#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntr n GLN 2 N 0.00 -3.53 -2.56 0.03 7.27 0.23 -4.98 117.38 113.84 1ntr n GLN 2 Ca 0.00 2.55 -0.04 0.00 0.07 0.00 0.00 57.00 59.58 1ntr n GLN 2 Cb 0.00 -2.80 0.08 0.00 2.41 0.00 0.00 30.24 29.93 1ntr n GLN 2 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1ntr n ARG 3 N 0.22 0.89 0.00 3.69 1.74 -1.08 -4.90 116.66 117.22 1ntr n ARG 3 Ca 0.00 -1.23 0.00 0.00 -0.77 0.00 0.00 57.85 55.85 1ntr n ARG 3 Cb 0.00 0.09 0.00 0.00 -1.02 0.00 0.00 32.46 31.53 1ntr n ARG 3 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ntr n GLY 4 N -0.75 2.11 2.70 -0.13 0.00 -1.26 -4.88 105.19 102.98 1ntr n GLY 4 Ca -0.12 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.64 1ntr n GLY 4 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ntr s ILE 5 N -2.00 -0.29 -0.21 -0.61 -4.36 -1.26 -0.94 121.20 111.53 1ntr s ILE 5 Ca 0.00 -0.38 0.02 0.00 -0.26 0.00 0.00 60.65 60.02 1ntr s ILE 5 Cb 0.00 -0.85 0.04 0.00 1.25 0.00 0.00 42.46 42.90 1ntr s ILE 5 CO 0.00 -0.41 -0.15 -0.69 0.24 0.00 0.00 174.94 173.93 1ntr s VAL 6 N 2.28 2.01 -1.11 8.37 1.01 -0.85 -1.85 120.40 130.27 1ntr s VAL 6 Ca 0.08 -1.16 -0.09 0.00 0.00 0.00 0.00 61.98 60.80 1ntr s VAL 6 Cb -0.15 -1.96 0.27 0.00 0.00 0.00 0.00 36.38 34.55 1ntr s VAL 6 CO -0.25 0.30 1.12 0.86 0.00 0.00 0.00 175.10 177.13 1ntr s TRP 7 N 1.25 4.24 0.28 5.22 -0.11 -1.01 -0.03 118.94 128.77 1ntr s TRP 7 Ca -0.00 -2.66 -0.29 0.00 1.22 0.00 0.00 56.10 54.36 1ntr s TRP 7 Cb -0.16 -3.86 -0.10 0.00 -1.50 0.00 0.00 33.47 27.86 1ntr s TRP 7 CO -0.10 -0.97 1.30 0.08 -4.62 0.00 0.00 176.95 172.65 1ntr s VAL 8 N -1.13 2.92 -0.49 5.86 1.01 -0.42 -2.29 120.40 125.87 1ntr s VAL 8 Ca 0.31 0.86 -0.25 0.00 0.00 0.00 0.00 61.98 62.90 1ntr s VAL 8 Cb -0.10 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1ntr s VAL 8 CO -0.08 0.17 0.92 -0.69 0.00 0.00 0.00 175.10 175.43 1ntr s VAL 9 N -0.64 4.46 0.15 2.92 1.01 -0.59 -2.15 120.40 125.55 1ntr s VAL 9 Ca 0.52 0.59 -0.01 0.00 0.00 0.00 0.00 61.98 63.07 1ntr s VAL 9 Cb -0.38 -4.46 0.03 0.00 0.00 0.00 0.00 36.38 31.57 1ntr s VAL 9 CO 0.46 -0.91 0.20 0.47 0.00 0.00 0.00 175.10 175.32 1ntr n ASP 10 N 7.23 0.14 0.00 3.32 8.00 -0.03 -1.62 116.55 133.60 1ntr n ASP 10 Ca 0.05 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.39 1ntr n ASP 10 Cb 0.48 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1ntr n ASP 10 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ntr n ASP 11 N -3.05 0.00 -4.78 -2.24 9.92 -1.26 -4.29 116.55 110.84 1ntr n ASP 11 Ca 0.03 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 54.05 1ntr n ASP 11 Cb 0.10 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.52 1ntr n ASP 11 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1ntr s ASP 12 N -1.00 4.58 1.03 -2.24 1.11 -1.26 -4.38 116.67 114.51 1ntr s ASP 12 Ca 0.00 -1.02 -0.17 0.00 0.18 0.00 0.00 52.55 51.54 1ntr s ASP 12 Cb 0.00 -0.43 0.02 0.00 1.07 0.00 0.00 42.92 43.58 1ntr s ASP 12 CO 0.00 -0.61 -0.09 -1.54 1.18 0.00 0.00 175.17 174.10 1ntr n SER 13 N -1.35 -2.77 0.00 0.27 3.41 -1.26 -2.37 113.62 109.56 1ntr n SER 13 Ca -0.00 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1ntr n SER 13 Cb 0.64 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1ntr n SER 13 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ntr n SER 14 N -0.40 0.00 -0.03 4.04 7.64 -1.26 -4.78 113.62 118.83 1ntr n SER 14 Ca 0.02 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.74 1ntr n SER 14 Cb 0.59 -0.02 -0.14 0.00 -1.01 0.00 0.00 64.21 63.63 1ntr n SER 14 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1ntr n ILE 15 N -2.00 1.66 0.09 0.44 2.08 -1.00 -3.75 119.36 116.88 1ntr n ILE 15 Ca 0.00 -0.69 0.00 0.00 0.56 0.00 0.00 62.75 62.62 1ntr n ILE 15 Cb 0.00 -1.41 0.31 0.00 -0.75 0.00 0.00 39.64 37.79 1ntr n ILE 15 CO 0.00 0.00 0.00 0.08 0.56 0.00 0.00 176.55 177.19 1ntr h ARG 16 N 0.04 0.28 0.08 0.38 0.11 -1.84 -2.85 114.38 110.58 1ntr h ARG 16 Ca -0.43 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 59.56 1ntr h ARG 16 Cb 2.02 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 33.06 1ntr h ARG 16 CO 0.05 0.50 -0.19 2.35 0.10 0.00 0.00 179.97 182.78 1ntr h TRP 17 N 0.26 -0.56 -0.83 4.08 2.91 -1.92 -1.52 115.95 118.37 1ntr h TRP 17 Ca 0.04 0.01 0.14 0.00 1.13 0.00 0.00 58.89 60.22 1ntr h TRP 17 Cb 0.55 0.23 -0.14 0.00 -0.51 0.00 0.00 29.16 29.29 1ntr h TRP 17 CO 0.01 -0.23 -0.34 0.28 -1.03 0.00 0.00 178.44 177.13 1ntr h VAL 18 N -0.30 0.08 0.00 2.65 2.07 -1.60 -2.31 116.25 116.84 1ntr h VAL 18 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1ntr h VAL 18 Cb 0.29 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1ntr h VAL 18 CO -0.08 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.69 1ntr n LEU 19 N -5.47 0.00 -0.55 2.57 7.99 -0.87 -1.29 117.00 119.39 1ntr n LEU 19 Ca 0.09 0.58 0.41 0.00 -0.01 0.00 0.00 56.01 57.07 1ntr n LEU 19 Cb 0.39 -0.08 0.63 0.00 -0.11 0.00 0.00 43.42 44.26 1ntr n LEU 19 CO -0.07 -0.08 1.14 -0.62 -1.51 0.00 0.00 177.39 176.25 1ntr n GLU 20 N -1.03 -0.00 0.31 3.23 1.02 -0.63 0.93 120.64 124.47 1ntr n GLU 20 Ca 0.00 0.84 -0.16 0.00 -0.02 0.00 0.00 57.16 57.82 1ntr n GLU 20 Cb 0.00 -1.94 -0.08 0.00 -0.02 0.00 0.00 31.44 29.40 1ntr n GLU 20 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ntr h ARG 21 N 0.00 -0.73 0.00 3.49 -0.00 -0.63 -1.24 114.38 115.27 1ntr h ARG 21 Ca 0.73 0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 60.25 1ntr h ARG 21 Cb 2.90 0.17 -0.00 0.00 0.00 0.00 0.00 29.97 33.04 1ntr h ARG 21 CO -0.02 -0.44 -0.01 0.00 0.00 0.00 0.00 179.97 179.49 1ntr h ALA 22 N -0.52 1.06 0.00 0.04 0.00 0.82 -0.94 119.26 119.72 1ntr h ALA 22 Ca -0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1ntr h ALA 22 Cb 0.63 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1ntr h ALA 22 CO 0.13 0.02 -0.33 1.25 0.00 0.00 0.00 179.25 180.32 1ntr h LEU 23 N 0.00 0.00 -1.03 0.00 5.85 -0.28 -2.94 115.31 116.91 1ntr h LEU 23 Ca -0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 1ntr h LEU 23 Cb 0.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1ntr h LEU 23 CO 0.00 0.33 -0.33 0.00 -0.34 0.00 0.00 178.44 178.09 1ntr h ALA 24 N 1.67 1.18 -0.41 1.25 0.00 -0.06 0.37 119.26 123.27 1ntr h ALA 24 Ca -0.00 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 1ntr h ALA 24 Cb 0.83 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1ntr h ALA 24 CO 0.04 0.54 -0.25 0.78 0.00 0.00 0.00 179.25 180.36 1ntr h GLY 25 N 1.10 0.93 1.48 0.00 0.00 -1.62 -2.59 103.07 102.37 1ntr h GLY 25 Ca 0.03 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.53 1ntr h GLY 25 CO 0.05 0.75 -0.35 0.00 0.00 0.00 0.00 176.54 177.00 1ntr n ALA 26 N -2.51 2.77 -3.23 3.60 0.00 -1.02 -4.97 120.51 115.14 1ntr n ALA 26 Ca -0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.15 1ntr n ALA 26 Cb 0.46 -1.29 0.03 0.00 0.00 0.00 0.00 19.45 18.65 1ntr n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ntr n GLY 27 N 1.38 -1.20 2.51 0.00 0.00 0.13 -4.67 105.19 103.34 1ntr n GLY 27 Ca 0.05 0.52 -0.17 0.00 0.00 0.00 0.00 46.02 46.42 1ntr n GLY 27 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ntr n LEU 28 N -2.57 0.00 -2.87 0.99 7.94 -1.10 0.76 117.00 120.14 1ntr n LEU 28 Ca -0.05 -2.43 -0.37 0.00 -1.11 0.00 0.00 56.01 52.05 1ntr n LEU 28 Cb 0.56 1.10 0.03 0.00 0.53 0.00 0.00 43.42 45.64 1ntr n LEU 28 CO 0.57 -0.39 1.21 0.41 -1.11 0.00 0.00 177.39 178.08 1ntr n THR 29 N -0.57 3.50 -2.52 1.96 -1.04 -0.11 -4.85 114.28 110.64 1ntr n THR 29 Ca 0.02 -4.59 -0.40 0.00 -2.04 0.00 0.00 64.05 57.03 1ntr n THR 29 Cb 0.47 -1.27 -0.02 0.00 -1.82 0.00 0.00 70.33 67.68 1ntr n THR 29 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ntr s THR 31 N 5.29 2.28 -0.15 0.00 2.01 0.95 -4.23 115.64 121.79 1ntr s THR 31 Ca 0.50 -0.29 -0.20 0.00 0.31 0.00 0.00 61.69 62.01 1ntr s THR 31 Cb 0.01 -2.99 0.05 0.00 0.01 0.00 0.00 72.50 69.58 1ntr s THR 31 CO -0.04 0.00 0.53 0.42 -0.69 0.00 0.00 174.62 174.85 1ntr s THR 32 N -3.23 0.01 0.00 -0.82 -4.23 -1.26 -1.30 115.64 104.81 1ntr s THR 32 Ca 0.60 -0.07 0.00 0.00 -1.18 0.00 0.00 61.69 61.04 1ntr s THR 32 Cb -0.10 -0.78 0.00 0.00 1.34 0.00 0.00 72.50 72.95 1ntr s THR 32 CO 0.45 -0.04 0.00 0.49 -0.54 0.00 0.00 174.62 174.98 1ntr n PHE 33 N 2.24 -0.21 0.23 3.99 3.72 -0.92 -4.69 117.46 121.83 1ntr n PHE 33 Ca -0.16 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.27 1ntr n PHE 33 Cb 0.56 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.12 1ntr n PHE 33 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1ntr n GLU 34 N -0.07 0.73 -3.95 -1.08 0.28 -1.26 -0.85 120.64 114.44 1ntr n GLU 34 Ca 0.00 -0.69 -0.19 0.00 -0.16 0.00 0.00 57.16 56.12 1ntr n GLU 34 Cb 0.00 -1.04 -0.17 0.00 1.43 0.00 0.00 31.44 31.66 1ntr n GLU 34 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1ntr s ASN 35 N -0.63 0.82 0.19 -1.84 -0.87 -1.26 -4.51 114.94 106.85 1ntr s ASN 35 Ca 0.06 -0.06 -0.16 0.00 -1.57 0.00 0.00 52.86 51.13 1ntr s ASN 35 Cb 0.04 -0.32 0.16 0.00 -0.02 0.00 0.00 41.25 41.12 1ntr s ASN 35 CO 0.09 -0.11 1.63 1.23 -2.57 0.00 0.00 177.10 177.37 1ntr h GLY 36 N 7.50 0.29 0.58 0.66 0.00 -1.92 -2.19 103.07 107.99 1ntr h GLY 36 Ca -0.35 0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 1ntr h GLY 36 CO 0.41 -0.21 -0.31 -0.57 0.00 0.00 0.00 176.54 175.86 1ntr h ASN 37 N -0.04 -0.77 -1.32 0.19 -1.24 -1.94 -2.10 115.58 108.35 1ntr h ASN 37 Ca 0.25 0.04 0.40 0.00 0.71 0.00 0.00 56.30 57.69 1ntr h ASN 37 Cb 0.42 0.21 -0.07 0.00 0.73 0.00 0.00 38.32 39.62 1ntr h ASN 37 CO -0.56 -0.51 0.93 1.21 -1.29 0.00 0.00 177.43 177.22 1ntr n GLU 38 N -4.34 -0.01 0.06 6.67 2.13 -0.88 -0.42 120.64 123.86 1ntr n GLU 38 Ca -0.10 0.82 -0.03 0.00 0.66 0.00 0.00 57.16 58.51 1ntr n GLU 38 Cb 0.33 -1.81 -0.01 0.00 0.27 0.00 0.00 31.44 30.22 1ntr n GLU 38 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1ntr h VAL 39 N 0.00 0.00 0.00 6.31 2.07 -0.80 -1.23 116.25 122.60 1ntr h VAL 39 Ca 0.67 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.83 1ntr h VAL 39 Cb 2.57 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1ntr h VAL 39 CO -0.09 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.51 1ntr n LEU 40 N -3.52 0.53 0.08 2.57 -0.00 0.43 -0.89 117.00 116.19 1ntr n LEU 40 Ca -0.02 0.74 -0.23 0.00 -0.00 0.00 0.00 56.01 56.50 1ntr n LEU 40 Cb 0.07 -0.81 -0.15 0.00 -0.00 0.00 0.00 43.42 42.54 1ntr n LEU 40 CO 0.06 -0.92 -0.51 0.00 -0.00 0.00 0.00 177.39 176.01 1ntr h ALA 41 N 1.97 0.15 -0.98 1.47 0.00 -0.75 -3.22 119.26 117.90 1ntr h ALA 41 Ca 0.00 -1.13 0.07 0.00 0.00 0.00 0.00 54.91 53.85 1ntr h ALA 41 Cb 0.02 0.43 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 1ntr h ALA 41 CO 0.00 1.02 0.63 0.00 0.00 0.00 0.00 179.25 180.90 1ntr h ALA 42 N 0.15 1.46 -3.00 0.00 0.00 0.26 -3.32 119.26 114.81 1ntr h ALA 42 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ntr h ALA 42 Cb 2.10 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1ntr h ALA 42 CO 0.18 0.38 0.00 1.28 0.00 0.00 0.00 179.25 181.09 1ntr n LEU 43 N -4.51 0.00 0.00 0.00 4.32 -1.05 -4.80 117.00 110.95 1ntr n LEU 43 Ca 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.14 1ntr n LEU 43 Cb 0.22 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.02 1ntr n LEU 43 CO 0.32 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.49 1ntr n ALA 44 N -3.00 0.00 -0.11 -1.18 0.00 -1.22 -4.03 120.51 110.97 1ntr n ALA 44 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1ntr n ALA 44 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1ntr n ALA 44 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ntr n SER 45 N 3.87 1.86 0.00 0.00 3.41 -1.26 -4.58 113.62 116.92 1ntr n SER 45 Ca 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1ntr n SER 45 Cb 0.00 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 1ntr n SER 45 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ntr n LYS 46 N -3.06 0.00 0.00 4.33 5.02 -1.26 -4.67 118.16 118.52 1ntr n LYS 46 Ca -0.38 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 1ntr n LYS 46 Cb 0.97 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.98 1ntr n LYS 46 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1ntr n THR 47 N 0.00 0.00 -0.32 -0.18 -1.04 -1.26 -5.03 114.28 106.44 1ntr n THR 47 Ca 0.00 0.27 0.00 0.00 -2.04 0.00 0.00 64.05 62.28 1ntr n THR 47 Cb 0.00 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.24 1ntr n THR 47 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1ntr n PRO 48 N -2.04 0.91 -0.00 -2.82 -0.04 -1.26 -5.00 135.00 124.74 1ntr n PRO 48 Ca 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 1ntr n PRO 48 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 1ntr n PRO 48 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ntr n ASP 49 N -0.61 0.97 -3.66 3.54 5.68 -0.77 -4.96 116.55 116.74 1ntr n ASP 49 Ca 0.00 -0.52 -0.06 0.00 -0.50 0.00 0.00 54.79 53.71 1ntr n ASP 49 Cb 0.00 1.07 -0.07 0.00 -1.14 0.00 0.00 41.12 40.97 1ntr n ASP 49 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1ntr s VAL 50 N -1.84 -0.66 -0.14 2.12 1.01 -0.83 -4.29 120.40 115.77 1ntr s VAL 50 Ca 0.02 0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.00 1ntr s VAL 50 Cb 0.05 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 1ntr s VAL 50 CO 0.29 0.04 0.16 -0.22 0.00 0.00 0.00 175.10 175.36 1ntr s LEU 51 N 2.52 4.32 0.47 3.92 2.96 -1.05 -2.41 118.68 129.41 1ntr s LEU 51 Ca -0.05 0.41 0.05 0.00 -0.22 0.00 0.00 54.13 54.32 1ntr s LEU 51 Cb -0.11 -2.11 -0.03 0.00 0.50 0.00 0.00 46.19 44.43 1ntr s LEU 51 CO -0.16 0.31 0.10 -0.76 -1.32 0.00 0.00 176.35 174.53 1ntr s LEU 52 N -0.48 2.70 -0.13 -0.68 1.43 -0.97 -1.05 118.68 119.51 1ntr s LEU 52 Ca 0.13 -1.38 -0.09 0.00 -1.03 0.00 0.00 54.13 51.76 1ntr s LEU 52 Cb -0.12 -1.01 0.04 0.00 0.03 0.00 0.00 46.19 45.14 1ntr s LEU 52 CO 0.02 -0.71 0.33 -0.94 0.23 0.00 0.00 176.35 175.28 1ntr s SER 53 N -3.90 -0.37 0.00 2.29 1.04 -0.41 -1.55 113.70 110.81 1ntr s SER 53 Ca 0.26 0.69 0.23 0.00 0.48 0.00 0.00 55.95 57.60 1ntr s SER 53 Cb 0.04 0.62 0.53 0.00 0.10 0.00 0.00 66.02 67.31 1ntr s SER 53 CO 0.14 -0.15 1.45 0.47 0.98 0.00 0.00 173.24 176.13 1ntr n ASP 54 N 3.71 2.70 -2.02 7.02 8.00 -0.64 -1.58 116.55 133.75 1ntr n ASP 54 Ca -0.20 -1.88 -0.14 0.00 0.71 0.00 0.00 54.79 53.29 1ntr n ASP 54 Cb 0.56 -0.16 0.01 0.00 -0.02 0.00 0.00 41.12 41.51 1ntr n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ntr n ILE 55 N 1.02 -1.51 -2.74 0.53 3.06 -1.26 -4.78 119.36 113.68 1ntr n ILE 55 Ca 0.18 0.07 -0.06 0.00 -2.50 0.00 0.00 62.75 60.44 1ntr n ILE 55 Cb 0.50 -1.49 0.04 0.00 0.54 0.00 0.00 39.64 39.23 1ntr n ILE 55 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 1ntr n ARG 56 N 0.12 0.60 -4.68 9.51 0.63 -1.26 -5.00 116.66 116.58 1ntr n ARG 56 Ca -0.03 -1.66 -0.24 0.00 -0.92 0.00 0.00 57.85 55.00 1ntr n ARG 56 Cb 0.29 -1.25 -0.16 0.00 0.45 0.00 0.00 32.46 31.79 1ntr n ARG 56 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 1ntr s MET 57 N 0.71 1.42 -0.22 -0.14 -1.94 -1.26 -4.73 119.30 113.14 1ntr s MET 57 Ca 0.30 -0.51 -0.29 0.00 -1.71 0.00 0.00 55.69 53.49 1ntr s MET 57 Cb 0.15 -1.29 -0.04 0.00 2.01 0.00 0.00 34.83 35.67 1ntr s MET 57 CO -0.17 0.23 1.84 -1.25 -0.01 0.00 0.00 175.02 175.66 1ntr s PRO 58 N -0.01 3.56 0.00 2.03 0.04 -1.26 -4.82 135.00 134.54 1ntr s PRO 58 Ca -0.01 1.79 0.00 0.00 0.04 0.00 0.00 61.00 62.82 1ntr s PRO 58 Cb -0.09 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.28 1ntr s PRO 58 CO 0.01 -1.59 0.00 0.41 0.04 0.00 0.00 177.00 175.87 1ntr n GLY 59 N 5.10 1.16 0.07 0.56 0.00 -1.26 -5.04 105.19 105.78 1ntr n GLY 59 Ca 0.22 -0.65 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 1ntr n GLY 59 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ntr h MET 60 N 0.00 0.03 -5.27 1.61 2.86 -2.08 -3.47 114.93 108.62 1ntr h MET 60 Ca 0.00 -0.04 -0.67 0.00 -2.06 0.00 0.00 59.70 56.93 1ntr h MET 60 Cb 0.00 0.01 -0.13 0.00 0.06 0.00 0.00 31.60 31.54 1ntr h MET 60 CO 0.00 0.86 -0.53 -0.51 1.06 0.00 0.00 176.91 177.79 1ntr s ASP 61 N -6.11 4.06 0.00 1.22 1.11 -1.26 -5.10 116.67 110.59 1ntr s ASP 61 Ca -0.18 -1.61 0.00 0.00 0.18 0.00 0.00 52.55 50.94 1ntr s ASP 61 Cb -0.01 0.38 0.00 0.00 1.07 0.00 0.00 42.92 44.36 1ntr s ASP 61 CO 0.70 -0.79 0.00 0.61 1.18 0.00 0.00 175.17 176.87 1ntr n GLY 62 N -1.21 -1.58 0.00 0.21 0.00 -1.26 -4.86 105.19 96.50 1ntr n GLY 62 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1ntr n GLY 62 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ntr n LEU 63 N 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.45 117.00 112.28 1ntr n LEU 63 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1ntr n LEU 63 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1ntr n LEU 63 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.39 1ntr n ALA 64 N 0.00 0.00 -0.41 1.47 0.00 -1.26 -4.73 120.51 115.57 1ntr n ALA 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ntr n ALA 64 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1ntr n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ntr n LEU 65 N 0.00 0.00 -0.62 0.00 4.77 -1.26 -4.23 117.00 115.67 1ntr n LEU 65 Ca 0.00 0.00 0.46 0.00 -0.03 0.00 0.00 56.01 56.44 1ntr n LEU 65 Cb 0.00 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 41.80 1ntr n LEU 65 CO 0.00 0.00 1.30 0.18 -1.33 0.00 0.00 177.39 177.54 1ntr n LEU 66 N 0.00 0.00 0.22 2.23 7.99 -1.26 0.64 117.00 126.82 1ntr n LEU 66 Ca 0.00 0.86 -0.15 0.00 -0.01 0.00 0.00 56.01 56.72 1ntr n LEU 66 Cb 0.00 -0.43 -0.08 0.00 -0.11 0.00 0.00 43.42 42.80 1ntr n LEU 66 CO 0.00 -0.86 0.60 0.11 -1.51 0.00 0.00 177.39 175.73 1ntr h LYS 67 N 0.00 -0.53 -0.52 3.23 1.79 -1.80 -3.10 116.57 115.64 1ntr h LYS 67 Ca 0.82 0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 59.24 1ntr h LYS 67 Cb 3.30 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 34.05 1ntr h LYS 67 CO -0.01 -0.26 0.01 -0.56 -1.08 0.00 0.00 179.45 177.56 1ntr h GLN 68 N -0.75 0.91 -0.87 3.15 -0.00 -0.15 -2.84 115.11 114.56 1ntr h GLN 68 Ca -0.06 -0.28 0.08 0.00 -0.00 0.00 0.00 58.65 58.39 1ntr h GLN 68 Cb 0.52 -0.09 -0.11 0.00 -0.00 0.00 0.00 27.48 27.81 1ntr h GLN 68 CO 0.09 0.92 -0.51 -0.89 -0.00 0.00 0.00 178.83 178.45 1ntr n ILE 69 N -4.31 -0.59 0.06 1.86 5.41 -0.66 -0.93 119.36 120.20 1ntr n ILE 69 Ca 0.01 2.09 -0.13 0.00 1.00 0.00 0.00 62.75 65.73 1ntr n ILE 69 Cb 0.31 -2.59 -0.09 0.00 -0.71 0.00 0.00 39.64 36.56 1ntr n ILE 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1ntr h LYS 70 N 0.00 -0.14 -0.99 0.38 3.11 -1.53 0.11 116.57 117.52 1ntr h LYS 70 Ca 0.14 0.01 0.34 0.00 -2.81 0.00 0.00 60.65 58.34 1ntr h LYS 70 Cb 0.36 0.03 -0.10 0.00 -1.00 0.00 0.00 32.23 31.52 1ntr h LYS 70 CO -0.82 0.18 0.63 0.94 -2.81 0.00 0.00 179.45 177.57 1ntr n GLN 71 N -5.01 -0.03 -0.03 1.90 7.27 -0.10 -2.62 117.38 118.76 1ntr n GLN 71 Ca -0.09 0.92 -0.06 0.00 0.07 0.00 0.00 57.00 57.84 1ntr n GLN 71 Cb 0.20 -1.80 -0.02 0.00 2.41 0.00 0.00 30.24 31.04 1ntr n GLN 71 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1ntr n ARG 72 N -4.17 0.29 -1.29 3.69 3.00 -0.94 -5.01 116.66 112.22 1ntr n ARG 72 Ca 0.29 0.11 -0.42 0.00 -0.00 0.00 0.00 57.85 57.83 1ntr n ARG 72 Cb 1.13 -1.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.58 1ntr n ARG 72 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1ntr n HIS 73 N -3.98 -1.73 -1.18 -0.14 8.25 0.02 -4.75 115.22 111.70 1ntr n HIS 73 Ca -0.09 0.68 -0.19 0.00 -0.26 0.00 0.00 57.72 57.86 1ntr n HIS 73 Cb 0.31 -1.78 -0.06 0.00 1.12 0.00 0.00 29.99 29.58 1ntr n HIS 73 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1ntr n PRO 74 N 1.24 2.09 -2.32 -0.41 -0.04 -1.26 -4.69 135.00 129.61 1ntr n PRO 74 Ca 0.12 -1.69 -0.06 0.00 -0.04 0.00 0.00 63.50 61.83 1ntr n PRO 74 Cb 0.36 -1.92 0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1ntr n PRO 74 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1ntr n MET 75 N 1.22 -1.54 -4.90 0.54 2.81 -1.26 -5.04 117.12 108.95 1ntr n MET 75 Ca 0.40 0.33 -0.33 0.00 -1.81 0.00 0.00 57.70 56.29 1ntr n MET 75 Cb 0.64 -3.41 -0.14 0.00 -0.71 0.00 0.00 33.22 29.61 1ntr n MET 75 CO 0.00 0.00 0.00 -0.48 1.51 0.00 0.00 175.97 177.00 1ntr s LEU 76 N -3.80 2.65 0.26 4.03 0.05 -1.26 -5.06 118.68 115.55 1ntr s LEU 76 Ca 0.10 -0.27 -0.26 0.00 0.05 0.00 0.00 54.13 53.75 1ntr s LEU 76 Cb -0.01 -1.55 -0.16 0.00 -2.05 0.00 0.00 46.19 42.41 1ntr s LEU 76 CO 0.28 0.28 0.43 -0.81 -0.55 0.00 0.00 176.35 175.98 1ntr n PRO 77 N 2.73 0.07 -3.79 1.48 -0.04 -1.26 -4.76 135.00 129.42 1ntr n PRO 77 Ca -0.17 0.02 -0.13 0.00 -0.04 0.00 0.00 63.50 63.18 1ntr n PRO 77 Cb 0.52 -1.05 -0.11 0.00 -0.04 0.00 0.00 33.50 32.83 1ntr n PRO 77 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ntr s VAL 78 N -1.19 0.02 0.32 0.52 -7.23 -0.83 -2.54 120.40 109.46 1ntr s VAL 78 Ca 0.63 -0.16 0.05 0.00 -1.81 0.00 0.00 61.98 60.69 1ntr s VAL 78 Cb -0.84 -0.42 -0.06 0.00 0.56 0.00 0.00 36.38 35.62 1ntr s VAL 78 CO 0.58 -0.09 0.01 -0.63 -0.31 0.00 0.00 175.10 174.66 1ntr s ILE 79 N -0.27 1.47 -0.08 -0.62 1.01 -0.22 -3.25 121.20 119.24 1ntr s ILE 79 Ca -0.04 -2.05 -0.13 0.00 0.00 0.00 0.00 60.65 58.44 1ntr s ILE 79 Cb -0.03 -2.68 0.03 0.00 0.01 0.00 0.00 42.46 39.78 1ntr s ILE 79 CO 0.01 -0.12 0.32 -0.51 0.00 0.00 0.00 174.94 174.64 1ntr s ILE 80 N -3.11 0.02 -1.34 2.92 2.07 -1.24 -1.29 121.20 119.23 1ntr s ILE 80 Ca 0.33 -0.20 -0.08 0.00 -1.41 0.00 0.00 60.65 59.29 1ntr s ILE 80 Cb 0.07 -0.52 0.12 0.00 0.13 0.00 0.00 42.46 42.26 1ntr s ILE 80 CO 0.14 -0.11 2.19 0.23 -1.91 0.00 0.00 174.94 175.48 1ntr n MET 81 N 2.24 3.93 0.00 3.50 2.81 -0.61 -0.72 117.12 128.26 1ntr n MET 81 Ca -0.17 -3.31 0.00 0.00 -1.81 0.00 0.00 57.70 52.41 1ntr n MET 81 Cb 0.57 -2.83 0.00 0.00 -0.71 0.00 0.00 33.22 30.25 1ntr n MET 81 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1ntr n THR 82 N 2.90 0.00 -1.75 2.03 -1.04 0.47 -4.72 114.28 112.16 1ntr n THR 82 Ca 0.53 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 62.17 1ntr n THR 82 Cb 0.31 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.87 1ntr n THR 82 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ntr n ALA 83 N -0.16 6.33 -1.96 2.41 0.00 -1.26 -4.78 120.51 121.09 1ntr n ALA 83 Ca 0.00 -3.89 0.00 0.00 0.00 0.00 0.00 53.44 49.55 1ntr n ALA 83 Cb 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1ntr n ALA 83 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ntr n HIS 84 N -0.68 0.00 -2.17 0.00 8.25 -1.26 -4.88 115.22 114.49 1ntr n HIS 84 Ca 0.56 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.96 1ntr n HIS 84 Cb 0.43 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.53 1ntr n HIS 84 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1ntr n SER 85 N 0.00 -2.24 -1.97 0.41 7.64 -1.26 -3.46 113.62 112.75 1ntr n SER 85 Ca 0.00 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.18 1ntr n SER 85 Cb 0.00 -2.05 0.00 0.00 -1.01 0.00 0.00 64.21 61.15 1ntr n SER 85 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ntr n ASP 86 N -1.19 -9.00 -0.26 6.43 8.00 -1.26 -3.36 116.55 115.90 1ntr n ASP 86 Ca -0.07 1.34 0.30 0.00 0.71 0.00 0.00 54.79 57.07 1ntr n ASP 86 Cb 0.47 -4.98 0.46 0.00 -0.02 0.00 0.00 41.12 37.05 1ntr n ASP 86 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1ntr n LEU 87 N 1.41 0.00 0.00 0.64 7.94 -1.22 -1.59 117.00 124.18 1ntr n LEU 87 Ca 0.00 0.76 0.00 0.00 -1.11 0.00 0.00 56.01 55.66 1ntr n LEU 87 Cb 0.00 -0.28 0.00 0.00 0.53 0.00 0.00 43.42 43.67 1ntr n LEU 87 CO 0.00 -0.76 0.30 -0.67 -1.11 0.00 0.00 177.39 175.15 1ntr n ASP 88 N -3.25 0.00 0.02 1.96 2.03 -1.26 0.96 116.55 117.01 1ntr n ASP 88 Ca 0.25 0.59 -0.04 0.00 0.52 0.00 0.00 54.79 56.11 1ntr n ASP 88 Cb 1.54 -0.17 0.17 0.00 -0.72 0.00 0.00 41.12 41.94 1ntr n ASP 88 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ntr h ALA 89 N -1.35 1.01 0.54 -1.67 0.00 -1.30 -3.25 119.26 113.24 1ntr h ALA 89 Ca 0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1ntr h ALA 89 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ntr h ALA 89 CO 0.00 0.60 -0.40 0.00 0.00 0.00 0.00 179.25 179.45 1ntr h ALA 90 N 1.24 -1.15 -0.39 0.00 0.00 -1.10 -2.61 119.26 115.26 1ntr h ALA 90 Ca 0.05 -0.18 0.16 0.00 0.00 0.00 0.00 54.91 54.93 1ntr h ALA 90 Cb 0.78 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 19.07 1ntr h ALA 90 CO 0.06 -1.14 0.22 1.55 0.00 0.00 0.00 179.25 179.95 1ntr n VAL 91 N -4.85 -0.14 -0.38 0.00 3.14 0.27 -0.60 118.33 115.76 1ntr n VAL 91 Ca -0.11 0.72 -0.09 0.00 -2.96 0.00 0.00 64.34 61.90 1ntr n VAL 91 Cb 0.39 -1.17 -0.08 0.00 -1.06 0.00 0.00 33.84 31.91 1ntr n VAL 91 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1ntr n SER 92 N -3.73 -0.95 -0.02 6.55 2.88 -0.98 -1.06 113.62 116.31 1ntr n SER 92 Ca 0.14 1.63 -0.01 0.00 -1.33 0.00 0.00 58.87 59.30 1ntr n SER 92 Cb 0.49 -0.22 -0.01 0.00 -0.75 0.00 0.00 64.21 63.72 1ntr n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ntr h ALA 93 N 0.51 -0.24 -0.33 -1.46 0.00 -1.07 -3.30 119.26 113.37 1ntr h ALA 93 Ca 0.16 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 1ntr h ALA 93 Cb 0.39 0.83 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1ntr h ALA 93 CO -0.87 -0.26 0.97 0.66 0.00 0.00 0.00 179.25 179.75 1ntr n TYR 94 N -2.99 0.77 0.00 0.00 4.01 -0.23 -3.17 117.16 115.55 1ntr n TYR 94 Ca -0.00 0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1ntr n TYR 94 Cb 0.02 -1.91 0.00 0.00 -0.31 0.00 0.00 39.34 37.15 1ntr n TYR 94 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1ntr n GLN 95 N 7.72 0.00 0.04 -0.72 1.13 -1.24 -4.95 117.38 119.35 1ntr n GLN 95 Ca 0.54 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.60 1ntr n GLN 95 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.67 1ntr n GLN 95 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1ntr n GLN 96 N -0.98 0.00 0.00 -1.09 7.27 -1.19 -5.18 117.38 116.22 1ntr n GLN 96 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1ntr n GLN 96 Cb 0.00 -0.02 0.00 0.00 2.41 0.00 0.00 30.24 32.63 1ntr n GLN 96 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ntr n GLY 97 N 1.82 1.14 2.72 1.69 0.00 -1.26 -5.01 105.19 106.29 1ntr n GLY 97 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.73 1ntr n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ntr n ALA 98 N -1.10 0.00 -3.57 4.61 0.00 -1.26 -4.79 120.51 114.40 1ntr n ALA 98 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1ntr n ALA 98 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 1ntr n ALA 98 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ntr s PHE 99 N -3.80 2.95 0.27 0.00 0.40 -1.26 -1.97 117.98 114.56 1ntr s PHE 99 Ca 0.00 -1.03 0.06 0.00 -0.60 0.00 0.00 56.93 55.36 1ntr s PHE 99 Cb 0.00 -2.09 -0.06 0.00 0.51 0.00 0.00 43.02 41.39 1ntr s PHE 99 CO 0.00 -0.58 -0.06 -0.51 0.70 0.00 0.00 175.22 174.77 1ntr s ASP 100 N 1.45 2.65 -0.56 1.36 1.01 -1.20 -4.80 116.67 116.59 1ntr s ASP 100 Ca 0.05 -1.18 -0.05 0.00 0.71 0.00 0.00 52.55 52.09 1ntr s ASP 100 Cb -0.14 -0.15 0.15 0.00 1.01 0.00 0.00 42.92 43.79 1ntr s ASP 100 CO -0.04 -0.34 0.39 -0.31 0.21 0.00 0.00 175.17 175.07 1ntr s TYR 101 N -3.05 3.49 0.44 4.23 2.02 -1.26 -3.72 117.35 119.50 1ntr s TYR 101 Ca 0.29 -2.44 -0.14 0.00 -0.37 0.00 0.00 57.07 54.40 1ntr s TYR 101 Cb 0.03 -3.31 -0.08 0.00 -0.40 0.00 0.00 41.96 38.21 1ntr s TYR 101 CO 0.11 -0.91 0.87 -1.17 -1.57 0.00 0.00 175.55 172.88 1ntr s LEU 102 N 0.51 3.78 0.00 -1.29 2.96 0.10 -4.84 118.68 119.91 1ntr s LEU 102 Ca 0.13 1.37 0.01 0.00 -0.22 0.00 0.00 54.13 55.42 1ntr s LEU 102 Cb -0.21 -4.27 -0.00 0.00 0.50 0.00 0.00 46.19 42.21 1ntr s LEU 102 CO -0.04 -0.45 0.02 -0.81 -1.32 0.00 0.00 176.35 173.75 1ntr n PRO 103 N -1.25 1.23 -4.43 0.98 -0.04 -1.26 -0.40 135.00 129.84 1ntr n PRO 103 Ca 0.05 -1.80 -0.25 0.00 -0.04 0.00 0.00 63.50 61.46 1ntr n PRO 103 Cb 0.54 0.60 -0.10 0.00 -0.04 0.00 0.00 33.50 34.50 1ntr n PRO 103 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1ntr s LYS 104 N -2.87 1.69 0.94 0.54 3.01 -1.26 -4.31 119.74 117.48 1ntr s LYS 104 Ca 0.03 -1.63 -0.15 0.00 -1.01 0.00 0.00 55.97 53.21 1ntr s LYS 104 Cb 0.00 -1.85 0.17 0.00 -1.01 0.00 0.00 37.83 35.14 1ntr s LYS 104 CO 0.02 0.36 1.26 -1.25 0.51 0.00 0.00 175.35 176.25 1ntr s PRO 105 N -3.19 0.87 -0.11 -1.68 0.04 -1.26 -5.15 135.00 124.52 1ntr s PRO 105 Ca 0.27 -0.20 -0.11 0.00 0.04 0.00 0.00 61.00 61.00 1ntr s PRO 105 Cb -0.06 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.65 1ntr s PRO 105 CO 0.14 -2.29 0.31 -0.59 0.04 0.00 0.00 177.00 174.60 1ntr s PHE 106 N -3.69 -0.32 0.39 0.56 -0.12 -1.26 -5.15 117.98 108.38 1ntr s PHE 106 Ca 0.70 0.78 -0.23 0.00 -0.05 0.00 0.00 56.93 58.13 1ntr s PHE 106 Cb -0.07 0.11 -0.10 0.00 -0.63 0.00 0.00 43.02 42.33 1ntr s PHE 106 CO 0.52 -0.18 0.96 0.34 -0.05 0.00 0.00 175.22 176.81 1ntr s ASP 107 N 0.03 7.05 0.26 1.98 -1.08 -1.26 -4.95 116.67 118.70 1ntr s ASP 107 Ca -0.01 1.78 0.08 0.00 -0.52 0.00 0.00 52.55 53.87 1ntr s ASP 107 Cb -0.02 -2.56 0.30 0.00 -1.46 0.00 0.00 42.92 39.18 1ntr s ASP 107 CO 0.01 -0.28 1.58 -0.29 0.52 0.00 0.00 175.17 176.72 1ntr h ILE 108 N 2.18 1.43 0.11 4.11 6.09 -1.98 -1.10 117.51 128.34 1ntr h ILE 108 Ca -0.48 -2.09 -0.21 0.00 -1.37 0.00 0.00 64.86 60.71 1ntr h ILE 108 Cb 1.19 2.11 0.01 0.00 0.47 0.00 0.00 36.82 40.59 1ntr h ILE 108 CO 0.62 0.60 -1.03 -0.78 -3.07 0.00 0.00 178.15 174.50 1ntr h ASP 109 N 0.07 0.38 -0.97 2.19 1.82 -1.92 -1.21 116.42 116.78 1ntr h ASP 109 Ca -0.01 -0.89 0.11 0.00 -0.39 0.00 0.00 57.03 55.84 1ntr h ASP 109 Cb 1.11 -0.12 -0.07 0.00 0.68 0.00 0.00 39.33 40.93 1ntr h ASP 109 CO 0.09 1.47 0.62 -0.08 -1.61 0.00 0.00 179.24 179.72 1ntr h GLU 110 N -0.41 0.95 0.13 0.28 4.81 -1.95 -1.21 114.58 117.17 1ntr h GLU 110 Ca -0.21 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.96 1ntr h GLU 110 Cb 1.63 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.80 1ntr h GLU 110 CO 0.09 0.63 -0.06 0.00 -0.73 0.00 0.00 179.01 178.93 1ntr h ALA 111 N 1.53 -0.36 -0.82 2.92 0.00 -1.25 -2.49 119.26 118.79 1ntr h ALA 111 Ca 0.46 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.43 1ntr h ALA 111 Cb 0.42 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.17 1ntr h ALA 111 CO -0.22 -0.34 -0.42 0.28 0.00 0.00 0.00 179.25 178.55 1ntr n VAL 112 N -3.26 -0.51 0.19 0.00 0.31 -0.46 -1.54 118.33 113.06 1ntr n VAL 112 Ca -0.02 1.97 -0.08 0.00 -0.01 0.00 0.00 64.34 66.20 1ntr n VAL 112 Cb 0.07 -2.50 -0.04 0.00 -0.91 0.00 0.00 33.84 30.46 1ntr n VAL 112 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ntr h ALA 113 N 0.72 -1.08 -0.76 3.52 0.00 -1.35 -1.89 119.26 118.41 1ntr h ALA 113 Ca 0.20 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.12 1ntr h ALA 113 Cb 0.40 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.34 1ntr h ALA 113 CO -0.79 -1.06 -0.29 -0.11 0.00 0.00 0.00 179.25 176.99 1ntr n LEU 114 N -3.47 -0.49 0.22 0.00 7.94 -0.68 0.88 117.00 121.41 1ntr n LEU 114 Ca -0.06 1.32 -0.15 0.00 -1.11 0.00 0.00 56.01 56.01 1ntr n LEU 114 Cb 0.20 -0.31 -0.07 0.00 0.53 0.00 0.00 43.42 43.77 1ntr n LEU 114 CO 0.15 -1.19 0.65 0.58 -1.11 0.00 0.00 177.39 176.46 1ntr h VAL 115 N 0.00 0.32 -0.75 1.96 2.07 -1.21 -1.91 116.25 116.74 1ntr h VAL 115 Ca 0.27 0.00 0.28 0.00 0.82 0.00 0.00 66.70 68.06 1ntr h VAL 115 Cb 0.46 0.32 -0.14 0.00 -1.52 0.00 0.00 31.29 30.41 1ntr h VAL 115 CO -0.75 0.00 0.27 1.21 0.02 0.00 0.00 177.57 178.32 1ntr n GLU 116 N -5.44 -0.05 0.05 1.57 2.13 0.25 0.85 120.64 120.00 1ntr n GLU 116 Ca -0.10 1.06 -0.10 0.00 0.66 0.00 0.00 57.16 58.68 1ntr n GLU 116 Cb 0.34 -1.82 -0.07 0.00 0.27 0.00 0.00 31.44 30.16 1ntr n GLU 116 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ntr h ARG 117 N 0.00 -0.21 -0.16 5.31 3.08 -0.98 -3.15 114.38 118.27 1ntr h ARG 117 Ca 0.57 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.66 1ntr h ARG 117 Cb 1.43 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.50 1ntr h ARG 117 CO -0.62 0.21 -0.18 0.00 -1.07 0.00 0.00 179.97 178.32 1ntr h ALA 118 N -0.38 -0.41 -0.88 0.04 0.00 0.11 0.21 119.26 117.95 1ntr h ALA 118 Ca -0.02 0.00 0.34 0.00 0.00 0.00 0.00 54.91 55.24 1ntr h ALA 118 Cb 0.51 0.88 -0.16 0.00 0.00 0.00 0.00 17.79 19.03 1ntr h ALA 118 CO 0.04 -0.50 0.39 -0.89 0.00 0.00 0.00 179.25 178.28 1ntr n ILE 119 N -3.57 -0.37 -0.18 0.00 5.41 -0.19 0.14 119.36 120.60 1ntr n ILE 119 Ca -0.01 1.81 -0.07 0.00 1.00 0.00 0.00 62.75 65.48 1ntr n ILE 119 Cb 0.10 -2.88 -0.01 0.00 -0.71 0.00 0.00 39.64 36.14 1ntr n ILE 119 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1ntr h SER 120 N 0.00 -1.26 -0.93 4.38 0.02 -0.53 0.13 113.55 115.36 1ntr h SER 120 Ca 0.71 0.22 0.31 0.00 -0.84 0.00 0.00 61.79 62.19 1ntr h SER 120 Cb 1.81 0.60 -0.17 0.00 0.14 0.00 0.00 62.40 64.77 1ntr h SER 120 CO -0.70 -0.32 0.22 1.57 -1.14 0.00 0.00 176.83 176.45 1ntr n HIS 121 N -5.42 0.80 -2.39 3.45 -0.00 0.12 -3.36 115.22 108.42 1ntr n HIS 121 Ca 0.02 1.11 -0.39 0.00 -0.00 0.00 0.00 57.72 58.47 1ntr n HIS 121 Cb 0.35 -1.33 -0.03 0.00 -0.00 0.00 0.00 29.99 28.98 1ntr n HIS 121 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1ntr s TYR 122 N -5.71 2.16 -0.29 1.57 5.04 0.47 -4.78 117.35 115.81 1ntr s TYR 122 Ca -0.11 0.00 0.10 0.00 -2.44 0.00 0.00 57.07 54.62 1ntr s TYR 122 Cb 0.29 -4.47 0.47 0.00 0.35 0.00 0.00 41.96 38.60 1ntr s TYR 122 CO 0.73 -2.05 1.17 1.04 -1.34 0.00 0.00 175.55 175.09 1ntr n GLN 123 N 9.16 3.27 0.00 4.97 6.02 -1.21 -5.01 117.38 134.58 1ntr n GLN 123 Ca 0.18 -4.07 0.11 0.00 -0.01 0.00 0.00 57.00 53.21 1ntr n GLN 123 Cb 0.50 -2.16 0.09 0.00 1.02 0.00 0.00 30.24 29.69 1ntr n GLN 123 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14