#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 0.00 -2.74 0.03 3.00 -1.26 -4.97 117.38 111.44 1ntr n GLN 2 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.98 1ntr n GLN 2 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 30.24 30.34 1ntr n GLN 2 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 1ntr n ARG 3 N -1.38 1.52 0.00 -1.09 0.63 -0.14 -4.86 116.66 111.34 1ntr n ARG 3 Ca 0.00 -2.17 0.00 0.00 -0.92 0.00 0.00 57.85 54.76 1ntr n ARG 3 Cb 0.00 -0.42 0.00 0.00 0.45 0.00 0.00 32.46 32.49 1ntr n ARG 3 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ntr n GLY 4 N -1.15 4.03 2.82 5.14 0.00 -1.26 -4.83 105.19 109.94 1ntr n GLY 4 Ca -0.08 -1.62 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.17 0.84 -0.19 -0.61 -1.09 -1.26 -1.27 121.20 115.45 1ntr s ILE 5 Ca 0.00 -0.63 0.00 0.00 -2.23 0.00 0.00 60.65 57.79 1ntr s ILE 5 Cb 0.00 -1.19 0.04 0.00 -1.58 0.00 0.00 42.46 39.74 1ntr s ILE 5 CO 0.00 -0.05 -0.07 -0.69 -1.23 0.00 0.00 174.94 172.89 1ntr s VAL 6 N 1.73 1.36 -0.84 2.92 1.01 -1.03 -1.51 120.40 124.03 1ntr s VAL 6 Ca -0.01 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 60.98 1ntr s VAL 6 Cb -0.16 -1.52 0.22 0.00 0.00 0.00 0.00 36.38 34.92 1ntr s VAL 6 CO -0.07 0.11 0.79 0.26 0.00 0.00 0.00 175.10 176.18 1ntr s TRP 7 N 1.51 3.78 0.33 5.22 0.52 -0.98 -2.13 118.94 127.19 1ntr s TRP 7 Ca -0.01 -2.02 -0.26 0.00 0.02 0.00 0.00 56.10 53.82 1ntr s TRP 7 Cb -0.16 -3.83 -0.09 0.00 -1.15 0.00 0.00 33.47 28.24 1ntr s TRP 7 CO -0.08 -0.99 1.01 0.08 0.02 0.00 0.00 176.95 176.99 1ntr s VAL 8 N 0.12 3.88 -0.45 4.03 1.01 0.40 -2.15 120.40 127.24 1ntr s VAL 8 Ca 0.19 1.61 -0.27 0.00 0.00 0.00 0.00 61.98 63.50 1ntr s VAL 8 Cb -0.10 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.39 1ntr s VAL 8 CO -0.09 0.17 1.03 -0.69 0.00 0.00 0.00 175.10 175.52 1ntr s VAL 9 N -1.50 4.37 1.13 2.92 1.01 -0.61 -1.85 120.40 125.87 1ntr s VAL 9 Ca 0.51 1.06 -0.15 0.00 0.00 0.00 0.00 61.98 63.40 1ntr s VAL 9 Cb -0.23 -4.50 0.20 0.00 0.00 0.00 0.00 36.38 31.84 1ntr s VAL 9 CO 0.29 -0.86 0.58 0.47 0.00 0.00 0.00 175.10 175.57 1ntr n ASP 10 N 7.41 -1.94 -0.63 3.32 8.00 0.62 -2.27 116.55 131.06 1ntr n ASP 10 Ca 0.09 -0.10 0.04 0.00 0.71 0.00 0.00 54.79 55.53 1ntr n ASP 10 Cb 0.49 -1.14 0.06 0.00 -0.02 0.00 0.00 41.12 40.51 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 -3.40 0.98 0.00 -2.24 8.00 -1.26 -4.56 116.55 114.07 1ntr n ASP 11 Ca 0.03 -2.49 0.00 0.00 0.71 0.00 0.00 54.79 53.04 1ntr n ASP 11 Cb 0.57 -0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1ntr n ASP 11 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ntr n ASP 12 N -0.36 0.00 -4.79 -2.24 9.92 -1.26 -4.79 116.55 113.02 1ntr n ASP 12 Ca 0.07 0.00 -0.36 0.00 -0.53 0.00 0.00 54.79 53.98 1ntr n ASP 12 Cb 0.78 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 41.20 1ntr n ASP 12 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1ntr s SER 13 N 0.00 7.09 0.00 -2.24 1.04 -1.26 -3.15 113.70 115.18 1ntr s SER 13 Ca 0.00 1.83 0.00 0.00 0.48 0.00 0.00 55.95 58.26 1ntr s SER 13 Cb 0.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1ntr s SER 13 CO 0.00 -0.25 0.00 -0.24 0.98 0.00 0.00 173.24 173.73 1ntr n SER 14 N 0.03 -1.69 0.08 7.02 2.88 -1.26 -4.85 113.62 115.84 1ntr n SER 14 Ca 0.04 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.48 1ntr n SER 14 Cb 0.51 -0.81 -0.07 0.00 -0.75 0.00 0.00 64.21 63.09 1ntr n SER 14 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1ntr h ILE 15 N 0.00 1.56 -0.28 2.46 1.08 -1.96 -2.83 117.51 117.53 1ntr h ILE 15 Ca 0.00 -2.95 0.02 0.00 -0.39 0.00 0.00 64.86 61.53 1ntr h ILE 15 Cb 0.10 2.69 -0.02 0.00 -3.07 0.00 0.00 36.82 36.52 1ntr h ILE 15 CO 0.00 0.86 0.15 -0.09 -0.69 0.00 0.00 178.15 178.37 1ntr h ARG 16 N 0.07 0.30 0.48 2.37 2.43 -1.89 -2.62 114.38 115.52 1ntr h ARG 16 Ca -0.06 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1ntr h ARG 16 Cb 1.69 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 31.17 1ntr h ARG 16 CO 0.15 0.20 -0.29 2.35 -1.51 0.00 0.00 179.97 180.87 1ntr h TRP 17 N 0.31 -0.77 -0.07 2.20 7.01 -1.96 -2.29 115.95 120.38 1ntr h TRP 17 Ca 0.11 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.11 1ntr h TRP 17 Cb 0.02 0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.34 1ntr h TRP 17 CO -0.09 -0.43 -0.04 0.28 -2.79 0.00 0.00 178.44 175.36 1ntr n VAL 18 N -4.14 -0.05 0.00 2.65 0.31 -1.07 -0.79 118.33 115.23 1ntr n VAL 18 Ca -0.09 1.34 0.00 0.00 -0.01 0.00 0.00 64.34 65.58 1ntr n VAL 18 Cb 0.30 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.45 1ntr n VAL 18 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1ntr n LEU 19 N -3.04 0.00 -0.53 7.52 4.77 -1.00 -1.23 117.00 123.49 1ntr n LEU 19 Ca 0.00 0.70 0.41 0.00 -0.03 0.00 0.00 56.01 57.09 1ntr n LEU 19 Cb 0.02 -0.20 0.63 0.00 -2.33 0.00 0.00 43.42 41.54 1ntr n LEU 19 CO -0.01 -0.20 1.18 1.21 -1.33 0.00 0.00 177.39 178.24 1ntr n GLU 20 N -1.46 0.00 0.22 3.23 4.07 -0.86 0.96 120.64 126.81 1ntr n GLU 20 Ca 0.00 0.87 -0.14 0.00 -0.06 0.00 0.00 57.16 57.83 1ntr n GLU 20 Cb 0.00 -2.02 -0.08 0.00 -0.06 0.00 0.00 31.44 29.28 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 -0.56 0.00 5.31 2.43 0.48 0.28 114.38 122.32 1ntr h ARG 21 Ca 0.72 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.92 1ntr h ARG 21 Cb 2.98 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 32.65 1ntr h ARG 21 CO -0.01 -0.26 0.00 0.00 -1.51 0.00 0.00 179.97 178.20 1ntr n ALA 22 N -2.51 1.72 0.76 2.80 0.00 0.27 -1.66 120.51 121.89 1ntr n ALA 22 Ca -0.10 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.36 1ntr n ALA 22 Cb 0.29 -1.22 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 1ntr n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ntr n LEU 23 N -1.36 1.57 0.07 0.00 7.99 -0.55 -4.30 117.00 120.42 1ntr n LEU 23 Ca 0.05 -0.73 -0.01 0.00 -0.01 0.00 0.00 56.01 55.31 1ntr n LEU 23 Cb 0.12 0.00 -0.06 0.00 -0.11 0.00 0.00 43.42 43.37 1ntr n LEU 23 CO 0.11 0.30 0.01 0.00 -1.51 0.00 0.00 177.39 176.31 1ntr h ALA 24 N 2.87 0.62 -0.08 -1.18 0.00 0.47 -2.81 119.26 119.14 1ntr h ALA 24 Ca 0.00 -0.80 -0.24 0.00 0.00 0.00 0.00 54.91 53.87 1ntr h ALA 24 Cb 0.55 0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.47 1ntr h ALA 24 CO 0.00 0.96 -0.88 0.78 0.00 0.00 0.00 179.25 180.12 1ntr h GLY 25 N 3.49 0.81 1.30 0.00 0.00 -1.75 -3.19 103.07 103.74 1ntr h GLY 25 Ca -0.10 -1.27 -0.13 0.00 0.00 0.00 0.00 47.33 45.83 1ntr h GLY 25 CO 0.07 1.13 -0.27 0.00 0.00 0.00 0.00 176.54 177.47 1ntr h ALA 26 N 0.47 0.80 -0.27 3.60 0.00 -1.75 -3.48 119.26 118.64 1ntr h ALA 26 Ca -0.09 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ntr h ALA 26 Cb 1.52 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1ntr h ALA 26 CO 0.18 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.48 1ntr n GLY 27 N -0.13 0.88 3.36 0.00 0.00 -1.11 -4.96 105.19 103.23 1ntr n GLY 27 Ca -0.00 -0.77 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.25 1.82 -1.09 0.99 1.02 -1.08 -0.96 118.68 119.12 1ntr s LEU 28 Ca 0.00 -1.74 -0.07 0.00 0.02 0.00 0.00 54.13 52.34 1ntr s LEU 28 Cb 0.00 0.35 0.29 0.00 0.02 0.00 0.00 46.19 46.85 1ntr s LEU 28 CO 0.00 -1.03 1.27 0.41 0.02 0.00 0.00 176.35 177.02 1ntr n THR 29 N -0.72 4.87 -2.60 5.49 -1.04 -0.40 -4.74 114.28 115.13 1ntr n THR 29 Ca 0.03 -5.63 -0.42 0.00 -2.04 0.00 0.00 64.05 56.00 1ntr n THR 29 Cb 0.63 -2.36 -0.03 0.00 -1.82 0.00 0.00 70.33 66.76 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 4.61 5.31 0.03 0.00 2.01 -0.91 -4.40 115.64 122.30 1ntr s THR 31 Ca 0.46 0.10 -0.00 0.00 0.31 0.00 0.00 61.69 62.56 1ntr s THR 31 Cb -0.00 -3.57 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 1ntr s THR 31 CO -0.08 0.33 -0.03 0.42 -0.69 0.00 0.00 174.62 174.58 1ntr s THR 32 N -1.33 0.14 -0.07 -0.82 -4.23 -1.26 -0.46 115.64 107.62 1ntr s THR 32 Ca 0.28 -1.11 -0.00 0.00 -1.18 0.00 0.00 61.69 59.68 1ntr s THR 32 Cb -0.13 -0.54 0.03 0.00 1.34 0.00 0.00 72.50 73.20 1ntr s THR 32 CO 0.17 -0.61 -0.03 -0.36 -0.54 0.00 0.00 174.62 173.26 1ntr s PHE 33 N -1.99 0.84 0.25 3.99 0.08 -0.77 -4.78 117.98 115.59 1ntr s PHE 33 Ca -0.11 -0.28 -0.10 0.00 0.12 0.00 0.00 56.93 56.56 1ntr s PHE 33 Cb -0.06 -0.84 0.36 0.00 -0.57 0.00 0.00 43.02 41.91 1ntr s PHE 33 CO -0.03 -0.32 1.60 0.93 -0.10 0.00 0.00 175.22 177.30 1ntr h GLU 34 N 7.95 0.01 -6.28 0.44 3.07 -1.89 0.18 114.58 118.06 1ntr h GLU 34 Ca -0.27 -0.00 -0.69 0.00 -0.50 0.00 0.00 59.36 57.90 1ntr h GLU 34 Cb 1.13 -0.00 -0.27 0.00 -0.84 0.00 0.00 28.75 28.77 1ntr h GLU 34 CO 0.35 0.00 -0.83 -0.80 -1.40 0.00 0.00 179.01 176.33 1ntr s ASN 35 N -5.24 3.51 0.34 1.42 0.02 -1.26 -4.26 114.94 109.46 1ntr s ASN 35 Ca -0.14 -0.36 0.20 0.00 -1.02 0.00 0.00 52.86 51.53 1ntr s ASN 35 Cb 0.23 -0.74 1.08 0.00 0.02 0.00 0.00 41.25 41.85 1ntr s ASN 35 CO 0.76 0.30 1.58 1.23 0.02 0.00 0.00 177.10 180.99 1ntr h GLY 36 N 5.64 0.00 0.00 0.66 0.00 -1.82 -2.76 103.07 104.78 1ntr h GLY 36 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1ntr h GLY 36 CO 0.49 0.00 0.00 -2.01 0.00 0.00 0.00 176.54 175.02 1ntr n ASN 37 N -2.23 0.00 -0.51 0.19 5.15 -1.26 -1.33 115.26 115.28 1ntr n ASN 37 Ca -0.01 0.08 0.39 0.00 -0.60 0.00 0.00 54.58 54.43 1ntr n ASN 37 Cb 0.12 0.00 0.62 0.00 -0.53 0.00 0.00 39.78 39.99 1ntr n ASN 37 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1ntr n GLU 38 N -0.12 -0.01 0.39 1.20 2.13 -1.21 0.13 120.64 123.15 1ntr n GLU 38 Ca 0.00 0.89 -0.18 0.00 0.66 0.00 0.00 57.16 58.54 1ntr n GLU 38 Cb 0.00 -1.97 -0.09 0.00 0.27 0.00 0.00 31.44 29.66 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 0.22 0.00 6.31 2.07 -1.46 0.23 116.25 123.63 1ntr h VAL 39 Ca 0.73 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 68.13 1ntr h VAL 39 Cb 2.77 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1ntr h VAL 39 CO -0.12 0.01 0.00 0.25 0.02 0.00 0.00 177.57 177.74 1ntr h LEU 40 N -1.08 0.00 0.00 2.57 7.12 0.24 -0.33 115.31 123.83 1ntr h LEU 40 Ca -0.10 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.88 1ntr h LEU 40 Cb 0.77 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.90 1ntr h LEU 40 CO 0.16 0.00 -1.20 0.00 -0.13 0.00 0.00 178.44 177.27 1ntr n ALA 41 N -1.88 2.45 0.03 1.25 0.00 -0.42 -3.39 120.51 118.55 1ntr n ALA 41 Ca -0.00 -0.33 0.09 0.00 0.00 0.00 0.00 53.44 53.20 1ntr n ALA 41 Cb 0.15 -1.03 -0.09 0.00 0.00 0.00 0.00 19.45 18.47 1ntr n ALA 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ntr n ALA 42 N -2.23 2.52 -1.44 0.00 0.00 0.76 -4.75 120.51 115.37 1ntr n ALA 42 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1ntr n ALA 42 Cb 0.61 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.18 1ntr n ALA 42 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ntr n LEU 43 N -2.52 0.00 0.00 0.00 4.77 -0.22 -4.87 117.00 114.15 1ntr n LEU 43 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1ntr n LEU 43 Cb 0.63 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1ntr n LEU 43 CO 0.43 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.49 1ntr n ALA 44 N -3.00 0.00 0.95 -1.18 0.00 -1.22 -4.19 120.51 111.87 1ntr n ALA 44 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1ntr n ALA 44 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1ntr n ALA 44 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ntr n SER 45 N 3.35 1.82 -2.31 0.00 7.64 -1.26 -4.02 113.62 118.85 1ntr n SER 45 Ca 0.00 -1.41 -0.02 0.00 1.01 0.00 0.00 58.87 58.45 1ntr n SER 45 Cb 0.00 0.55 -0.02 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.24 -4.33 -0.07 1.43 5.02 -1.26 -4.85 118.16 113.86 1ntr n LYS 46 Ca 0.08 3.25 -0.07 0.00 -2.02 0.00 0.00 58.31 59.55 1ntr n LYS 46 Cb 0.43 -4.38 -0.02 0.00 -0.02 0.00 0.00 35.03 31.04 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 1.55 1.21 -0.36 -0.18 -1.04 -1.26 -4.91 114.28 109.30 1ntr n THR 47 Ca -0.17 0.21 -0.11 0.00 -2.04 0.00 0.00 64.05 61.94 1ntr n THR 47 Cb 0.27 -2.17 0.11 0.00 -1.82 0.00 0.00 70.33 66.72 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 -4.07 -1.05 0.03 -2.82 -0.04 -1.26 -4.90 135.00 120.89 1ntr n PRO 48 Ca -0.11 -0.53 0.01 0.00 -0.04 0.00 0.00 63.50 62.82 1ntr n PRO 48 Cb 0.41 -1.06 -0.08 0.00 -0.04 0.00 0.00 33.50 32.72 1ntr n PRO 48 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ntr n ASP 49 N -1.42 0.80 -3.73 3.54 8.00 -0.57 -4.87 116.55 118.31 1ntr n ASP 49 Ca 0.05 0.35 -0.12 0.00 0.71 0.00 0.00 54.79 55.78 1ntr n ASP 49 Cb 0.22 0.27 -0.12 0.00 -0.02 0.00 0.00 41.12 41.48 1ntr n ASP 49 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ntr s VAL 50 N -2.96 -0.03 -0.22 2.53 1.01 -0.76 -4.26 120.40 115.71 1ntr s VAL 50 Ca -0.03 0.09 -0.10 0.00 0.00 0.00 0.00 61.98 61.95 1ntr s VAL 50 Cb 0.09 -0.47 -0.05 0.00 0.00 0.00 0.00 36.38 35.95 1ntr s VAL 50 CO 0.81 0.04 0.13 -0.76 0.00 0.00 0.00 175.10 175.32 1ntr s LEU 51 N 1.04 4.02 0.48 3.92 2.01 -1.02 -2.32 118.68 126.81 1ntr s LEU 51 Ca -0.07 0.10 0.07 0.00 0.01 0.00 0.00 54.13 54.24 1ntr s LEU 51 Cb -0.08 -2.06 0.01 0.00 0.01 0.00 0.00 46.19 44.07 1ntr s LEU 51 CO -0.08 0.10 0.39 -0.22 1.01 0.00 0.00 176.35 177.55 1ntr s LEU 52 N 0.82 3.02 -0.24 1.79 0.20 -0.91 -1.61 118.68 121.76 1ntr s LEU 52 Ca 0.07 -1.02 -0.10 0.00 0.69 0.00 0.00 54.13 53.76 1ntr s LEU 52 Cb -0.13 -1.56 0.09 0.00 -0.43 0.00 0.00 46.19 44.17 1ntr s LEU 52 CO 0.02 -0.89 0.53 -0.44 -0.29 0.00 0.00 176.35 175.29 1ntr s SER 53 N -4.20 -0.69 0.61 3.68 0.01 -0.50 -1.58 113.70 111.03 1ntr s SER 53 Ca 0.42 1.24 -0.02 0.00 1.31 0.00 0.00 55.95 58.89 1ntr s SER 53 Cb -0.02 1.50 0.04 0.00 0.21 0.00 0.00 66.02 67.75 1ntr s SER 53 CO 0.25 -0.22 0.87 -0.62 0.41 0.00 0.00 173.24 173.93 1ntr s ASP 54 N 2.25 5.11 -0.14 2.44 2.15 -0.96 -1.95 116.67 125.56 1ntr s ASP 54 Ca -0.06 0.19 -0.04 0.00 0.43 0.00 0.00 52.55 53.07 1ntr s ASP 54 Cb -0.10 -0.99 0.07 0.00 -0.30 0.00 0.00 42.92 41.60 1ntr s ASP 54 CO -0.16 -1.31 0.19 -0.51 -0.17 0.00 0.00 175.17 173.21 1ntr s ILE 55 N -2.95 -0.29 0.00 4.11 1.10 -1.26 -4.68 121.20 117.22 1ntr s ILE 55 Ca 0.58 0.12 0.00 0.00 -0.51 0.00 0.00 60.65 60.84 1ntr s ILE 55 Cb -0.10 -0.49 0.00 0.00 0.15 0.00 0.00 42.46 42.02 1ntr s ILE 55 CO 0.41 -0.03 0.00 0.54 -2.11 0.00 0.00 174.94 173.75 1ntr n ARG 56 N 5.32 0.57 -3.28 3.50 1.74 -1.26 -4.98 116.66 118.27 1ntr n ARG 56 Ca -0.05 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.59 1ntr n ARG 56 Cb 0.50 -0.45 -0.07 0.00 -1.02 0.00 0.00 32.46 31.41 1ntr n ARG 56 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ntr s MET 57 N -0.89 3.04 0.22 5.56 0.23 -1.26 -5.04 119.30 121.16 1ntr s MET 57 Ca 0.00 -1.15 -0.30 0.00 -1.03 0.00 0.00 55.69 53.21 1ntr s MET 57 Cb 0.00 -4.12 -0.08 0.00 -1.53 0.00 0.00 34.83 29.09 1ntr s MET 57 CO 0.00 -1.12 1.07 -1.25 -2.03 0.00 0.00 175.02 171.69 1ntr s PRO 58 N 2.10 4.66 0.00 3.16 0.04 -1.26 -3.82 135.00 139.87 1ntr s PRO 58 Ca 0.09 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1ntr s PRO 58 Cb -0.22 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.07 1ntr s PRO 58 CO 0.09 0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.74 1ntr n GLY 59 N 1.66 0.43 1.77 0.56 0.00 -1.26 -4.88 105.19 103.48 1ntr n GLY 59 Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1ntr n GLY 59 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ntr n MET 60 N 0.00 0.47 0.00 1.61 2.81 -1.26 -4.85 117.12 115.90 1ntr n MET 60 Ca 0.00 -2.04 0.00 0.00 -1.81 0.00 0.00 57.70 53.85 1ntr n MET 60 Cb 0.00 -0.19 0.00 0.00 -0.71 0.00 0.00 33.22 32.32 1ntr n MET 60 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1ntr n ASP 61 N -0.00 0.20 0.00 7.83 9.92 -1.26 -4.71 116.55 128.53 1ntr n ASP 61 Ca -0.03 -1.06 0.00 0.00 -0.53 0.00 0.00 54.79 53.17 1ntr n ASP 61 Cb 0.96 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.44 1ntr n ASP 61 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ntr n GLY 62 N -0.03 -0.07 0.00 0.44 0.00 -1.25 -4.72 105.19 99.56 1ntr n GLY 62 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 1ntr n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ntr n LEU 63 N -0.42 0.00 0.22 0.99 4.32 -1.26 -3.20 117.00 117.65 1ntr n LEU 63 Ca 0.00 0.03 0.09 0.00 -0.02 0.00 0.00 56.01 56.11 1ntr n LEU 63 Cb 0.00 -0.03 0.51 0.00 -1.62 0.00 0.00 43.42 42.29 1ntr n LEU 63 CO 0.00 -0.00 0.82 0.00 -1.22 0.00 0.00 177.39 176.99 1ntr h ALA 64 N 3.86 1.14 -0.00 -1.18 0.00 -1.84 -1.65 119.26 119.59 1ntr h ALA 64 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ntr h ALA 64 Cb 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ntr h ALA 64 CO 0.00 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.83 1ntr n LEU 65 N -3.58 0.25 0.10 0.00 4.32 -1.19 -3.05 117.00 113.85 1ntr n LEU 65 Ca -0.01 -0.08 0.13 0.00 -0.02 0.00 0.00 56.01 56.03 1ntr n LEU 65 Cb 0.38 -0.00 0.43 0.00 -1.62 0.00 0.00 43.42 42.61 1ntr n LEU 65 CO 0.33 0.04 0.88 0.18 -1.22 0.00 0.00 177.39 177.61 1ntr n LEU 66 N -0.80 0.76 -0.02 2.23 7.99 -0.62 -2.71 117.00 123.83 1ntr n LEU 66 Ca 0.23 0.59 -0.16 0.00 -0.01 0.00 0.00 56.01 56.66 1ntr n LEU 66 Cb 0.15 -0.37 -0.09 0.00 -0.11 0.00 0.00 43.42 43.00 1ntr n LEU 66 CO 0.17 -0.24 0.36 0.50 -1.51 0.00 0.00 177.39 176.68 1ntr h LYS 67 N 0.00 0.47 0.05 3.23 1.63 -1.71 -3.26 116.57 116.98 1ntr h LYS 67 Ca 0.00 -0.40 -0.00 0.00 -0.85 0.00 0.00 60.65 59.40 1ntr h LYS 67 Cb 0.66 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.38 1ntr h LYS 67 CO 0.00 1.03 -0.02 -0.56 -3.45 0.00 0.00 179.45 176.45 1ntr h GLN 68 N 0.03 -0.07 -0.62 1.90 3.07 -1.77 -2.27 115.11 115.39 1ntr h GLN 68 Ca -0.04 0.00 0.06 0.00 0.09 0.00 0.00 58.65 58.76 1ntr h GLN 68 Cb 1.14 0.01 -0.07 0.00 0.08 0.00 0.00 27.48 28.64 1ntr h GLN 68 CO 0.10 0.39 -0.37 1.51 0.09 0.00 0.00 178.83 180.55 1ntr n ILE 69 N -4.90 -0.42 0.14 1.86 3.06 -1.10 -1.15 119.36 116.85 1ntr n ILE 69 Ca -0.08 1.59 -0.12 0.00 -2.50 0.00 0.00 62.75 61.64 1ntr n ILE 69 Cb 0.25 -1.98 -0.07 0.00 0.54 0.00 0.00 39.64 38.38 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 -0.39 -1.07 9.51 1.63 -1.62 -2.53 116.57 122.09 1ntr h LYS 70 Ca 0.10 0.03 0.31 0.00 -0.85 0.00 0.00 60.65 60.24 1ntr h LYS 70 Cb 0.26 0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.93 1ntr h LYS 70 CO -0.59 -0.05 1.01 0.94 -3.45 0.00 0.00 179.45 177.31 1ntr n GLN 71 N -5.08 0.01 -0.09 1.90 7.27 -0.30 -1.72 117.38 119.37 1ntr n GLN 71 Ca -0.09 0.81 -0.18 0.00 0.07 0.00 0.00 57.00 57.61 1ntr n GLN 71 Cb 0.27 -1.96 -0.07 0.00 2.41 0.00 0.00 30.24 30.89 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 -3.05 0.38 -4.17 3.69 3.00 -0.65 -4.99 116.66 110.87 1ntr n ARG 72 Ca 0.24 0.16 -0.35 0.00 -0.00 0.00 0.00 57.85 57.90 1ntr n ARG 72 Cb 1.33 -1.17 -0.09 0.00 0.00 0.00 0.00 32.46 32.53 1ntr n ARG 72 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1ntr s HIS 73 N -2.33 3.23 -0.35 -0.14 -3.43 -0.70 -4.85 115.29 106.72 1ntr s HIS 73 Ca -0.25 0.12 -0.00 0.00 -0.80 0.00 0.00 55.06 54.13 1ntr s HIS 73 Cb 0.09 -1.95 0.12 0.00 -1.43 0.00 0.00 32.58 29.41 1ntr s HIS 73 CO 0.33 0.31 0.17 -1.25 -2.00 0.00 0.00 174.74 172.29 1ntr s PRO 74 N -0.23 0.78 0.00 -0.38 0.04 -1.26 -4.50 135.00 129.45 1ntr s PRO 74 Ca 0.07 -1.33 0.00 0.00 0.04 0.00 0.00 61.00 59.78 1ntr s PRO 74 Cb -0.12 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1ntr s PRO 74 CO 0.02 -1.09 0.00 -1.33 0.04 0.00 0.00 177.00 174.64 1ntr n MET 75 N 4.36 0.00 -0.40 4.56 2.81 -1.26 -5.04 117.12 122.14 1ntr n MET 75 Ca 0.03 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.66 1ntr n MET 75 Cb 0.39 0.00 0.23 0.00 -0.71 0.00 0.00 33.22 33.13 1ntr n MET 75 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 1ntr n LEU 76 N 0.00 -1.10 -4.93 4.03 -0.00 -1.26 -4.98 117.00 108.76 1ntr n LEU 76 Ca 0.00 -0.54 -0.27 0.00 -0.00 0.00 0.00 56.01 55.20 1ntr n LEU 76 Cb 0.00 -0.96 0.11 0.00 -0.00 0.00 0.00 43.42 42.57 1ntr n LEU 76 CO 0.00 -3.84 0.71 -2.16 -0.00 0.00 0.00 177.39 172.10 1ntr s PRO 77 N -4.28 1.67 -0.11 1.47 0.04 -1.26 -4.89 135.00 127.64 1ntr s PRO 77 Ca 0.56 -0.34 -0.01 0.00 0.04 0.00 0.00 61.00 61.25 1ntr s PRO 77 Cb -0.12 -2.07 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1ntr s PRO 77 CO 0.52 -1.65 -0.03 0.08 0.04 0.00 0.00 177.00 175.96 1ntr s VAL 78 N -3.46 0.72 -0.10 -0.36 1.01 -1.00 -2.42 120.40 114.78 1ntr s VAL 78 Ca 0.65 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.45 1ntr s VAL 78 Cb -0.08 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 1ntr s VAL 78 CO 0.48 0.24 -0.12 -0.63 0.00 0.00 0.00 175.10 175.06 1ntr s ILE 79 N 1.82 3.15 0.32 2.22 1.01 -0.63 -4.27 121.20 124.82 1ntr s ILE 79 Ca 0.04 -0.65 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1ntr s ILE 79 Cb -0.13 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.99 1ntr s ILE 79 CO -0.07 0.55 0.10 0.27 0.00 0.00 0.00 174.94 175.78 1ntr s ILE 80 N -0.03 0.79 0.38 2.92 -4.36 -1.26 -1.41 121.20 118.23 1ntr s ILE 80 Ca -0.03 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.24 1ntr s ILE 80 Cb -0.14 -2.62 -0.07 0.00 1.25 0.00 0.00 42.46 40.87 1ntr s ILE 80 CO 0.04 0.00 0.76 -0.04 0.24 0.00 0.00 174.94 175.94 1ntr s MET 81 N -3.88 3.86 0.02 0.37 -1.94 -0.82 -0.97 119.30 115.93 1ntr s MET 81 Ca 0.34 0.55 -0.19 0.00 -1.71 0.00 0.00 55.69 54.68 1ntr s MET 81 Cb 0.07 -2.40 -0.06 0.00 2.01 0.00 0.00 34.83 34.45 1ntr s MET 81 CO 0.15 0.03 0.55 0.95 -0.01 0.00 0.00 175.02 176.69 1ntr s THR 82 N -2.24 4.88 0.00 2.05 -4.23 -0.66 -4.72 115.64 110.72 1ntr s THR 82 Ca 0.52 1.16 0.00 0.00 -1.18 0.00 0.00 61.69 62.19 1ntr s THR 82 Cb -0.10 -3.88 0.00 0.00 1.34 0.00 0.00 72.50 69.86 1ntr s THR 82 CO 0.26 0.49 0.00 0.00 -0.54 0.00 0.00 174.62 174.83 1ntr n ALA 83 N 2.27 0.00 -3.63 3.99 0.00 -1.26 -4.90 120.51 116.99 1ntr n ALA 83 Ca -0.09 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.26 1ntr n ALA 83 Cb 0.51 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 1ntr n ALA 83 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1ntr s HIS 84 N 0.00 -0.33 -0.88 0.00 4.02 -1.26 -4.95 115.29 111.89 1ntr s HIS 84 Ca 0.00 0.04 -0.26 0.00 1.02 0.00 0.00 55.06 55.86 1ntr s HIS 84 Cb 0.00 0.62 -0.14 0.00 -1.02 0.00 0.00 32.58 32.04 1ntr s HIS 84 CO 0.00 -0.91 2.27 0.45 1.02 0.00 0.00 174.74 177.57 1ntr s SER 85 N -2.79 4.02 -1.63 1.40 0.15 -1.26 -1.74 113.70 111.85 1ntr s SER 85 Ca 0.07 -0.32 -0.00 0.00 0.70 0.00 0.00 55.95 56.39 1ntr s SER 85 Cb -0.03 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1ntr s SER 85 CO -0.04 -3.87 0.01 0.47 1.20 0.00 0.00 173.24 171.02 1ntr n ASP 86 N 18.06 -5.51 -3.09 5.45 8.00 -1.26 -0.67 116.55 137.53 1ntr n ASP 86 Ca 0.45 -0.02 -0.19 0.00 0.71 0.00 0.00 54.79 55.73 1ntr n ASP 86 Cb 0.45 -4.55 -0.04 0.00 -0.02 0.00 0.00 41.12 36.96 1ntr n ASP 86 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ntr n LEU 87 N -2.77 -0.37 0.00 0.64 -0.00 -0.71 -0.83 117.00 112.96 1ntr n LEU 87 Ca -0.22 -0.39 0.00 0.00 -0.00 0.00 0.00 56.01 55.40 1ntr n LEU 87 Cb 0.67 -1.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.05 1ntr n LEU 87 CO 0.27 0.04 0.00 -0.67 -0.00 0.00 0.00 177.39 177.03 1ntr n ASP 88 N -1.49 0.00 -0.22 1.45 -0.08 0.16 0.27 116.55 116.63 1ntr n ASP 88 Ca 0.05 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 1ntr n ASP 88 Cb 0.37 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.83 1ntr n ASP 88 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ntr n ALA 89 N 0.00 1.87 -0.74 -1.67 0.00 -1.26 -3.14 120.51 115.57 1ntr n ALA 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ntr n ALA 89 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1ntr n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ntr n ALA 90 N -0.16 2.26 -0.61 0.00 0.00 0.75 -4.38 120.51 118.38 1ntr n ALA 90 Ca 0.00 0.00 0.47 0.00 0.00 0.00 0.00 53.44 53.91 1ntr n ALA 90 Cb 0.05 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.22 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 -1.40 0.00 -2.71 0.00 0.31 -0.01 -4.34 118.33 110.18 1ntr n VAL 91 Ca 0.00 1.33 0.00 0.00 -0.01 0.00 0.00 64.34 65.66 1ntr n VAL 91 Cb 0.00 -2.23 0.00 0.00 -0.91 0.00 0.00 33.84 30.70 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 -3.68 0.33 -0.09 4.52 7.64 -1.19 -4.89 113.62 116.27 1ntr n SER 92 Ca 0.39 -0.54 0.00 0.00 1.01 0.00 0.00 58.87 59.72 1ntr n SER 92 Cb 1.80 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 65.00 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 -0.17 -0.43 0.00 -1.26 -4.01 120.51 111.64 1ntr n ALA 93 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1ntr n ALA 93 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1ntr n ALA 93 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1ntr h TYR 94 N 0.00 -1.49 -6.28 0.00 -1.99 -1.95 -3.45 116.97 101.81 1ntr h TYR 94 Ca 0.00 0.08 -0.45 0.00 2.00 0.00 0.00 58.73 60.36 1ntr h TYR 94 Cb 0.00 0.72 0.04 0.00 2.00 0.00 0.00 36.73 39.48 1ntr h TYR 94 CO 0.00 -0.46 -0.91 0.94 -0.00 0.00 0.00 178.16 177.74 1ntr n GLN 95 N -5.39 -2.47 0.00 4.88 0.00 -1.26 -4.84 117.38 108.31 1ntr n GLN 95 Ca -0.01 0.47 0.00 0.00 -0.00 0.00 0.00 57.00 57.46 1ntr n GLN 95 Cb 0.34 -4.43 0.00 0.00 0.00 0.00 0.00 30.24 26.15 1ntr n GLN 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ntr n GLN 96 N -4.26 0.00 0.00 3.69 -0.00 -1.26 -4.94 117.38 110.61 1ntr n GLN 96 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.80 1ntr n GLN 96 Cb 0.64 -0.47 0.00 0.00 -0.00 0.00 0.00 30.24 30.40 1ntr n GLN 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ntr n GLY 97 N 0.77 -2.96 0.00 2.61 0.00 -1.26 -4.94 105.19 99.42 1ntr n GLY 97 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.79 0.00 -3.90 4.61 0.00 -1.26 -5.01 120.51 113.16 1ntr n ALA 98 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1ntr n ALA 98 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1ntr n ALA 98 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ntr n PHE 99 N 0.00 -0.34 0.00 0.00 3.01 -1.26 -2.38 117.46 116.49 1ntr n PHE 99 Ca 0.00 -1.77 0.00 0.00 1.01 0.00 0.00 57.45 56.69 1ntr n PHE 99 Cb 0.00 0.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1ntr n PHE 99 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1ntr n ASP 100 N -2.03 0.00 -0.37 4.37 2.03 -1.26 -4.99 116.55 114.30 1ntr n ASP 100 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 1ntr n ASP 100 Cb 0.39 0.06 0.00 0.00 -0.72 0.00 0.00 41.12 40.85 1ntr n ASP 100 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1ntr n TYR 101 N -1.73 -1.01 -3.85 -0.67 4.01 -1.25 -5.00 117.16 107.66 1ntr n TYR 101 Ca 0.00 0.53 -0.26 0.00 -0.16 0.00 0.00 57.90 58.01 1ntr n TYR 101 Cb 0.00 -1.73 -0.17 0.00 -0.31 0.00 0.00 39.34 37.13 1ntr n TYR 101 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1ntr s LEU 102 N -1.88 1.03 0.69 7.72 2.96 -0.14 -4.91 118.68 124.14 1ntr s LEU 102 Ca 0.00 -0.30 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 1ntr s LEU 102 Cb 0.00 -0.70 0.13 0.00 0.50 0.00 0.00 46.19 46.12 1ntr s LEU 102 CO 0.00 -0.16 0.95 -2.16 -1.32 0.00 0.00 176.35 173.66 1ntr s PRO 103 N 1.80 1.78 0.17 0.98 0.04 -1.26 -1.65 135.00 136.85 1ntr s PRO 103 Ca 0.04 -1.37 0.09 0.00 0.04 0.00 0.00 61.00 59.79 1ntr s PRO 103 Cb -0.13 -2.43 -0.04 0.00 0.04 0.00 0.00 34.50 31.94 1ntr s PRO 103 CO -0.07 -1.34 -0.09 0.15 0.04 0.00 0.00 177.00 175.69 1ntr s LYS 104 N -5.02 2.10 0.59 4.56 3.01 -1.26 -4.19 119.74 119.52 1ntr s LYS 104 Ca 0.66 -1.22 -0.03 0.00 -1.01 0.00 0.00 55.97 54.36 1ntr s LYS 104 Cb -0.05 -2.19 0.03 0.00 -1.01 0.00 0.00 37.83 34.61 1ntr s LYS 104 CO 0.43 0.45 0.87 -1.25 0.51 0.00 0.00 175.35 176.35 1ntr s PRO 105 N -2.76 2.66 0.01 -1.68 0.04 -1.26 -5.20 135.00 126.81 1ntr s PRO 105 Ca 0.25 -0.32 -0.18 0.00 0.04 0.00 0.00 61.00 60.78 1ntr s PRO 105 Cb -0.09 -2.34 0.03 0.00 0.04 0.00 0.00 34.50 32.14 1ntr s PRO 105 CO 0.15 -0.78 0.39 -0.59 0.04 0.00 0.00 177.00 176.21 1ntr s PHE 106 N -2.94 -0.26 0.84 0.56 -0.71 -1.26 -5.17 117.98 109.05 1ntr s PHE 106 Ca 0.55 0.32 -0.11 0.00 -1.04 0.00 0.00 56.93 56.65 1ntr s PHE 106 Cb -0.10 0.18 0.13 0.00 -1.21 0.00 0.00 43.02 42.01 1ntr s PHE 106 CO 0.42 -0.49 1.19 0.34 -1.34 0.00 0.00 175.22 175.34 1ntr s ASP 107 N -1.63 3.97 -0.08 1.98 2.15 -1.26 -5.03 116.67 116.77 1ntr s ASP 107 Ca -0.09 0.38 -0.05 0.00 0.43 0.00 0.00 52.55 53.22 1ntr s ASP 107 Cb -0.03 -0.71 -0.02 0.00 -0.30 0.00 0.00 42.92 41.87 1ntr s ASP 107 CO 0.02 -2.19 -0.10 -0.38 -0.17 0.00 0.00 175.17 172.35 1ntr n ILE 108 N -3.38 0.77 -0.12 4.11 2.08 -1.26 -3.65 119.36 117.90 1ntr n ILE 108 Ca 0.12 0.35 -0.06 0.00 0.56 0.00 0.00 62.75 63.72 1ntr n ILE 108 Cb 0.60 -1.98 0.02 0.00 -0.75 0.00 0.00 39.64 37.54 1ntr n ILE 108 CO 0.00 0.00 0.00 -0.78 0.56 0.00 0.00 176.55 176.33 1ntr h ASP 109 N -0.54 0.23 -0.94 4.38 3.58 -1.97 0.46 116.42 121.62 1ntr h ASP 109 Ca 0.00 0.03 0.28 0.00 0.42 0.00 0.00 57.03 57.76 1ntr h ASP 109 Cb 0.28 -0.01 -0.15 0.00 1.72 0.00 0.00 39.33 41.18 1ntr h ASP 109 CO 0.00 0.17 0.37 -0.08 -2.88 0.00 0.00 179.24 176.82 1ntr h GLU 110 N 0.36 0.22 0.00 0.28 4.22 -1.99 0.82 114.58 118.49 1ntr h GLU 110 Ca 0.18 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.61 1ntr h GLU 110 Cb 0.12 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1ntr h GLU 110 CO -0.15 0.15 0.00 0.00 -2.18 0.00 0.00 179.01 176.82 1ntr n ALA 111 N -2.55 -0.19 -0.03 2.92 0.00 0.02 -2.28 120.51 118.39 1ntr n ALA 111 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1ntr n ALA 111 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.29 1ntr n ALA 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ntr n VAL 112 N -1.66 0.00 -0.18 0.00 0.31 -0.43 -1.31 118.33 115.06 1ntr n VAL 112 Ca 0.00 1.20 -0.06 0.00 -0.01 0.00 0.00 64.34 65.47 1ntr n VAL 112 Cb 0.00 -1.61 -0.05 0.00 -0.91 0.00 0.00 33.84 31.27 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 -0.84 -0.33 -0.70 3.52 0.00 -1.02 0.11 119.26 120.00 1ntr h ALA 113 Ca 0.00 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1ntr h ALA 113 Cb 0.00 1.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.80 1ntr h ALA 113 CO 0.00 -0.52 -0.24 -0.11 0.00 0.00 0.00 179.25 178.37 1ntr n LEU 114 N -4.10 -0.39 0.22 0.00 0.00 -0.42 0.19 117.00 112.50 1ntr n LEU 114 Ca 0.00 1.22 -0.16 0.00 0.00 0.00 0.00 56.01 57.08 1ntr n LEU 114 Cb 0.14 -0.31 -0.08 0.00 0.00 0.00 0.00 43.42 43.17 1ntr n LEU 114 CO -0.06 -1.12 0.62 0.58 0.00 0.00 0.00 177.39 177.41 1ntr h VAL 115 N 0.00 0.25 -1.06 1.96 2.07 -0.02 -1.44 116.25 118.01 1ntr h VAL 115 Ca 0.28 0.00 0.39 0.00 0.82 0.00 0.00 66.70 68.19 1ntr h VAL 115 Cb 0.45 0.25 -0.13 0.00 -1.52 0.00 0.00 31.29 30.34 1ntr h VAL 115 CO -0.71 0.00 0.65 -0.62 0.02 0.00 0.00 177.57 176.91 1ntr n GLU 116 N -5.47 -0.04 0.06 1.57 -0.58 0.50 0.13 120.64 116.81 1ntr n GLU 116 Ca -0.10 1.10 -0.17 0.00 -0.42 0.00 0.00 57.16 57.58 1ntr n GLU 116 Cb 0.37 -2.10 -0.14 0.00 -0.57 0.00 0.00 31.44 28.99 1ntr n GLU 116 CO 0.00 0.00 0.00 0.07 -0.48 0.00 0.00 177.13 176.72 1ntr h ARG 117 N 0.00 0.25 0.83 3.49 -0.00 -0.81 -3.32 114.38 114.82 1ntr h ARG 117 Ca 0.74 -0.43 -0.04 0.00 -0.00 0.00 0.00 59.98 60.25 1ntr h ARG 117 Cb 2.24 0.16 0.01 0.00 -0.00 0.00 0.00 29.97 32.38 1ntr h ARG 117 CO -0.49 1.11 -0.40 0.00 -0.00 0.00 0.00 179.97 180.20 1ntr h ALA 118 N 0.46 -1.24 -0.74 0.08 0.00 0.20 -2.65 119.26 115.38 1ntr h ALA 118 Ca -0.26 -0.24 0.27 0.00 0.00 0.00 0.00 54.91 54.67 1ntr h ALA 118 Cb 2.02 0.43 -0.14 0.00 0.00 0.00 0.00 17.79 20.11 1ntr h ALA 118 CO 0.16 -1.16 0.24 -0.89 0.00 0.00 0.00 179.25 177.60 1ntr n ILE 119 N -5.13 -0.31 -2.47 0.00 5.41 -0.27 0.80 119.36 117.38 1ntr n ILE 119 Ca -0.14 1.56 -0.37 0.00 1.00 0.00 0.00 62.75 64.80 1ntr n ILE 119 Cb 0.44 -2.42 0.01 0.00 -0.71 0.00 0.00 39.64 36.96 1ntr n ILE 119 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1ntr n SER 120 N -4.82 6.70 0.08 4.38 7.64 -1.01 -4.48 113.62 122.12 1ntr n SER 120 Ca 0.24 -3.73 0.00 0.00 1.01 0.00 0.00 58.87 56.38 1ntr n SER 120 Cb 0.80 -0.98 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1ntr n SER 120 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1ntr n HIS 121 N -0.26 -1.46 -0.25 1.43 -0.00 0.24 -4.86 115.22 110.06 1ntr n HIS 121 Ca 0.46 0.26 -0.13 0.00 -0.00 0.00 0.00 57.72 58.30 1ntr n HIS 121 Cb 0.31 0.52 0.10 0.00 -0.00 0.00 0.00 29.99 30.93 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 -3.08 1.73 0.59 1.57 4.11 -1.24 -4.19 117.16 116.64 1ntr n TYR 122 Ca 0.00 -1.24 0.13 0.00 -0.00 0.00 0.00 57.90 56.79 1ntr n TYR 122 Cb 0.00 -0.64 0.37 0.00 -0.00 0.00 0.00 39.34 39.07 1ntr n TYR 122 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.86 178.82 1ntr h GLN 123 N 0.60 0.00 0.00 -3.48 4.20 -1.85 -3.52 115.11 111.06 1ntr h GLN 123 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 1ntr h GLN 123 Cb 2.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.82 1ntr h GLN 123 CO 0.62 0.00 0.00 -1.91 -0.67 0.00 0.00 178.83 176.87