#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntr s GLN 2 N 0.00 3.30 0.30 2.12 0.74 -1.26 -5.09 119.66 119.77 1ntr s GLN 2 Ca 0.00 -0.68 -0.16 0.00 0.05 0.00 0.00 55.36 54.57 1ntr s GLN 2 Cb 0.00 -2.86 0.02 0.00 1.10 0.00 0.00 33.01 31.27 1ntr s GLN 2 CO 0.00 -0.14 0.65 1.03 -0.55 0.00 0.00 175.29 176.28 1ntr s ARG 3 N 1.28 1.84 0.00 1.67 3.00 -1.26 -4.79 118.95 120.69 1ntr s ARG 3 Ca 0.03 -1.23 0.00 0.00 0.00 0.00 0.00 55.73 54.53 1ntr s ARG 3 Cb -0.14 0.56 0.00 0.00 0.00 0.00 0.00 34.95 35.37 1ntr s ARG 3 CO -0.04 -0.82 0.00 0.41 0.00 0.00 0.00 175.30 174.84 1ntr n GLY 4 N -0.47 -1.23 2.83 -3.53 0.00 -1.26 -5.01 105.19 96.52 1ntr n GLY 4 Ca -0.04 -1.14 -0.14 0.00 0.00 0.00 0.00 46.02 44.71 1ntr n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ntr s ILE 5 N -3.00 -0.46 -0.29 -0.61 1.01 -1.26 -2.37 121.20 114.21 1ntr s ILE 5 Ca 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 59.86 1ntr s ILE 5 Cb 0.00 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 1ntr s ILE 5 CO 0.00 -0.45 0.19 0.54 0.00 0.00 0.00 174.94 175.22 1ntr s VAL 6 N 1.84 5.24 -0.48 2.92 0.11 -0.71 -1.65 120.40 127.67 1ntr s VAL 6 Ca 0.14 0.06 -0.13 0.00 -2.93 0.00 0.00 61.98 59.12 1ntr s VAL 6 Cb -0.13 -3.54 0.10 0.00 -1.53 0.00 0.00 36.38 31.28 1ntr s VAL 6 CO -0.14 0.20 0.38 0.26 -3.33 0.00 0.00 175.10 172.47 1ntr s TRP 7 N 1.74 3.31 0.02 1.54 0.52 -0.33 -1.75 118.94 123.99 1ntr s TRP 7 Ca 0.07 -1.37 -0.03 0.00 0.02 0.00 0.00 56.10 54.78 1ntr s TRP 7 Cb -0.16 -3.36 -0.04 0.00 -1.15 0.00 0.00 33.47 28.75 1ntr s TRP 7 CO 0.10 -0.91 0.23 0.08 0.02 0.00 0.00 176.95 176.47 1ntr s VAL 8 N 1.52 5.37 -0.18 4.03 1.01 0.18 -1.75 120.40 130.58 1ntr s VAL 8 Ca 0.04 -0.11 -0.07 0.00 0.00 0.00 0.00 61.98 61.84 1ntr s VAL 8 Cb -0.26 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1ntr s VAL 8 CO 0.03 0.27 0.05 0.68 0.00 0.00 0.00 175.10 176.13 1ntr s VAL 9 N -1.39 4.65 0.00 2.92 -7.23 -0.73 -1.80 120.40 116.82 1ntr s VAL 9 Ca 0.30 -0.08 0.00 0.00 -1.81 0.00 0.00 61.98 60.39 1ntr s VAL 9 Cb -0.13 -3.10 0.00 0.00 0.56 0.00 0.00 36.38 33.72 1ntr s VAL 9 CO 0.20 0.45 0.00 0.47 -0.31 0.00 0.00 175.10 175.92 1ntr n ASP 10 N 3.63 0.00 0.00 4.85 9.92 -1.04 -2.64 116.55 131.27 1ntr n ASP 10 Ca -0.17 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.09 1ntr n ASP 10 Cb 0.52 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 1ntr n ASP 10 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1ntr n ASP 11 N 0.00 0.00 -3.12 -2.24 -0.08 -0.87 -4.65 116.55 105.58 1ntr n ASP 11 Ca 0.00 0.00 -0.17 0.00 -1.51 0.00 0.00 54.79 53.11 1ntr n ASP 11 Cb 0.00 0.31 -0.06 0.00 2.34 0.00 0.00 41.12 43.71 1ntr n ASP 11 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1ntr n ASP 12 N -2.44 -1.02 -4.59 1.67 2.03 -1.23 -4.09 116.55 106.88 1ntr n ASP 12 Ca 0.00 -3.06 -0.28 0.00 0.52 0.00 0.00 54.79 51.97 1ntr n ASP 12 Cb 0.00 2.09 0.21 0.00 -0.72 0.00 0.00 41.12 42.70 1ntr n ASP 12 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1ntr s SER 13 N -3.26 1.88 0.00 1.67 0.15 -1.26 -3.26 113.70 109.62 1ntr s SER 13 Ca 0.35 1.34 0.00 0.00 0.70 0.00 0.00 55.95 58.34 1ntr s SER 13 Cb 0.01 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.26 1ntr s SER 13 CO 0.25 -3.61 0.00 -0.24 1.20 0.00 0.00 173.24 170.83 1ntr n SER 14 N -4.51 0.00 -0.07 5.45 2.88 -1.26 -4.75 113.62 111.36 1ntr n SER 14 Ca 0.04 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.50 1ntr n SER 14 Cb 0.56 -0.17 -0.15 0.00 -0.75 0.00 0.00 64.21 63.69 1ntr n SER 14 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1ntr n ILE 15 N -2.00 1.39 -0.10 2.46 -0.00 -1.20 -3.79 119.36 116.12 1ntr n ILE 15 Ca 0.00 -0.82 -0.04 0.00 -0.00 0.00 0.00 62.75 61.89 1ntr n ILE 15 Cb 0.00 -0.61 0.17 0.00 -0.00 0.00 0.00 39.64 39.20 1ntr n ILE 15 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.55 176.46 1ntr h ARG 16 N 0.00 0.76 0.59 0.38 2.43 -1.85 -2.82 114.38 113.86 1ntr h ARG 16 Ca -0.44 -0.20 -0.03 0.00 -0.81 0.00 0.00 59.98 58.50 1ntr h ARG 16 Cb 2.11 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 31.58 1ntr h ARG 16 CO 0.04 0.77 -0.28 2.35 -1.51 0.00 0.00 179.97 181.35 1ntr h TRP 17 N 0.71 -0.73 -0.34 2.20 7.01 -1.95 -2.02 115.95 120.83 1ntr h TRP 17 Ca 0.14 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.15 1ntr h TRP 17 Cb 0.44 0.24 -0.04 0.00 -2.10 0.00 0.00 29.16 27.70 1ntr h TRP 17 CO 0.02 -0.45 -0.20 0.28 -2.79 0.00 0.00 178.44 175.30 1ntr n VAL 18 N -4.29 -0.23 0.00 2.65 0.31 -1.17 -1.03 118.33 114.57 1ntr n VAL 18 Ca -0.10 1.59 0.00 0.00 -0.01 0.00 0.00 64.34 65.82 1ntr n VAL 18 Cb 0.31 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 1ntr n VAL 18 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1ntr n LEU 19 N -3.74 0.00 -0.39 7.52 0.00 -1.07 -1.28 117.00 118.04 1ntr n LEU 19 Ca 0.01 0.96 0.32 0.00 0.00 0.00 0.00 56.01 57.30 1ntr n LEU 19 Cb 0.09 -0.46 0.54 0.00 0.00 0.00 0.00 43.42 43.59 1ntr n LEU 19 CO -0.05 -0.46 0.97 1.21 0.00 0.00 0.00 177.39 179.06 1ntr n GLU 20 N -2.31 -0.02 0.23 1.96 4.07 -0.76 0.12 120.64 123.93 1ntr n GLU 20 Ca 0.00 0.96 -0.15 0.00 -0.06 0.00 0.00 57.16 57.91 1ntr n GLU 20 Cb 0.00 -1.92 -0.08 0.00 -0.06 0.00 0.00 31.44 29.37 1ntr n GLU 20 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1ntr h ARG 21 N 0.00 -0.52 0.00 5.31 1.12 0.29 0.16 114.38 120.75 1ntr h ARG 21 Ca 0.69 0.04 0.00 0.00 -1.11 0.00 0.00 59.98 59.60 1ntr h ARG 21 Cb 2.29 0.12 0.00 0.00 -0.01 0.00 0.00 29.97 32.37 1ntr h ARG 21 CO -0.32 -0.31 0.00 0.00 -3.11 0.00 0.00 179.97 176.22 1ntr h ALA 22 N -0.02 1.00 0.00 2.80 0.00 0.12 -1.18 119.26 121.98 1ntr h ALA 22 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ntr h ALA 22 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ntr h ALA 22 CO 0.09 0.00 -0.37 -0.11 0.00 0.00 0.00 179.25 178.86 1ntr n LEU 23 N -2.95 0.38 -0.08 0.00 0.00 -0.29 -3.80 117.00 110.26 1ntr n LEU 23 Ca -0.00 0.15 -0.13 0.00 0.00 0.00 0.00 56.01 56.02 1ntr n LEU 23 Cb 0.21 -0.31 -0.05 0.00 0.00 0.00 0.00 43.42 43.27 1ntr n LEU 23 CO 0.23 0.08 0.57 0.00 0.00 0.00 0.00 177.39 178.27 1ntr h ALA 24 N 2.97 0.36 -0.61 1.96 0.00 0.58 -0.50 119.26 124.02 1ntr h ALA 24 Ca 0.00 -0.39 0.08 0.00 0.00 0.00 0.00 54.91 54.60 1ntr h ALA 24 Cb 0.51 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1ntr h ALA 24 CO 0.00 0.36 0.41 0.78 0.00 0.00 0.00 179.25 180.80 1ntr h GLY 25 N 0.33 0.69 2.00 0.00 0.00 -1.67 0.21 103.07 104.63 1ntr h GLY 25 Ca 0.04 -0.21 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 1ntr h GLY 25 CO 0.07 0.14 -0.39 0.00 0.00 0.00 0.00 176.54 176.36 1ntr h ALA 26 N 1.68 0.78 -3.19 3.60 0.00 -1.63 -3.48 119.26 117.02 1ntr h ALA 26 Ca 0.27 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1ntr h ALA 26 Cb 0.40 -0.06 0.06 0.00 0.00 0.00 0.00 17.79 18.18 1ntr h ALA 26 CO -0.08 0.48 -0.25 0.41 0.00 0.00 0.00 179.25 179.81 1ntr n GLY 27 N 1.04 0.19 3.55 0.00 0.00 0.74 -4.80 105.19 105.89 1ntr n GLY 27 Ca 0.02 -0.29 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 1ntr n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ntr s LEU 28 N -3.43 2.04 -0.78 0.99 1.02 -1.09 -4.58 118.68 112.85 1ntr s LEU 28 Ca 0.01 -1.67 -0.17 0.00 0.02 0.00 0.00 54.13 52.32 1ntr s LEU 28 Cb -0.00 -0.20 0.16 0.00 0.02 0.00 0.00 46.19 46.16 1ntr s LEU 28 CO 0.24 -0.91 0.85 -0.89 0.02 0.00 0.00 176.35 175.66 1ntr s THR 29 N -3.16 5.10 -1.22 5.49 2.01 -1.00 -4.79 115.64 118.06 1ntr s THR 29 Ca 0.22 -1.73 -0.15 0.00 0.31 0.00 0.00 61.69 60.33 1ntr s THR 29 Cb 0.03 -4.57 0.14 0.00 0.01 0.00 0.00 72.50 68.10 1ntr s THR 29 CO 0.13 -1.20 1.52 0.00 -0.69 0.00 0.00 174.62 174.38 1ntr s THR 31 N 2.52 4.40 0.14 0.00 2.01 -0.72 -4.48 115.64 119.50 1ntr s THR 31 Ca 0.46 1.62 -0.05 0.00 0.31 0.00 0.00 61.69 64.03 1ntr s THR 31 Cb -0.01 -4.07 -0.02 0.00 0.01 0.00 0.00 72.50 68.41 1ntr s THR 31 CO 0.02 0.44 0.16 0.42 -0.69 0.00 0.00 174.62 174.96 1ntr s THR 32 N -1.25 0.10 0.07 -0.82 -4.23 -1.26 -0.65 115.64 107.60 1ntr s THR 32 Ca 0.38 -1.63 0.01 0.00 -1.18 0.00 0.00 61.69 59.27 1ntr s THR 32 Cb -0.22 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.76 1ntr s THR 32 CO 0.25 -0.45 0.03 0.49 -0.54 0.00 0.00 174.62 174.40 1ntr n PHE 33 N -0.13 0.02 -0.03 3.99 3.01 -0.75 -4.91 117.46 118.66 1ntr n PHE 33 Ca -0.08 -0.46 0.02 0.00 1.01 0.00 0.00 57.45 57.94 1ntr n PHE 33 Cb 0.63 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.99 1ntr n PHE 33 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1ntr n GLU 34 N -0.16 0.99 -3.94 -1.08 0.28 -1.26 -2.49 120.64 112.98 1ntr n GLU 34 Ca -0.01 -0.08 -0.10 0.00 -0.16 0.00 0.00 57.16 56.81 1ntr n GLU 34 Cb 0.11 -1.34 -0.12 0.00 1.43 0.00 0.00 31.44 31.52 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 -4.02 0.16 0.50 -1.84 0.02 -1.26 -2.06 114.94 106.44 1ntr s ASN 35 Ca -0.06 -0.34 0.21 0.00 -1.02 0.00 0.00 52.86 51.66 1ntr s ASN 35 Cb 0.07 0.08 1.27 0.00 0.02 0.00 0.00 41.25 42.69 1ntr s ASN 35 CO 0.57 -0.21 2.00 1.23 0.02 0.00 0.00 177.10 180.71 1ntr h GLY 36 N 5.08 0.18 0.00 0.66 0.00 -1.87 -2.27 103.07 104.85 1ntr h GLY 36 Ca -0.30 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1ntr h GLY 36 CO 0.44 0.03 0.00 0.70 0.00 0.00 0.00 176.54 177.70 1ntr n ASN 37 N -4.43 0.00 -0.39 0.19 3.02 -1.26 -2.44 115.26 109.95 1ntr n ASN 37 Ca 0.09 0.53 0.31 0.00 -0.03 0.00 0.00 54.58 55.48 1ntr n ASN 37 Cb 0.49 -0.17 0.51 0.00 -0.61 0.00 0.00 39.78 40.00 1ntr n ASN 37 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1ntr n GLU 38 N -1.01 -0.02 0.47 3.52 4.07 -1.15 0.12 120.64 126.64 1ntr n GLU 38 Ca 0.00 0.83 -0.19 0.00 -0.06 0.00 0.00 57.16 57.74 1ntr n GLU 38 Cb 0.00 -1.73 -0.09 0.00 -0.06 0.00 0.00 31.44 29.55 1ntr n GLU 38 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1ntr h VAL 39 N 0.00 0.09 0.00 6.31 2.07 -1.24 -1.10 116.25 122.37 1ntr h VAL 39 Ca 0.63 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 68.10 1ntr h VAL 39 Cb 2.22 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1ntr h VAL 39 CO -0.21 0.00 0.00 0.17 0.02 0.00 0.00 177.57 177.55 1ntr h LEU 40 N -1.24 0.00 -0.78 2.57 8.10 0.13 0.45 115.31 124.54 1ntr h LEU 40 Ca -0.12 0.00 -0.11 0.00 0.11 0.00 0.00 57.88 57.76 1ntr h LEU 40 Cb 0.92 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.13 1ntr h LEU 40 CO 0.20 0.00 -0.28 0.00 -4.11 0.00 0.00 178.44 174.25 1ntr h ALA 41 N 2.03 0.96 0.00 0.17 0.00 -0.04 -2.72 119.26 119.66 1ntr h ALA 41 Ca 0.00 -0.38 -0.20 0.00 0.00 0.00 0.00 54.91 54.33 1ntr h ALA 41 Cb 0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1ntr h ALA 41 CO 0.00 0.61 -1.11 0.00 0.00 0.00 0.00 179.25 178.75 1ntr h ALA 42 N 1.17 0.56 0.00 0.00 0.00 -0.23 -3.18 119.26 117.57 1ntr h ALA 42 Ca 0.07 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1ntr h ALA 42 Cb 0.75 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1ntr h ALA 42 CO 0.06 1.15 0.00 1.28 0.00 0.00 0.00 179.25 181.74 1ntr n LEU 43 N -3.19 0.00 0.33 0.00 7.99 -0.63 -1.78 117.00 119.72 1ntr n LEU 43 Ca -0.05 0.39 0.22 0.00 -0.01 0.00 0.00 56.01 56.56 1ntr n LEU 43 Cb 0.91 -0.39 1.18 0.00 -0.11 0.00 0.00 43.42 45.00 1ntr n LEU 43 CO 0.45 -0.27 1.18 0.00 -1.51 0.00 0.00 177.39 177.24 1ntr h ALA 44 N 2.38 1.07 -0.85 -1.18 0.00 -1.50 0.22 119.26 119.41 1ntr h ALA 44 Ca 0.00 -0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1ntr h ALA 44 Cb 0.12 -0.00 -0.21 0.00 0.00 0.00 0.00 17.79 17.71 1ntr h ALA 44 CO 0.00 0.00 0.44 0.43 0.00 0.00 0.00 179.25 180.12 1ntr n SER 45 N -3.19 4.37 -0.71 0.00 7.64 -0.73 -5.02 113.62 115.98 1ntr n SER 45 Ca -0.03 -3.40 0.00 0.00 1.01 0.00 0.00 58.87 56.45 1ntr n SER 45 Cb 0.08 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1ntr n SER 45 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1ntr n LYS 46 N -0.59 -2.05 -0.83 1.43 4.01 0.78 -4.99 118.16 115.92 1ntr n LYS 46 Ca 0.49 1.53 -0.21 0.00 -0.51 0.00 0.00 58.31 59.61 1ntr n LYS 46 Cb 1.52 -1.72 0.17 0.00 -0.51 0.00 0.00 35.03 34.50 1ntr n LYS 46 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1ntr n THR 47 N -0.91 0.00 0.00 -0.18 5.66 -1.26 -4.80 114.28 112.79 1ntr n THR 47 Ca 0.00 -0.39 -0.01 0.00 -3.05 0.00 0.00 64.05 60.60 1ntr n THR 47 Cb 0.00 -1.23 -0.00 0.00 -1.55 0.00 0.00 70.33 67.54 1ntr n THR 47 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1ntr n PRO 48 N -3.77 0.04 0.02 1.09 -0.04 -1.26 -5.03 135.00 126.05 1ntr n PRO 48 Ca 0.11 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1ntr n PRO 48 Cb 0.42 -0.30 0.00 0.00 -0.04 0.00 0.00 33.50 33.58 1ntr n PRO 48 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ntr n ASP 49 N -2.85 0.36 -3.66 3.54 -0.08 -0.81 -4.91 116.55 108.13 1ntr n ASP 49 Ca -0.01 0.06 -0.08 0.00 -1.51 0.00 0.00 54.79 53.25 1ntr n ASP 49 Cb 0.04 -0.10 -0.09 0.00 2.34 0.00 0.00 41.12 43.31 1ntr n ASP 49 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1ntr s VAL 50 N -2.00 -0.09 -0.21 5.18 0.11 -0.66 -4.75 120.40 117.99 1ntr s VAL 50 Ca 0.00 0.05 -0.10 0.00 -2.93 0.00 0.00 61.98 59.00 1ntr s VAL 50 Cb 0.00 -0.82 -0.05 0.00 -1.53 0.00 0.00 36.38 33.98 1ntr s VAL 50 CO 0.00 0.02 0.13 -0.22 -3.33 0.00 0.00 175.10 171.69 1ntr s LEU 51 N 1.64 4.13 0.14 2.54 2.96 -1.05 -1.19 118.68 127.86 1ntr s LEU 51 Ca -0.09 0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 1ntr s LEU 51 Cb -0.07 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 1ntr s LEU 51 CO -0.17 0.15 0.11 -1.48 -1.32 0.00 0.00 176.35 173.64 1ntr s LEU 52 N 0.51 1.56 0.06 -0.68 0.05 -0.71 -1.74 118.68 117.74 1ntr s LEU 52 Ca 0.07 -1.17 0.03 0.00 0.05 0.00 0.00 54.13 53.12 1ntr s LEU 52 Cb -0.12 0.47 -0.03 0.00 -2.05 0.00 0.00 46.19 44.47 1ntr s LEU 52 CO -0.00 -0.77 -0.10 -0.94 -0.55 0.00 0.00 176.35 173.99 1ntr s SER 53 N -3.05 1.19 -0.13 1.48 1.04 -1.04 -1.78 113.70 111.43 1ntr s SER 53 Ca 0.24 -0.62 0.01 0.00 0.48 0.00 0.00 55.95 56.06 1ntr s SER 53 Cb 0.07 0.01 -0.01 0.00 0.10 0.00 0.00 66.02 66.19 1ntr s SER 53 CO 0.03 -0.18 -0.16 -0.62 0.98 0.00 0.00 173.24 173.28 1ntr s ASP 54 N -1.80 3.73 0.26 7.02 -1.08 -1.08 -2.43 116.67 121.30 1ntr s ASP 54 Ca -0.05 -0.41 -0.21 0.00 -0.52 0.00 0.00 52.55 51.36 1ntr s ASP 54 Cb -0.08 -1.55 -0.09 0.00 -1.46 0.00 0.00 42.92 39.73 1ntr s ASP 54 CO 0.01 0.15 0.80 -0.51 0.52 0.00 0.00 175.17 176.14 1ntr s ILE 55 N 0.41 4.46 0.01 4.11 -1.16 -1.20 -4.62 121.20 123.21 1ntr s ILE 55 Ca -0.12 1.44 0.00 0.00 -0.51 0.00 0.00 60.65 61.46 1ntr s ILE 55 Cb -0.16 -3.89 0.00 0.00 0.61 0.00 0.00 42.46 39.02 1ntr s ILE 55 CO 0.06 0.15 0.00 -2.11 -2.81 0.00 0.00 174.94 170.23 1ntr n ARG 56 N 0.58 0.00 -1.29 3.50 1.85 -1.13 -4.93 116.66 115.24 1ntr n ARG 56 Ca -0.00 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.47 1ntr n ARG 56 Cb 0.51 0.00 0.04 0.00 -1.05 0.00 0.00 32.46 31.96 1ntr n ARG 56 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ntr n MET 57 N -2.16 0.23 -3.61 2.89 0.00 -1.25 -4.96 117.12 108.25 1ntr n MET 57 Ca 0.00 0.09 -0.20 0.00 0.00 0.00 0.00 57.70 57.60 1ntr n MET 57 Cb 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 33.22 31.80 1ntr n MET 57 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1ntr s PRO 58 N -1.86 3.22 0.00 3.17 0.04 -1.26 -4.17 135.00 134.14 1ntr s PRO 58 Ca 0.61 -0.92 0.00 0.00 0.04 0.00 0.00 61.00 60.73 1ntr s PRO 58 Cb -0.42 -2.84 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1ntr s PRO 58 CO 0.62 0.17 0.00 0.41 0.04 0.00 0.00 177.00 178.24 1ntr n GLY 59 N -1.58 0.71 0.25 0.56 0.00 -1.26 -4.79 105.19 99.08 1ntr n GLY 59 Ca -0.03 -2.07 0.02 0.00 0.00 0.00 0.00 46.02 43.94 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 6.28 0.31 -3.54 1.61 2.86 -2.05 -3.35 114.93 117.05 1ntr h MET 60 Ca 0.00 -0.07 -0.63 0.00 -2.06 0.00 0.00 59.70 56.94 1ntr h MET 60 Cb 0.00 -0.04 -0.41 0.00 0.06 0.00 0.00 31.60 31.21 1ntr h MET 60 CO 0.00 0.41 -0.68 -0.51 1.06 0.00 0.00 176.91 177.20 1ntr s ASP 61 N -6.85 4.22 -0.07 1.22 1.01 -1.26 -4.80 116.67 110.14 1ntr s ASP 61 Ca -0.06 -2.68 -0.22 0.00 0.71 0.00 0.00 52.55 50.30 1ntr s ASP 61 Cb 0.15 -1.45 -0.30 0.00 1.01 0.00 0.00 42.92 42.34 1ntr s ASP 61 CO 0.74 -0.28 0.82 1.23 0.21 0.00 0.00 175.17 177.89 1ntr h GLY 62 N 6.85 0.28 0.00 0.21 0.00 -1.72 -3.40 103.07 105.29 1ntr h GLY 62 Ca -0.06 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.55 1ntr h GLY 62 CO 0.60 0.63 0.00 -0.10 0.00 0.00 0.00 176.54 177.67 1ntr n LEU 63 N -4.17 0.00 0.00 3.11 0.00 -1.26 -2.82 117.00 111.86 1ntr n LEU 63 Ca -0.15 0.34 0.00 0.00 0.00 0.00 0.00 56.01 56.20 1ntr n LEU 63 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.21 1ntr n LEU 63 CO 0.45 0.00 0.00 0.00 0.00 0.00 0.00 177.39 177.84 1ntr n ALA 64 N -1.44 0.00 -3.31 1.96 0.00 -1.26 -3.78 120.51 112.68 1ntr n ALA 64 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1ntr n ALA 64 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 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 -5.26 0.08 0.00 4.32 -1.26 -3.65 117.00 111.22 1ntr n LEU 65 Ca 0.00 -0.64 0.12 0.00 -0.02 0.00 0.00 56.01 55.47 1ntr n LEU 65 Cb 0.00 -3.04 0.46 0.00 -1.62 0.00 0.00 43.42 39.22 1ntr n LEU 65 CO 0.00 -0.07 0.87 -0.11 -1.22 0.00 0.00 177.39 176.85 1ntr n LEU 66 N -3.09 0.51 0.10 2.23 7.94 -1.26 -1.92 117.00 121.51 1ntr n LEU 66 Ca -0.07 0.58 -0.21 0.00 -1.11 0.00 0.00 56.01 55.20 1ntr n LEU 66 Cb 0.59 -0.46 -0.12 0.00 0.53 0.00 0.00 43.42 43.96 1ntr n LEU 66 CO 0.59 -0.28 -0.06 0.50 -1.11 0.00 0.00 177.39 177.03 1ntr h LYS 67 N 0.00 0.56 0.04 1.96 1.63 -1.89 -3.22 116.57 115.66 1ntr h LYS 67 Ca 0.00 -0.77 -0.00 0.00 -0.85 0.00 0.00 60.65 59.03 1ntr h LYS 67 Cb 0.51 0.26 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1ntr h LYS 67 CO 0.00 1.34 -0.02 -0.56 -3.45 0.00 0.00 179.45 176.76 1ntr h GLN 68 N 0.24 -0.06 -1.36 1.90 3.07 -1.88 -2.79 115.11 114.23 1ntr h GLN 68 Ca -0.18 0.00 0.45 0.00 0.09 0.00 0.00 58.65 59.01 1ntr h GLN 68 Cb 1.92 0.01 -0.11 0.00 0.08 0.00 0.00 27.48 29.38 1ntr h GLN 68 CO 0.23 0.58 0.91 1.51 0.09 0.00 0.00 178.83 182.14 1ntr n ILE 69 N -4.75 -0.17 -0.03 1.86 3.06 -0.81 0.78 119.36 119.31 1ntr n ILE 69 Ca -0.08 1.53 -0.08 0.00 -2.50 0.00 0.00 62.75 61.62 1ntr n ILE 69 Cb 0.32 -2.52 -0.07 0.00 0.54 0.00 0.00 39.64 37.91 1ntr n ILE 69 CO 0.00 0.00 0.00 0.50 -2.50 0.00 0.00 176.55 174.55 1ntr h LYS 70 N 0.00 -0.06 -0.65 9.51 1.63 -1.56 -1.84 116.57 123.60 1ntr h LYS 70 Ca 0.80 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 60.78 1ntr h LYS 70 Cb 2.73 0.01 -0.12 0.00 -0.60 0.00 0.00 32.23 34.25 1ntr h LYS 70 CO -0.31 0.45 0.03 1.04 -3.45 0.00 0.00 179.45 177.21 1ntr n GLN 71 N -4.75 -0.05 -0.00 1.90 3.00 0.23 0.23 117.38 117.94 1ntr n GLN 71 Ca -0.06 0.97 -0.22 0.00 -0.01 0.00 0.00 57.00 57.68 1ntr n GLN 71 Cb 0.26 -1.55 -0.14 0.00 0.00 0.00 0.00 30.24 28.82 1ntr n GLN 71 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 1ntr h ARG 72 N 0.00 0.22 -6.03 -1.09 9.65 -1.60 -3.47 114.38 112.06 1ntr h ARG 72 Ca 0.40 -0.38 -0.53 0.00 -1.10 0.00 0.00 59.98 58.36 1ntr h ARG 72 Cb 0.84 0.14 0.24 0.00 -1.39 0.00 0.00 29.97 29.81 1ntr h ARG 72 CO -0.61 1.18 -2.05 0.72 2.80 0.00 0.00 179.97 182.02 1ntr n HIS 73 N -3.86 -4.10 -2.08 2.20 8.25 0.14 -4.89 115.22 110.87 1ntr n HIS 73 Ca -0.28 0.15 -0.26 0.00 -0.26 0.00 0.00 57.72 57.07 1ntr n HIS 73 Cb 0.92 -1.43 0.02 0.00 1.12 0.00 0.00 29.99 30.62 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 2.34 3.47 -2.42 -0.41 -0.04 -1.26 -4.94 135.00 131.74 1ntr n PRO 74 Ca -0.02 -4.17 -0.04 0.00 -0.04 0.00 0.00 63.50 59.24 1ntr n PRO 74 Cb 0.61 -2.27 0.01 0.00 -0.04 0.00 0.00 33.50 31.80 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 -0.66 -1.90 -3.80 0.54 2.81 -1.26 -5.08 117.12 107.77 1ntr n MET 75 Ca 0.45 1.77 -0.12 0.00 -1.81 0.00 0.00 57.70 57.99 1ntr n MET 75 Cb 0.84 -4.33 -0.09 0.00 -0.71 0.00 0.00 33.22 28.93 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 -1.85 1.13 -0.14 4.03 0.05 -1.26 -5.10 118.68 115.54 1ntr s LEU 76 Ca 0.13 -0.09 -0.37 0.00 0.05 0.00 0.00 54.13 53.84 1ntr s LEU 76 Cb -0.04 1.07 -0.18 0.00 -2.05 0.00 0.00 46.19 44.99 1ntr s LEU 76 CO 0.54 -0.46 1.09 -0.81 -0.55 0.00 0.00 176.35 176.16 1ntr n PRO 77 N 1.16 0.00 -3.95 1.48 -0.04 -1.26 -4.80 135.00 127.59 1ntr n PRO 77 Ca -0.21 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.92 1ntr n PRO 77 Cb 0.57 -1.32 -0.14 0.00 -0.04 0.00 0.00 33.50 32.57 1ntr n PRO 77 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ntr s VAL 78 N 0.85 2.58 0.63 0.52 1.01 -1.01 -2.52 120.40 122.47 1ntr s VAL 78 Ca 0.84 -2.23 -0.13 0.00 0.00 0.00 0.00 61.98 60.46 1ntr s VAL 78 Cb -1.18 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 1ntr s VAL 78 CO 0.57 -0.61 1.05 -0.63 0.00 0.00 0.00 175.10 175.48 1ntr s ILE 79 N 0.98 4.07 -0.22 2.22 1.01 -0.71 -3.93 121.20 124.62 1ntr s ILE 79 Ca 0.09 0.81 -0.09 0.00 0.00 0.00 0.00 60.65 61.46 1ntr s ILE 79 Cb -0.20 -3.47 0.09 0.00 0.01 0.00 0.00 42.46 38.89 1ntr s ILE 79 CO -0.07 -0.74 0.48 -0.51 0.00 0.00 0.00 174.94 174.11 1ntr s ILE 80 N -2.80 -0.46 -0.57 2.92 2.07 -1.26 -2.48 121.20 118.61 1ntr s ILE 80 Ca 0.60 0.10 -0.17 0.00 -1.41 0.00 0.00 60.65 59.77 1ntr s ILE 80 Cb -0.14 -0.74 0.12 0.00 0.13 0.00 0.00 42.46 41.83 1ntr s ILE 80 CO 0.46 0.04 0.59 -0.04 -1.91 0.00 0.00 174.94 174.08 1ntr s MET 81 N 2.23 3.03 0.57 3.50 -1.94 -1.02 -2.49 119.30 123.18 1ntr s MET 81 Ca -0.05 -1.57 0.00 0.00 -1.71 0.00 0.00 55.69 52.35 1ntr s MET 81 Cb -0.10 -4.29 0.00 0.00 2.01 0.00 0.00 34.83 32.44 1ntr s MET 81 CO -0.15 -1.42 0.00 0.25 -0.01 0.00 0.00 175.02 173.70 1ntr n THR 82 N 5.34 -0.81 -3.82 2.05 -2.24 -0.73 -3.20 114.28 110.87 1ntr n THR 82 Ca -0.12 0.86 0.00 0.00 -2.27 0.00 0.00 64.05 62.52 1ntr n THR 82 Cb 0.41 -1.31 0.01 0.00 -2.10 0.00 0.00 70.33 67.34 1ntr n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ntr n ALA 83 N -4.17 -1.72 -1.25 6.98 0.00 -1.26 -4.08 120.51 115.01 1ntr n ALA 83 Ca -0.08 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1ntr n ALA 83 Cb 0.65 0.19 0.00 0.00 0.00 0.00 0.00 19.45 20.29 1ntr n ALA 83 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1ntr n HIS 84 N -0.45 0.00 -2.87 0.00 -0.00 -1.26 -4.97 115.22 105.67 1ntr n HIS 84 Ca 0.01 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.11 1ntr n HIS 84 Cb 0.31 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.17 1ntr n HIS 84 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1ntr n SER 85 N 0.00 -1.22 -1.70 0.26 7.64 -1.26 -3.14 113.62 114.21 1ntr n SER 85 Ca 0.00 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1ntr n SER 85 Cb 0.00 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 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 -1.68 -8.33 -0.52 6.43 8.00 -1.26 -2.70 116.55 116.49 1ntr n ASP 86 Ca 0.02 1.18 0.40 0.00 0.71 0.00 0.00 54.79 57.09 1ntr n ASP 86 Cb 0.49 -4.34 0.63 0.00 -0.02 0.00 0.00 41.12 37.88 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 0.80 0.05 0.00 0.64 7.94 -1.19 -1.19 117.00 124.05 1ntr n LEU 87 Ca 0.00 0.88 0.00 0.00 -1.11 0.00 0.00 56.01 55.78 1ntr n LEU 87 Cb 0.00 -0.44 0.00 0.00 0.53 0.00 0.00 43.42 43.51 1ntr n LEU 87 CO 0.00 -0.90 0.20 0.47 -1.11 0.00 0.00 177.39 176.05 1ntr n ASP 88 N -3.74 0.00 -0.35 1.96 9.92 -1.26 0.13 116.55 123.22 1ntr n ASP 88 Ca 0.35 0.41 0.33 0.00 -0.53 0.00 0.00 54.79 55.34 1ntr n ASP 88 Cb 1.52 0.00 0.68 0.00 -0.64 0.00 0.00 41.12 42.68 1ntr n ASP 88 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ntr h ALA 89 N -1.89 2.89 -3.00 2.24 0.00 -0.94 -1.34 119.26 117.23 1ntr h ALA 89 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ntr h ALA 89 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ntr h ALA 89 CO 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 179.25 177.97 1ntr n ALA 90 N -2.68 0.00 -0.27 0.00 0.00 0.34 -3.09 120.51 114.81 1ntr n ALA 90 Ca 0.27 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.64 1ntr n ALA 90 Cb 1.19 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.59 1ntr n ALA 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ntr n VAL 91 N -0.11 -0.44 0.00 0.00 0.31 0.36 -3.40 118.33 115.06 1ntr n VAL 91 Ca 0.00 1.59 0.00 0.00 -0.01 0.00 0.00 64.34 65.92 1ntr n VAL 91 Cb 0.00 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 30.95 1ntr n VAL 91 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1ntr n SER 92 N -4.84 0.00 0.00 4.52 7.64 -0.52 -4.21 113.62 116.22 1ntr n SER 92 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1ntr n SER 92 Cb 0.18 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1ntr n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ntr n ALA 93 N -3.00 0.00 -3.15 -0.43 0.00 -1.18 -1.92 120.51 110.84 1ntr n ALA 93 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1ntr n ALA 93 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1ntr n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ntr n TYR 94 N 0.00 -0.11 -0.43 0.00 4.02 -1.26 -5.07 117.16 114.32 1ntr n TYR 94 Ca 0.00 -3.66 -0.28 0.00 -0.01 0.00 0.00 57.90 53.95 1ntr n TYR 94 Cb 0.00 -0.23 0.25 0.00 -0.02 0.00 0.00 39.34 39.34 1ntr n TYR 94 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1ntr n GLN 95 N 0.31 -3.19 -3.13 -0.72 1.13 -0.81 -4.09 117.38 106.89 1ntr n GLN 95 Ca 0.23 -0.93 -0.13 0.00 -1.94 0.00 0.00 57.00 54.23 1ntr n GLN 95 Cb 0.66 -1.91 0.07 0.00 0.11 0.00 0.00 30.24 29.17 1ntr n GLN 95 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1ntr n GLN 96 N -4.39 -5.12 0.00 -1.09 6.02 -1.26 -4.93 117.38 106.61 1ntr n GLN 96 Ca 0.06 0.68 0.00 0.00 -0.01 0.00 0.00 57.00 57.73 1ntr n GLN 96 Cb 0.55 -5.17 0.00 0.00 1.02 0.00 0.00 30.24 26.65 1ntr n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ntr n GLY 97 N -1.11 2.15 2.71 1.08 0.00 -1.26 -5.10 105.19 103.66 1ntr n GLY 97 Ca -0.22 0.26 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1ntr n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ntr s ALA 98 N -1.00 2.20 -0.02 4.61 0.00 -1.26 -5.09 121.76 121.20 1ntr s ALA 98 Ca 0.00 -2.65 0.02 0.00 0.00 0.00 0.00 51.96 49.34 1ntr s ALA 98 Cb 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.23 1ntr s ALA 98 CO 0.00 -2.06 -0.08 -0.06 0.00 0.00 0.00 175.76 173.56 1ntr s PHE 99 N 0.26 0.80 0.00 0.00 0.40 -1.26 -2.39 117.98 115.79 1ntr s PHE 99 Ca 0.19 -0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 1ntr s PHE 99 Cb -0.22 -0.58 0.00 0.00 0.51 0.00 0.00 43.02 42.73 1ntr s PHE 99 CO -0.01 -0.08 0.00 -0.40 0.70 0.00 0.00 175.22 175.43 1ntr n ASP 100 N 3.26 1.99 -3.09 1.36 5.75 -1.25 -5.06 116.55 119.51 1ntr n ASP 100 Ca -0.17 -0.79 0.03 0.00 -0.01 0.00 0.00 54.79 53.85 1ntr n ASP 100 Cb 0.55 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.64 1ntr n ASP 100 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1ntr s TYR 101 N -0.58 -1.24 0.15 2.11 2.02 -1.26 -4.47 117.35 114.08 1ntr s TYR 101 Ca 0.00 0.46 0.11 0.00 -0.37 0.00 0.00 57.07 57.27 1ntr s TYR 101 Cb 0.00 0.22 -0.04 0.00 -0.40 0.00 0.00 41.96 41.74 1ntr s TYR 101 CO 0.00 -0.78 -0.25 -0.48 -1.57 0.00 0.00 175.55 172.47 1ntr s LEU 102 N 2.38 2.36 0.00 -1.29 2.34 -1.04 -4.91 118.68 118.53 1ntr s LEU 102 Ca 0.16 -0.79 0.00 0.00 0.06 0.00 0.00 54.13 53.57 1ntr s LEU 102 Cb -0.04 -1.16 0.00 0.00 -0.56 0.00 0.00 46.19 44.43 1ntr s LEU 102 CO -0.17 0.14 0.01 -0.81 -1.06 0.00 0.00 176.35 174.46 1ntr n PRO 103 N 0.68 1.56 -3.08 1.48 -0.04 -1.26 -1.78 135.00 132.55 1ntr n PRO 103 Ca -0.16 -1.25 -0.26 0.00 -0.04 0.00 0.00 63.50 61.79 1ntr n PRO 103 Cb 0.54 0.32 -0.01 0.00 -0.04 0.00 0.00 33.50 34.31 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 -2.63 3.53 0.66 0.54 1.02 -1.26 -4.38 119.74 117.22 1ntr s LYS 104 Ca 0.01 -0.08 -0.05 0.00 0.02 0.00 0.00 55.97 55.87 1ntr s LYS 104 Cb -0.00 -2.55 0.05 0.00 -0.52 0.00 0.00 37.83 34.82 1ntr s LYS 104 CO 0.00 0.02 0.95 -1.25 -0.92 0.00 0.00 175.35 174.16 1ntr s PRO 105 N -4.38 2.31 -0.07 -1.68 0.04 -1.26 -5.18 135.00 124.78 1ntr s PRO 105 Ca 0.43 -0.37 -0.31 0.00 0.04 0.00 0.00 61.00 60.80 1ntr s PRO 105 Cb -0.10 -2.25 0.08 0.00 0.04 0.00 0.00 34.50 32.27 1ntr s PRO 105 CO 0.39 -1.09 0.75 -0.59 0.04 0.00 0.00 177.00 176.50 1ntr s PHE 106 N -3.12 -0.59 -0.28 0.56 -0.71 -1.26 -5.12 117.98 107.45 1ntr s PHE 106 Ca 0.59 1.01 -0.29 0.00 -1.04 0.00 0.00 56.93 57.21 1ntr s PHE 106 Cb -0.11 0.42 0.01 0.00 -1.21 0.00 0.00 43.02 42.14 1ntr s PHE 106 CO 0.43 -0.55 1.05 0.34 -1.34 0.00 0.00 175.22 175.15 1ntr s ASP 107 N -1.18 7.00 0.34 1.98 -1.08 -1.26 -4.89 116.67 117.58 1ntr s ASP 107 Ca -0.09 1.18 0.14 0.00 -0.52 0.00 0.00 52.55 53.26 1ntr s ASP 107 Cb -0.00 -2.54 1.11 0.00 -1.46 0.00 0.00 42.92 40.04 1ntr s ASP 107 CO 0.08 -0.78 1.61 -0.29 0.52 0.00 0.00 175.17 176.30 1ntr h ILE 108 N 5.61 0.11 -0.08 4.11 6.09 -2.00 1.19 117.51 132.54 1ntr h ILE 108 Ca -0.20 -0.03 -0.23 0.00 -1.37 0.00 0.00 64.86 63.02 1ntr h ILE 108 Cb 1.06 -0.00 0.01 0.00 0.47 0.00 0.00 36.82 38.36 1ntr h ILE 108 CO 1.01 0.02 -0.87 -0.78 -3.07 0.00 0.00 178.15 174.45 1ntr h ASP 109 N 0.10 0.83 -0.98 2.19 3.58 -1.90 -0.99 116.42 119.25 1ntr h ASP 109 Ca 0.75 -0.60 0.20 0.00 0.42 0.00 0.00 57.03 57.80 1ntr h ASP 109 Cb 1.81 -0.25 -0.09 0.00 1.72 0.00 0.00 39.33 42.52 1ntr h ASP 109 CO -0.75 1.39 0.62 -0.08 -2.88 0.00 0.00 179.24 177.54 1ntr h GLU 110 N 0.43 0.61 0.00 0.28 4.22 0.10 -0.19 114.58 120.03 1ntr h GLU 110 Ca -0.08 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.33 1ntr h GLU 110 Cb 1.51 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1ntr h GLU 110 CO 0.17 0.40 -0.00 0.00 -2.18 0.00 0.00 179.01 177.40 1ntr h ALA 111 N 1.63 0.00 -1.25 2.92 0.00 -1.00 -2.68 119.26 118.87 1ntr h ALA 111 Ca 0.55 -0.05 0.43 0.00 0.00 0.00 0.00 54.91 55.83 1ntr h ALA 111 Cb 1.03 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.71 1ntr h ALA 111 CO -0.31 0.00 0.81 0.28 0.00 0.00 0.00 179.25 180.04 1ntr n VAL 112 N -2.13 -0.20 -0.00 0.00 0.31 -0.39 -1.30 118.33 114.61 1ntr n VAL 112 Ca -0.00 1.55 -0.00 0.00 -0.01 0.00 0.00 64.34 65.88 1ntr n VAL 112 Cb 0.00 -2.55 -0.00 0.00 -0.91 0.00 0.00 33.84 30.38 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 1.34 -0.08 -0.77 3.52 0.00 -1.16 -0.86 119.26 121.25 1ntr h ALA 113 Ca 0.77 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.82 1ntr h ALA 113 Cb 2.55 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 20.22 1ntr h ALA 113 CO -0.37 -0.08 -0.24 -0.11 0.00 0.00 0.00 179.25 178.45 1ntr n LEU 114 N -2.95 -0.37 0.02 0.00 -0.00 -0.42 0.47 117.00 113.75 1ntr n LEU 114 Ca -0.00 1.34 -0.13 0.00 -0.00 0.00 0.00 56.01 57.22 1ntr n LEU 114 Cb 0.01 -0.36 -0.09 0.00 -0.00 0.00 0.00 43.42 42.98 1ntr n LEU 114 CO 0.01 -1.25 0.57 0.58 -0.00 0.00 0.00 177.39 177.30 1ntr h VAL 115 N 0.00 1.21 -1.05 1.96 2.07 -1.50 -3.10 116.25 115.84 1ntr h VAL 115 Ca 0.33 -1.12 0.34 0.00 0.82 0.00 0.00 66.70 67.07 1ntr h VAL 115 Cb 0.52 1.92 -0.08 0.00 -1.52 0.00 0.00 31.29 32.13 1ntr h VAL 115 CO -0.78 0.27 0.71 1.21 0.02 0.00 0.00 177.57 179.00 1ntr n GLU 116 N -4.89 -0.02 0.02 1.57 0.00 0.18 0.10 120.64 117.60 1ntr n GLU 116 Ca -0.09 0.81 -0.06 0.00 0.00 0.00 0.00 57.16 57.82 1ntr n GLU 116 Cb 0.26 -1.67 -0.05 0.00 0.00 0.00 0.00 31.44 29.99 1ntr n GLU 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ntr h ARG 117 N 0.00 -0.17 -0.52 5.31 3.08 -1.32 -3.29 114.38 117.47 1ntr h ARG 117 Ca 0.61 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.76 1ntr h ARG 117 Cb 2.11 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 32.09 1ntr h ARG 117 CO -0.22 0.11 -0.34 0.00 -1.07 0.00 0.00 179.97 178.46 1ntr h ALA 118 N -0.73 -0.11 -0.99 0.04 0.00 0.67 0.11 119.26 118.25 1ntr h ALA 118 Ca -0.02 0.14 0.32 0.00 0.00 0.00 0.00 54.91 55.36 1ntr h ALA 118 Cb 0.36 0.77 -0.18 0.00 0.00 0.00 0.00 17.79 18.73 1ntr h ALA 118 CO 0.03 -0.70 0.21 -0.89 0.00 0.00 0.00 179.25 177.89 1ntr n ILE 119 N -5.43 -0.42 0.11 0.00 5.41 -0.51 0.58 119.36 119.11 1ntr n ILE 119 Ca 0.03 2.11 0.07 0.00 1.00 0.00 0.00 62.75 65.96 1ntr n ILE 119 Cb 0.35 -3.21 0.01 0.00 -0.71 0.00 0.00 39.64 36.08 1ntr n ILE 119 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1ntr h SER 120 N 0.00 0.00 -0.90 4.38 4.64 -0.94 -3.38 113.55 117.35 1ntr h SER 120 Ca 0.69 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 62.13 1ntr h SER 120 Cb 1.60 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.55 1ntr h SER 120 CO -0.87 0.26 -0.39 1.57 -0.87 0.00 0.00 176.83 176.53 1ntr n HIS 121 N -2.92 -0.07 -1.41 4.77 -0.00 0.20 0.31 115.22 116.10 1ntr n HIS 121 Ca -0.02 1.11 -0.26 0.00 -0.00 0.00 0.00 57.72 58.55 1ntr n HIS 121 Cb 0.66 -0.77 -0.04 0.00 -0.00 0.00 0.00 29.99 29.84 1ntr n HIS 121 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 1ntr n TYR 122 N -5.27 1.67 0.15 1.57 4.11 -1.25 -4.49 117.16 113.64 1ntr n TYR 122 Ca 0.07 -1.98 0.00 0.00 -0.00 0.00 0.00 57.90 55.99 1ntr n TYR 122 Cb 0.33 -1.31 0.19 0.00 -0.00 0.00 0.00 39.34 38.55 1ntr n TYR 122 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.86 177.23 1ntr h GLN 123 N 2.74 0.00 0.00 -3.48 4.15 -0.40 -3.52 115.11 114.60 1ntr h GLN 123 Ca 0.39 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.81 1ntr h GLN 123 Cb 0.73 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.42 1ntr h GLN 123 CO 0.90 0.57 0.00 -1.91 -1.93 0.00 0.00 178.83 176.46