.47 1.92 3.64 -1.84 -1.69 116.57 119.17 1nrz h LYS 65 Ca 0.11 -0.35 0.08 0.00 -1.27 0.00 0.00 60.65 59.22 1nrz h LYS 65 Cb -0.00 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.75 1nrz h LYS 65 CO -0.05 0.96 0.10 0.00 -2.27 0.00 0.00 179.45 178.18 1nrz h ALA 66 N 1.01 0.52 -0.41 5.00 0.00 -0.54 0.41 119.26 125.24 1nrz h ALA 66 Ca 0.06 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1nrz h ALA 66 Cb 0.88 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1nrz h ALA 66 CO 0.08 -0.31 0.15 0.28 0.00 0.00 0.00 179.25 179.45 1nrz h VAL 67 N 0.23 1.20 -0.26 0.00 2.07 -1.13 -1.50 116.25 116.87 1nrz h VAL 67 Ca 0.23 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 1nrz h VAL 67 Cb 0.29 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1nrz h VAL 67 CO -0.30 0.23 0.14 0.00 0.02 0.00 0.00 177.57 177.67 1nrz h ALA 68 N 1.00 0.34 -0.41 1.67 0.00 -0.66 -2.44 119.26 118.76 1nrz h ALA 68 Ca 0.13 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1nrz h ALA 68 Cb 0.22 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1nrz h ALA 68 CO -0.01 -0.13 -0.15 -0.39 0.00 0.00 0.00 179.25 178.57 1nrz h VAL 69 N 0.31 1.26 -0.97 0.00 -1.51 -0.89 -2.49 116.25 111.96 1nrz h VAL 69 Ca 0.09 -1.23 0.08 0.00 -1.23 0.00 0.00 66.70 64.41 1nrz h VAL 69 Cb 0.07 1.11 -0.07 0.00 -2.13 0.00 0.00 31.29 30.28 1nrz h VAL 69 CO -0.01 0.42 0.63 0.22 -1.23 0.00 0.00 177.57 177.59 1nrz h TYR 70 N 0.68 1.13 -0.20 5.19 3.20 -1.10 -1.50 116.97 124.37 1nrz h TYR 70 Ca 0.11 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1nrz h TYR 70 Cb 0.64 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1nrz h TYR 70 CO 0.03 0.56 0.00 0.72 -1.64 0.00 0.00 178.16 177.83 1nrz n HIS 71 N -4.52 0.25 -2.99 -3.82 8.25 -0.93 -4.09 115.22 107.37 1nrz n HIS 71 Ca 0.16 -0.13 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 1nrz n HIS 71 Cb 0.23 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.29 1nrz n HIS 71 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1nrz s ASN 72 N -1.51 6.49 0.53 0.41 3.84 -0.57 -4.94 114.94 119.19 1nrz s ASN 72 Ca 0.32 0.20 0.27 0.00 0.21 0.00 0.00 52.86 53.85 1nrz s ASN 72 Cb 0.17 -2.38 1.45 0.00 -0.55 0.00 0.00 41.25 39.94 1nrz s ASN 72 CO 0.26 -0.74 1.79 -0.65 -2.79 0.00 0.00 177.10 174.96 1nrz h PRO 73 N 8.59 0.00 -0.10 0.43 0.11 -1.87 -0.76 132.00 138.40 1nrz h PRO 73 Ca -0.25 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.89 1nrz h PRO 73 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1nrz h PRO 73 CO 0.91 0.00 0.09 0.37 -0.21 0.00 0.00 178.00 179.16 1nrz h GLN 74 N 0.00 0.00 -0.25 1.05 4.15 -1.92 -1.57 115.11 116.57 1nrz h GLN 74 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 1nrz h GLN 74 Cb 0.46 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 1nrz h GLN 74 CO 0.00 0.00 -0.01 0.66 -1.93 0.00 0.00 178.83 177.55 1nrz n TYR 75 N -4.10 0.87 -0.26 3.99 4.02 -0.29 -4.80 117.16 116.59 1nrz n TYR 75 Ca -0.01 -1.05 0.06 0.00 -0.01 0.00 0.00 57.90 56.89 1nrz n TYR 75 Cb 0.20 -0.34 0.17 0.00 -0.02 0.00 0.00 39.34 39.36 1nrz n TYR 75 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1nrz h GLN 76 N 1.41 0.14 -0.53 -0.72 4.15 -1.38 -1.44 115.11 116.73 1nrz h GLN 76 Ca 0.05 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1nrz h GLN 76 Cb 1.44 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.10 1nrz h GLN 76 CO 0.24 0.09 0.00 -0.25 -1.93 0.00 0.00 178.83 176.98 1nrz n ASP 77 N -5.30 3.51 -4.74 -0.69 8.00 -1.26 -1.10 116.55 114.98 1nrz n ASP 77 Ca 0.14 -1.97 -0.41 0.00 0.71 0.00 0.00 54.79 53.25 1nrz n ASP 77 Cb 0.49 -0.35 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 1nrz n ASP 77 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1nrz s GLU 78 N -1.10 4.41 -0.07 -1.24 2.12 -0.62 -4.68 118.70 117.53 1nrz s GLU 78 Ca 0.39 2.00 -0.15 0.00 0.36 0.00 0.00 54.97 57.57 1nrz s GLU 78 Cb 0.21 -3.21 -0.05 0.00 0.26 0.00 0.00 34.13 31.34 1nrz s GLU 78 CO 0.28 -0.21 0.40 0.95 -0.54 0.00 0.00 175.26 176.13 1nrz s THR 79 N 0.09 5.14 -0.01 -1.70 -4.23 -1.26 -0.37 115.64 113.30 1nrz s THR 79 Ca 0.56 0.80 0.03 0.00 -1.18 0.00 0.00 61.69 61.90 1nrz s THR 79 Cb -0.35 -3.72 -0.01 0.00 1.34 0.00 0.00 72.50 69.76 1nrz s THR 79 CO 0.38 0.47 -0.10 -0.69 -0.54 0.00 0.00 174.62 174.13 1nrz s VAL 80 N -0.25 0.80 -0.37 2.29 1.01 -0.08 -1.48 120.40 122.31 1nrz s VAL 80 Ca 0.23 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 1nrz s VAL 80 Cb -0.15 -0.67 0.07 0.00 0.00 0.00 0.00 36.38 35.62 1nrz s VAL 80 CO 0.10 0.23 0.16 0.12 0.00 0.00 0.00 175.10 175.71 1nrz s PHE 81 N -0.23 3.34 0.17 5.22 5.36 -0.29 -1.39 117.98 130.18 1nrz s PHE 81 Ca 0.04 -1.71 -0.23 0.00 -0.96 0.00 0.00 56.93 54.07 1nrz s PHE 81 Cb -0.04 -2.64 -0.08 0.00 -0.34 0.00 0.00 43.02 39.92 1nrz s PHE 81 CO -0.00 -0.82 0.74 0.71 -1.46 0.00 0.00 175.22 174.38 1nrz s TYR 82 N 1.34 3.81 -0.07 10.12 4.12 0.14 -1.16 117.35 135.65 1nrz s TYR 82 Ca 0.01 1.52 0.05 0.00 0.02 0.00 0.00 57.07 58.66 1nrz s TYR 82 Cb -0.21 -2.69 -0.00 0.00 -1.52 0.00 0.00 41.96 37.53 1nrz s TYR 82 CO 0.01 0.47 -0.22 -0.51 0.02 0.00 0.00 175.55 175.31 1nrz s LEU 83 N -1.41 2.01 0.20 -1.29 1.43 -0.34 -1.40 118.68 117.87 1nrz s LEU 83 Ca 0.37 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 53.07 1nrz s LEU 83 Cb -0.21 -1.25 -0.05 0.00 0.03 0.00 0.00 46.19 44.72 1nrz s LEU 83 CO 0.24 0.18 -0.12 -0.36 0.23 0.00 0.00 176.35 176.52 1nrz s PHE 84 N 0.08 1.60 -0.74 0.29 0.40 -0.44 -1.01 117.98 118.16 1nrz s PHE 84 Ca -0.09 -0.65 0.16 0.00 -0.60 0.00 0.00 56.93 55.75 1nrz s PHE 84 Cb -0.15 -0.79 -0.17 0.00 0.51 0.00 0.00 43.02 42.42 1nrz s PHE 84 CO 0.05 0.25 0.67 0.25 0.70 0.00 0.00 175.22 177.14 1nrz n THR 85 N -0.35 0.00 -3.47 0.64 -2.24 -1.26 -1.10 114.28 106.50 1nrz n THR 85 Ca -0.08 -0.13 -0.12 0.00 -2.27 0.00 0.00 64.05 61.45 1nrz n THR 85 Cb 0.61 0.98 -0.03 0.00 -2.10 0.00 0.00 70.33 69.79 1nrz n THR 85 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1nrz s ASN 86 N -2.53 -0.50 0.35 3.42 2.20 -1.26 -4.55 114.94 112.06 1nrz s ASN 86 Ca 0.06 0.12 0.16 0.00 -0.94 0.00 0.00 52.86 52.26 1nrz s ASN 86 Cb 0.12 0.50 0.63 0.00 -2.00 0.00 0.00 41.25 40.50 1nrz s ASN 86 CO 0.66 -0.77 1.72 1.55 -2.94 0.00 0.00 177.10 177.32 1nrz h PRO 87 N 2.17 0.00 -0.76 3.55 0.13 -1.96 -3.25 132.00 131.88 1nrz h PRO 87 Ca -0.28 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.89 1nrz h PRO 87 Cb 1.26 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.34 1nrz h PRO 87 CO 0.35 0.43 0.47 0.45 -0.23 0.00 0.00 178.00 179.47 1nrz h HIS 88 N 0.00 0.88 -0.43 1.56 3.86 -1.92 -1.22 115.15 117.88 1nrz h HIS 88 Ca -0.00 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.16 1nrz h HIS 88 Cb 0.90 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 1nrz h HIS 88 CO 0.00 0.47 -0.01 -0.44 0.86 0.00 0.00 177.93 178.81 1nrz h ASP 89 N 0.89 0.68 -0.08 2.45 3.45 -1.96 -0.21 116.42 121.63 1nrz h ASP 89 Ca 0.32 -0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 1nrz h ASP 89 Cb 0.09 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 38.68 1nrz h ASP 89 CO -0.14 0.75 0.02 0.58 -1.57 0.00 0.00 179.24 178.89 1nrz h VAL 90 N 0.66 1.18 -0.71 -1.35 2.07 -1.50 -2.49 116.25 114.12 1nrz h VAL 90 Ca 0.13 -0.54 0.07 0.00 0.82 0.00 0.00 66.70 67.18 1nrz h VAL 90 Cb 0.43 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 1nrz h VAL 90 CO 0.02 0.15 0.39 0.25 0.02 0.00 0.00 177.57 178.40 1nrz h LEU 91 N -0.06 0.56 -0.62 2.57 5.85 -0.79 0.36 115.31 123.18 1nrz h LEU 91 Ca 0.03 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1nrz h LEU 91 Cb 0.22 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.13 1nrz h LEU 91 CO -0.00 0.35 0.32 0.74 -0.34 0.00 0.00 178.44 179.51 1nrz h THR 92 N 0.70 0.93 -0.13 1.05 2.02 -0.90 -1.15 112.91 115.43 1nrz h THR 92 Ca 0.33 -0.20 -0.15 0.00 0.77 0.00 0.00 66.41 67.15 1nrz h THR 92 Cb 0.24 0.28 0.01 0.00 -1.74 0.00 0.00 68.15 66.94 1nrz h THR 92 CO -0.21 0.11 -0.52 0.24 0.37 0.00 0.00 175.52 175.52 1nrz h MET 93 N 0.60 0.59 -0.86 6.66 2.86 -0.90 -3.14 114.93 120.73 1nrz h MET 93 Ca 0.28 -0.45 0.05 0.00 -2.06 0.00 0.00 59.70 57.52 1nrz h MET 93 Cb 0.21 0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.90 1nrz h MET 93 CO -0.20 1.07 0.56 0.28 1.06 0.00 0.00 176.91 179.69 1nrz h VAL 94 N 0.23 1.09 0.00 -2.22 2.07 -0.79 0.17 116.25 116.81 1nrz h VAL 94 Ca -0.03 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1nrz h VAL 94 Cb 1.15 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1nrz h VAL 94 CO 0.11 0.18 0.00 0.03 0.02 0.00 0.00 177.57 177.91 1nrz h ARG 95 N 1.01 0.00 -0.41 1.57 3.08 -1.18 -2.59 114.38 115.86 1nrz h ARG 95 Ca 0.36 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.31 1nrz h ARG 95 Cb 0.13 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.12 1nrz h ARG 95 CO -0.12 0.00 0.05 1.04 -1.07 0.00 0.00 179.97 179.87 1nrz n GLN 96 N -2.35 2.87 -0.17 0.04 6.02 0.02 -4.95 117.38 118.86 1nrz n GLN 96 Ca 0.01 -2.99 0.00 0.00 -0.01 0.00 0.00 57.00 54.01 1nrz n GLN 96 Cb 0.18 -1.94 0.00 0.00 1.02 0.00 0.00 30.24 29.51 1nrz n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nrz n GLY 97 N -0.57 0.59 3.63 1.08 0.00 -0.98 -5.03 105.19 103.91 1nrz n GLY 97 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 1nrz n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nrz s VAL 98 N -2.35 4.23 -0.58 1.61 1.01 -1.00 -4.96 120.40 118.35 1nrz s VAL 98 Ca 0.00 1.40 -0.26 0.00 0.00 0.00 0.00 61.98 63.12 1nrz s VAL 98 Cb 0.00 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.20 1nrz s VAL 98 CO 0.00 -0.47 1.08 -1.10 0.00 0.00 0.00 175.10 174.61 1nrz s GLN 99 N 4.03 3.39 -0.27 2.72 -0.21 -1.26 -4.21 119.66 123.84 1nrz s GLN 99 Ca 0.54 -0.06 0.03 0.00 0.02 0.00 0.00 55.36 55.88 1nrz s GLN 99 Cb -0.16 -4.05 0.07 0.00 1.00 0.00 0.00 33.01 29.86 1nrz s GLN 99 CO 0.21 -1.64 -0.08 0.42 -2.12 0.00 0.00 175.29 172.08 1nrz s ILE 100 N 4.54 2.10 -0.05 1.08 1.01 -1.26 -4.75 121.20 123.87 1nrz s ILE 100 Ca 0.36 -1.68 -0.24 0.00 0.00 0.00 0.00 60.65 59.09 1nrz s ILE 100 Cb -0.10 -2.27 -0.25 0.00 0.01 0.00 0.00 42.46 39.85 1nrz s ILE 100 CO 0.21 -0.12 1.00 0.00 0.00 0.00 0.00 174.94 176.03 1nrz h ALA 101 N 7.77 0.02 -4.02 9.38 0.00 -1.93 -3.44 119.26 127.04 1nrz h ALA 101 Ca -0.17 -0.52 -0.44 0.00 0.00 0.00 0.00 54.91 53.77 1nrz h ALA 101 Cb 1.04 0.03 -0.30 0.00 0.00 0.00 0.00 17.79 18.56 1nrz h ALA 101 CO 0.46 0.17 -0.80 -0.08 0.00 0.00 0.00 179.25 179.01 1nrz s THR 102 N -2.94 0.90 -0.23 0.00 -1.32 -1.26 -1.24 115.64 109.54 1nrz s THR 102 Ca -0.15 -0.47 -0.06 0.00 -1.21 0.00 0.00 61.69 59.80 1nrz s THR 102 Cb 0.01 -0.77 -0.02 0.00 -1.51 0.00 0.00 72.50 70.21 1nrz s THR 102 CO 0.77 0.26 0.02 -0.22 -2.21 0.00 0.00 174.62 173.24 1nrz s LEU 103 N -0.12 3.24 -0.02 9.08 0.20 0.74 -4.42 118.68 127.38 1nrz s LEU 103 Ca 0.02 -0.25 -0.23 0.00 0.69 0.00 0.00 54.13 54.35 1nrz s LEU 103 Cb -0.06 -1.85 -0.05 0.00 -0.43 0.00 0.00 46.19 43.81 1nrz s LEU 103 CO -0.00 -0.00 0.70 0.21 -0.29 0.00 0.00 176.35 176.97 1nrz s ASN 104 N 1.40 7.06 -0.24 3.68 3.04 0.11 -0.81 114.94 129.17 1nrz s ASN 104 Ca 0.05 1.27 -0.04 0.00 0.04 0.00 0.00 52.86 54.18 1nrz s ASN 104 Cb -0.15 -2.42 0.01 0.00 -1.54 0.00 0.00 41.25 37.15 1nrz s ASN 104 CO 0.01 -0.03 -0.02 -0.63 -3.04 0.00 0.00 177.10 173.38 1nrz s ILE 105 N 0.34 3.32 -0.01 -5.21 -1.09 0.31 -0.81 121.20 118.06 1nrz s ILE 105 Ca 0.37 -0.72 0.01 0.00 -2.23 0.00 0.00 60.65 58.08 1nrz s ILE 105 Cb -0.19 -2.61 -0.01 0.00 -1.58 0.00 0.00 42.46 38.07 1nrz s ILE 105 CO 0.19 0.28 0.00 0.61 -1.23 0.00 0.00 174.94 174.79 1nrz n GLY 106 N 4.77 -0.03 3.49 6.18 0.00 0.22 -1.65 105.19 118.16 1nrz n GLY 106 Ca -0.17 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 45.85 1nrz n GLY 106 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nrz s GLY 107 N -3.13 -0.56 -0.25 -0.02 0.00 -0.82 -4.47 107.32 98.08 1nrz s GLY 107 Ca -0.00 2.56 -0.02 0.00 0.00 0.00 0.00 44.72 47.26 1nrz s GLY 107 CO 0.03 3.19 0.05 1.06 0.00 0.00 0.00 173.10 177.43 1nrz s MET 108 N 2.74 0.77 0.44 2.90 -1.94 0.29 -1.36 119.30 123.15 1nrz s MET 108 Ca -0.02 -0.74 -0.23 0.00 -1.71 0.00 0.00 55.69 52.99 1nrz s MET 108 Cb -0.10 -2.09 -0.08 0.00 2.01 0.00 0.00 34.83 34.57 1nrz s MET 108 CO -0.18 -0.78 1.12 0.00 -0.01 0.00 0.00 175.02 175.17 1nrz s ALA 109 N 1.72 3.00 0.35 3.03 0.00 -1.26 -1.32 121.76 127.28 1nrz s ALA 109 Ca 0.03 0.84 -0.26 0.00 0.00 0.00 0.00 51.96 52.57 1nrz s ALA 109 Cb -0.17 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.51 1nrz s ALA 109 CO -0.15 -0.51 1.06 -0.46 0.00 0.00 0.00 175.76 175.70 1nrz s TRP 110 N -1.61 3.40 0.15 0.00 -0.00 -1.26 -4.69 118.94 114.94 1nrz s TRP 110 Ca 0.62 1.67 -0.17 0.00 -0.00 0.00 0.00 56.10 58.23 1nrz s TRP 110 Cb -0.26 -3.17 0.03 0.00 -0.00 0.00 0.00 33.47 30.07 1nrz s TRP 110 CO 0.32 -0.55 0.45 -0.98 -0.00 0.00 0.00 176.95 176.19 1nrz s ARG 111 N -2.10 1.19 0.19 5.86 1.70 -1.26 -5.07 118.95 119.45 1nrz s ARG 111 Ca 0.53 -0.76 -0.33 0.00 -0.47 0.00 0.00 55.73 54.70 1nrz s ARG 111 Cb -0.25 0.49 -0.14 0.00 -0.57 0.00 0.00 34.95 34.48 1nrz s ARG 111 CO 0.32 -0.49 1.40 -2.30 -1.08 0.00 0.00 175.30 173.16 1nrz n PRO 112 N -0.28 1.80 0.00 3.89 -0.02 -1.26 -1.44 135.00 137.69 1nrz n PRO 112 Ca -0.14 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1nrz n PRO 112 Cb 0.63 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1nrz n PRO 112 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nrz n GLY 113 N 2.52 1.77 3.77 -1.23 0.00 -1.26 -5.08 105.19 105.69 1nrz n GLY 113 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 1nrz n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nrz s LYS 114 N -0.63 2.73 -0.06 1.61 -0.14 -0.52 -4.65 119.74 118.08 1nrz s LYS 114 Ca 0.00 -1.18 0.04 0.00 -1.36 0.00 0.00 55.97 53.48 1nrz s LYS 114 Cb 0.00 -2.44 -0.00 0.00 -1.68 0.00 0.00 37.83 33.71 1nrz s LYS 114 CO 0.00 0.37 -0.20 0.15 -0.76 0.00 0.00 175.35 174.91 1nrz s LYS 115 N -3.80 2.24 0.17 1.68 -0.14 0.48 -4.80 119.74 115.56 1nrz s LYS 115 Ca 0.33 -0.72 -0.31 0.00 -1.36 0.00 0.00 55.97 53.91 1nrz s LYS 115 Cb -0.07 -1.85 -0.09 0.00 -1.68 0.00 0.00 37.83 34.14 1nrz s LYS 115 CO 0.24 0.24 1.40 -1.14 -0.76 0.00 0.00 175.35 175.33 1nrz s GLN 116 N 0.13 4.32 -0.22 1.68 0.74 -1.26 -1.26 119.66 123.78 1nrz s GLN 116 Ca -0.08 2.15 -0.14 0.00 0.05 0.00 0.00 55.36 57.34 1nrz s GLN 116 Cb -0.14 -3.19 -0.18 0.00 1.10 0.00 0.00 33.01 30.59 1nrz s GLN 116 CO 0.04 -0.41 0.03 -0.11 -0.55 0.00 0.00 175.29 174.30 1nrz n LEU 117 N 3.29 2.18 -3.83 3.68 7.94 0.14 -4.92 117.00 125.49 1nrz n LEU 117 Ca 0.09 0.29 -0.07 0.00 -1.11 0.00 0.00 56.01 55.21 1nrz n LEU 117 Cb 0.42 -0.95 0.01 0.00 0.53 0.00 0.00 43.42 43.42 1nrz n LEU 117 CO 0.59 0.56 0.55 0.28 -1.11 0.00 0.00 177.39 178.26 1nrz s THR 118 N -2.46 0.00 0.32 1.96 -1.32 -1.02 -5.04 115.64 108.08 1nrz s THR 118 Ca -0.31 -0.94 -0.29 0.00 -1.21 0.00 0.00 61.69 58.94 1nrz s THR 118 Cb 0.09 -2.50 -0.12 0.00 -1.51 0.00 0.00 72.50 68.45 1nrz s THR 118 CO 0.60 0.00 1.33 1.17 -2.21 0.00 0.00 174.62 175.51 1nrz n LYS 119 N -0.52 2.14 0.00 7.08 4.81 -1.26 -1.96 118.16 128.45 1nrz n LYS 119 Ca -0.06 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 1nrz n LYS 119 Cb 0.60 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.28 1nrz n LYS 119 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nrz n ALA 120 N 0.78 0.00 -3.74 3.14 0.00 -1.26 -4.96 120.51 114.46 1nrz n ALA 120 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.25 1nrz n ALA 120 Cb 0.35 -0.01 -0.17 0.00 0.00 0.00 0.00 19.45 19.62 1nrz n ALA 120 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nrz s VAL 121 N -1.62 0.99 0.02 0.00 1.01 -0.83 -0.54 120.40 119.43 1nrz s VAL 121 Ca 0.00 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1nrz s VAL 121 Cb 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 1nrz s VAL 121 CO 0.00 0.35 -0.14 -0.44 0.00 0.00 0.00 175.10 174.87 1nrz s SER 122 N 1.35 1.64 0.05 3.32 0.01 -0.44 -0.68 113.70 118.95 1nrz s SER 122 Ca -0.02 -0.39 -0.00 0.00 1.31 0.00 0.00 55.95 56.85 1nrz s SER 122 Cb -0.14 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 1nrz s SER 122 CO -0.04 0.08 -0.04 -0.76 0.41 0.00 0.00 173.24 172.89 1nrz s LEU 123 N -0.87 2.46 0.41 2.44 1.43 -0.39 -4.73 118.68 119.43 1nrz s LEU 123 Ca 0.03 -0.93 0.07 0.00 -1.03 0.00 0.00 54.13 52.27 1nrz s LEU 123 Cb -0.07 0.13 -0.07 0.00 0.03 0.00 0.00 46.19 46.21 1nrz s LEU 123 CO 0.01 -0.53 0.04 1.51 0.23 0.00 0.00 176.35 177.61 1nrz s ASP 124 N -2.72 3.98 0.46 2.29 1.47 -1.26 -0.39 116.67 120.50 1nrz s ASP 124 Ca 0.04 -1.32 0.17 0.00 1.18 0.00 0.00 52.55 52.63 1nrz s ASP 124 Cb 0.05 -0.41 1.15 0.00 -0.34 0.00 0.00 42.92 43.37 1nrz s ASP 124 CO -0.08 -0.47 1.98 -0.65 0.68 0.00 0.00 175.17 176.64 1nrz h PRO 125 N 1.71 0.26 -0.09 2.11 0.11 -2.00 -1.80 132.00 132.30 1nrz h PRO 125 Ca -0.44 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.49 1nrz h PRO 125 Cb 1.24 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1nrz h PRO 125 CO 0.79 0.18 -0.67 1.96 -0.21 0.00 0.00 178.00 180.05 1nrz h GLN 126 N 0.27 0.36 -0.28 1.05 7.50 -1.99 -0.62 115.11 121.41 1nrz h GLN 126 Ca 0.27 -0.27 -0.00 0.00 0.50 0.00 0.00 58.65 59.15 1nrz h GLN 126 Cb 0.70 0.05 -0.01 0.00 0.05 0.00 0.00 27.48 28.26 1nrz h GLN 126 CO -0.06 0.90 0.17 -0.44 -1.50 0.00 0.00 178.83 177.90 1nrz h ASP 127 N 0.26 0.34 -0.55 1.46 3.32 -1.75 -1.41 116.42 118.09 1nrz h ASP 127 Ca -0.02 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1nrz h ASP 127 Cb 1.22 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 1nrz h ASP 127 CO 0.11 0.29 0.22 0.40 -1.72 0.00 0.00 179.24 178.54 1nrz h ILE 128 N 0.36 1.22 -0.83 0.35 2.04 -1.26 -1.38 117.51 118.00 1nrz h ILE 128 Ca 0.10 -0.68 0.07 0.00 1.00 0.00 0.00 64.86 65.35 1nrz h ILE 128 Cb 0.01 0.65 -0.06 0.00 -0.74 0.00 0.00 36.82 36.68 1nrz h ILE 128 CO -0.02 0.26 0.51 1.56 0.00 0.00 0.00 178.15 180.46 1nrz h GLN 129 N 0.74 0.88 -0.43 2.37 4.20 -0.91 -0.08 115.11 121.87 1nrz h GLN 129 Ca 0.18 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.81 1nrz h GLN 129 Cb 0.20 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1nrz h GLN 129 CO -0.02 0.58 0.16 0.00 -0.67 0.00 0.00 178.83 178.88 1nrz h ALA 130 N 1.41 0.57 -0.92 3.87 0.00 -0.55 -0.80 119.26 122.84 1nrz h ALA 130 Ca 0.37 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1nrz h ALA 130 Cb 0.22 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1nrz h ALA 130 CO -0.19 0.19 0.58 0.74 0.00 0.00 0.00 179.25 180.58 1nrz h PHE 131 N 0.56 1.18 -0.58 0.00 0.04 -0.67 -0.52 116.94 116.95 1nrz h PHE 131 Ca 0.14 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.87 1nrz h PHE 131 Cb 0.22 -0.39 -0.03 0.00 2.20 0.00 0.00 35.95 37.95 1nrz h PHE 131 CO 0.01 0.76 0.14 0.00 -0.60 0.00 0.00 178.31 178.62 1nrz h ARG 132 N 1.25 0.90 -0.25 1.51 3.08 -0.36 -0.83 114.38 119.68 1nrz h ARG 132 Ca 0.33 -0.19 -0.16 0.00 0.07 0.00 0.00 59.98 60.03 1nrz h ARG 132 Cb -0.10 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.81 1nrz h ARG 132 CO -0.07 0.81 -0.51 0.93 -1.07 0.00 0.00 179.97 180.06 1nrz h GLU 133 N 0.87 0.71 -0.73 0.04 4.39 -0.65 -1.41 114.58 117.79 1nrz h GLU 133 Ca 0.19 -0.42 -0.02 0.00 0.34 0.00 0.00 59.36 59.45 1nrz h GLU 133 Cb 0.32 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1nrz h GLU 133 CO -0.00 1.04 0.39 -0.07 -1.16 0.00 0.00 179.01 179.21 1nrz h LEU 134 N 0.55 0.93 -0.72 1.33 3.38 -0.73 -1.95 115.31 118.10 1nrz h LEU 134 Ca 0.02 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1nrz h LEU 134 Cb 1.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1nrz h LEU 134 CO 0.11 0.77 -0.03 -0.78 0.09 0.00 0.00 178.44 178.60 1nrz h ASP 135 N 1.01 0.94 0.15 -0.43 3.58 -0.98 -0.94 116.42 119.76 1nrz h ASP 135 Ca 0.26 -0.27 -0.03 0.00 0.42 0.00 0.00 57.03 57.41 1nrz h ASP 135 Cb 0.06 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 40.85 1nrz h ASP 135 CO -0.04 1.01 -0.15 0.11 -2.88 0.00 0.00 179.24 177.29 1nrz h LYS 136 N 0.87 0.00 -0.00 0.28 1.57 -0.88 -1.22 116.57 117.18 1nrz h LYS 136 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1nrz h LYS 136 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1nrz h LYS 136 CO 0.03 0.15 -0.01 1.28 -0.57 0.00 0.00 179.45 180.32 1nrz n LEU 137 N -4.34 0.44 0.00 2.94 4.77 -0.77 -4.90 117.00 115.14 1nrz n LEU 137 Ca -0.03 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1nrz n LEU 137 Cb 0.22 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1nrz n LEU 137 CO 0.36 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1nrz n GLY 138 N 1.10 0.70 3.68 -0.72 0.00 -0.46 -5.04 105.19 104.44 1nrz n GLY 138 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1nrz n GLY 138 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nrz s VAL 139 N -2.34 4.15 0.15 1.61 1.01 -0.42 -4.92 120.40 119.64 1nrz s VAL 139 Ca 0.00 1.47 -0.30 0.00 0.00 0.00 0.00 61.98 63.15 1nrz s VAL 139 Cb 0.00 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 32.36 1nrz s VAL 139 CO 0.00 -0.03 1.07 -0.54 0.00 0.00 0.00 175.10 175.61 1nrz s LYS 140 N 2.52 4.60 -0.36 2.72 1.02 -0.38 -4.15 119.74 125.72 1nrz s LYS 140 Ca 0.57 1.65 -0.05 0.00 0.02 0.00 0.00 55.97 58.16 1nrz s LYS 140 Cb -0.25 -3.31 0.07 0.00 -0.52 0.00 0.00 37.83 33.81 1nrz s LYS 140 CO 0.21 0.07 0.14 -0.51 -0.92 0.00 0.00 175.35 174.35 1nrz s LEU 141 N -0.11 4.63 -0.55 3.17 1.43 -1.26 -0.19 118.68 125.80 1nrz s LEU 141 Ca 0.50 -1.46 -0.09 0.00 -1.03 0.00 0.00 54.13 52.05 1nrz s LEU 141 Cb -0.28 -1.85 0.14 0.00 0.03 0.00 0.00 46.19 44.24 1nrz s LEU 141 CO 0.33 -0.41 0.43 -0.62 0.23 0.00 0.00 176.35 176.31 1nrz s ASP 142 N 1.63 5.78 -0.61 2.29 2.15 0.01 -3.32 116.67 124.60 1nrz s ASP 142 Ca 0.01 -2.21 -0.26 0.00 0.43 0.00 0.00 52.55 50.53 1nrz s ASP 142 Cb -0.21 -2.01 0.04 0.00 -0.30 0.00 0.00 42.92 40.44 1nrz s ASP 142 CO 0.00 -0.62 1.08 -0.22 -0.17 0.00 0.00 175.17 175.24 1nrz s LEU 143 N 0.92 3.78 -0.21 -1.34 2.96 0.10 -0.53 118.68 124.36 1nrz s LEU 143 Ca 0.10 -0.34 -0.11 0.00 -0.22 0.00 0.00 54.13 53.56 1nrz s LEU 143 Cb -0.23 -2.81 0.08 0.00 0.50 0.00 0.00 46.19 43.73 1nrz s LEU 143 CO -0.02 -1.45 0.51 0.00 -1.32 0.00 0.00 176.35 174.06 1nrz s ARG 144 N 4.59 0.48 -0.03 1.98 1.70 -0.66 -2.02 118.95 124.99 1nrz s ARG 144 Ca 0.33 1.00 -0.24 0.00 -0.47 0.00 0.00 55.73 56.35 1nrz s ARG 144 Cb -0.11 0.14 -0.18 0.00 -0.57 0.00 0.00 34.95 34.23 1nrz s ARG 144 CO 0.19 -0.17 1.11 0.28 -1.08 0.00 0.00 175.30 175.62 1nrz h VAL 145 N 5.53 1.10 -3.35 4.99 2.07 -1.78 -3.37 116.25 121.44 1nrz h VAL 145 Ca -0.30 -1.09 -0.65 0.00 0.82 0.00 0.00 66.70 65.48 1nrz h VAL 145 Cb 1.18 1.76 -0.15 0.00 -1.52 0.00 0.00 31.29 32.56 1nrz h VAL 145 CO 0.22 0.25 -0.73 0.68 0.02 0.00 0.00 177.57 178.00 1nrz s VAL 146 N -3.96 3.30 0.37 2.57 -7.23 -1.26 -4.88 120.40 109.31 1nrz s VAL 146 Ca -0.15 -1.42 0.09 0.00 -1.81 0.00 0.00 61.98 58.69 1nrz s VAL 146 Cb 0.01 -2.58 0.32 0.00 0.56 0.00 0.00 36.38 34.69 1nrz s VAL 146 CO 0.58 0.02 1.92 0.00 -0.31 0.00 0.00 175.10 177.32 1nrz h ALA 147 N 3.33 1.83 0.00 1.32 0.00 -1.92 -1.40 119.26 122.42 1nrz h ALA 147 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1nrz h ALA 147 Cb 1.18 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1nrz h ALA 147 CO 0.53 -0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.64 1nrz n SER 148 N -4.51 0.35 -4.77 0.00 3.41 -1.26 -4.82 113.62 102.03 1nrz n SER 148 Ca 0.14 0.55 -0.36 0.00 -0.26 0.00 0.00 58.87 58.94 1nrz n SER 148 Cb 0.37 -0.64 0.01 0.00 -0.26 0.00 0.00 64.21 63.69 1nrz n SER 148 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1nrz s ASP 149 N -3.66 5.62 0.36 4.04 -0.00 -0.53 -4.98 116.67 117.52 1nrz s ASP 149 Ca 0.09 2.28 -0.28 0.00 -0.00 0.00 0.00 52.55 54.64 1nrz s ASP 149 Cb 0.13 -2.59 -0.10 0.00 -0.00 0.00 0.00 42.92 40.36 1nrz s ASP 149 CO 0.46 -1.30 1.38 -2.84 -0.00 0.00 0.00 175.17 172.87 1nrz s PRO 150 N -3.20 4.20 0.38 8.23 0.02 -1.26 -4.97 135.00 138.40 1nrz s PRO 150 Ca 0.73 2.35 -0.25 0.00 0.02 0.00 0.00 61.00 63.85 1nrz s PRO 150 Cb -0.27 -2.99 -0.09 0.00 0.02 0.00 0.00 34.50 31.17 1nrz s PRO 150 CO 0.30 -0.37 1.06 0.45 -0.33 0.00 0.00 177.00 178.11 1nrz s SER 151 N -0.39 6.85 -0.04 2.53 0.15 -1.26 -4.79 113.70 116.76 1nrz s SER 151 Ca 0.52 2.08 0.05 0.00 0.70 0.00 0.00 55.95 59.30 1nrz s SER 151 Cb -0.42 -2.59 -0.01 0.00 -1.71 0.00 0.00 66.02 61.29 1nrz s SER 151 CO 0.56 -0.43 -0.17 -0.69 1.20 0.00 0.00 173.24 173.71 1nrz s VAL 152 N -1.56 1.43 -0.33 4.45 1.01 -0.86 -4.95 120.40 119.60 1nrz s VAL 152 Ca 0.55 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 1nrz s VAL 152 Cb -0.24 -1.22 0.01 0.00 0.00 0.00 0.00 36.38 34.93 1nrz s VAL 152 CO 0.30 0.41 1.20 0.21 0.00 0.00 0.00 175.10 177.23 1nrz s ASN 153 N -0.07 6.75 0.33 3.32 3.04 -1.26 0.01 114.94 127.06 1nrz s ASN 153 Ca -0.01 1.06 0.02 0.00 0.04 0.00 0.00 52.86 53.96 1nrz s ASN 153 Cb -0.10 -2.54 0.58 0.00 -1.54 0.00 0.00 41.25 37.64 1nrz s ASN 153 CO 0.01 -1.04 1.94 -0.29 -3.04 0.00 0.00 177.10 174.69 1nrz h ILE 154 N 5.92 1.18 -0.40 -5.21 2.10 -1.94 -1.94 117.51 117.23 1nrz h ILE 154 Ca -0.24 -0.50 -0.11 0.00 1.08 0.00 0.00 64.86 65.09 1nrz h ILE 154 Cb 1.08 0.46 -0.01 0.00 -1.09 0.00 0.00 36.82 37.25 1nrz h ILE 154 CO 1.05 0.21 -0.20 -0.07 -1.08 0.00 0.00 178.15 178.05 1nrz h LEU 155 N 0.78 0.78 -0.87 2.19 3.38 -1.91 -0.38 115.31 119.28 1nrz h LEU 155 Ca 0.20 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1nrz h LEU 155 Cb 0.07 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1nrz h LEU 155 CO -0.03 0.97 0.41 0.44 0.09 0.00 0.00 178.44 180.32 1nrz h ASP 156 N 0.68 1.11 -0.33 -0.43 3.32 -1.82 0.90 116.42 119.85 1nrz h ASP 156 Ca 0.10 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 1nrz h ASP 156 Cb 0.71 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1nrz h ASP 156 CO 0.05 0.93 0.02 0.50 -1.72 0.00 0.00 179.24 179.03 1nrz h LYS 157 N 1.21 0.56 -0.23 3.56 1.63 -0.89 -2.62 116.57 119.79 1nrz h LYS 157 Ca 0.29 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1nrz h LYS 157 Cb 0.12 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.68 1nrz h LYS 157 CO -0.04 0.67 0.12 0.82 -3.45 0.00 0.00 179.45 177.58 1nrz h ILE 158 N 0.37 1.11 -0.01 2.00 2.04 -0.88 -2.91 117.51 119.24 1nrz h ILE 158 Ca 0.10 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1nrz h ILE 158 Cb 0.40 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1nrz h ILE 158 CO 0.01 0.11 0.02 0.78 0.00 0.00 0.00 178.15 179.07 1nrz h ASN 159 N 0.26 0.00 0.03 1.72 2.35 -0.71 -2.45 115.58 116.78 1nrz h ASN 159 Ca 0.08 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1nrz h ASN 159 Cb 0.06 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1nrz h ASN 159 CO -0.01 0.00 -0.03 -0.33 -1.65 0.00 0.00 177.43 175.41 1nrz h GLU 160 N 0.00 0.00 0.00 0.81 5.08 -1.26 -3.24 114.58 115.97 1nrz h GLU 160 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nrz h GLU 160 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1nrz h GLU 160 CO -0.00 0.03 0.00 0.25 -1.00 0.00 0.00 179.01 178.29 1nrz n THR 161 N -4.41 0.00 -3.96 1.13 -2.24 -0.95 -5.08 114.28 98.77 1nrz n THR 161 Ca -0.03 -0.39 -0.09 0.00 -2.27 0.00 0.00 64.05 61.27 1nrz n THR 161 Cb 0.11 1.21 -0.10 0.00 -2.10 0.00 0.00 70.33 69.46 1nrz n THR 161 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nrz s ALA 162 N -0.00 0.04 0.45 6.98 0.00 -1.02 -5.16 121.76 123.04 1nrz s ALA 162 Ca 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 51.96 51.21 1nrz s ALA 162 Cb 0.00 0.25 -0.06 0.00 0.00 0.00 0.00 23.12 23.31 1nrz s ALA 162 CO 0.00 -0.31 0.80 -0.06 0.00 0.00 0.00 175.76 176.19 1nrz s PHE 163 N -2.70 3.51 0.00 0.00 0.40 -1.26 -4.42 117.98 113.50 1nrz s PHE 163 Ca -0.04 1.02 0.00 0.00 -0.60 0.00 0.00 56.93 57.31 1nrz s PHE 163 Cb -0.01 -2.44 0.00 0.00 0.51 0.00 0.00 43.02 41.08 1nrz s PHE 163 CO -0.05 -0.21 0.00 0.00 0.70 0.00 0.00 175.22 175.66