#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 3.02 -1.78 0.03 7.27 -1.26 -5.06 117.38 119.60 1ntr n GLN 2 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.78 1ntr n GLN 2 Cb 0.00 -0.88 0.21 0.00 2.41 0.00 0.00 30.24 31.98 1ntr n GLN 2 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 1ntr n ARG 3 N -1.64 -1.55 -4.12 3.69 1.85 -1.26 -5.10 116.66 108.54 1ntr n ARG 3 Ca 0.00 -2.01 -0.15 0.00 -1.00 0.00 0.00 57.85 54.69 1ntr n ARG 3 Cb 0.37 -1.40 -0.05 0.00 -1.05 0.00 0.00 32.46 30.33 1ntr n ARG 3 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1ntr s GLY 4 N -5.70 1.59 -0.25 2.89 0.00 -1.26 -5.08 107.32 99.51 1ntr s GLY 4 Ca 0.75 -1.60 -0.04 0.00 0.00 0.00 0.00 44.72 43.83 1ntr s GLY 4 CO 0.53 -1.08 0.16 -0.42 0.00 0.00 0.00 173.10 172.29 1ntr s ILE 5 N -3.19 -0.18 -0.46 0.90 1.01 -1.26 -2.06 121.20 115.96 1ntr s ILE 5 Ca 0.32 -0.46 -0.16 0.00 0.00 0.00 0.00 60.65 60.35 1ntr s ILE 5 Cb 0.00 -0.83 0.06 0.00 0.01 0.00 0.00 42.46 41.70 1ntr s ILE 5 CO 0.21 -0.49 0.39 -0.69 0.00 0.00 0.00 174.94 174.36 1ntr s VAL 6 N 2.19 5.21 -0.77 2.92 1.01 -0.39 -1.64 120.40 128.93 1ntr s VAL 6 Ca 0.07 -0.91 -0.15 0.00 0.00 0.00 0.00 61.98 60.99 1ntr s VAL 6 Cb -0.16 -4.09 0.19 0.00 0.00 0.00 0.00 36.38 32.32 1ntr s VAL 6 CO -0.26 -0.53 0.75 0.26 0.00 0.00 0.00 175.10 175.33 1ntr s TRP 7 N 1.74 3.57 0.56 5.22 0.52 -0.13 -1.23 118.94 129.19 1ntr s TRP 7 Ca 0.05 -1.76 -0.01 0.00 0.02 0.00 0.00 56.10 54.40 1ntr s TRP 7 Cb -0.23 -3.87 0.02 0.00 -1.15 0.00 0.00 33.47 28.25 1ntr s TRP 7 CO 0.08 -1.06 0.81 0.08 0.02 0.00 0.00 176.95 176.88 1ntr s VAL 8 N 0.78 3.10 -0.18 4.03 1.01 0.45 -1.95 120.40 127.63 1ntr s VAL 8 Ca 0.16 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1ntr s VAL 8 Cb -0.14 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 1ntr s VAL 8 CO -0.06 -0.16 0.20 -0.69 0.00 0.00 0.00 175.10 174.39 1ntr s VAL 9 N -2.83 5.37 0.11 2.92 1.01 0.53 -2.37 120.40 125.15 1ntr s VAL 9 Ca 0.55 0.34 -0.01 0.00 0.00 0.00 0.00 61.98 62.86 1ntr s VAL 9 Cb -0.10 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1ntr s VAL 9 CO 0.40 0.42 0.05 0.47 0.00 0.00 0.00 175.10 176.44 1ntr n ASP 10 N 3.56 -1.18 0.07 3.32 9.92 -0.68 -2.57 116.55 128.99 1ntr n ASP 10 Ca -0.14 -0.05 0.00 0.00 -0.53 0.00 0.00 54.79 54.07 1ntr n ASP 10 Cb 0.52 -0.09 0.00 0.00 -0.64 0.00 0.00 41.12 40.91 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 -1.37 -1.23 -4.89 -2.24 -0.08 -1.26 -4.19 116.55 101.29 1ntr n ASP 11 Ca 0.01 0.27 -0.24 0.00 -1.51 0.00 0.00 54.79 53.32 1ntr n ASP 11 Cb 0.03 1.49 -0.01 0.00 2.34 0.00 0.00 41.12 44.97 1ntr n ASP 11 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1ntr s ASP 12 N -1.34 4.81 0.25 1.67 1.01 -1.26 -4.33 116.67 117.47 1ntr s ASP 12 Ca 0.00 -1.02 -0.30 0.00 0.71 0.00 0.00 52.55 51.95 1ntr s ASP 12 Cb 0.00 -0.01 -0.09 0.00 1.01 0.00 0.00 42.92 43.83 1ntr s ASP 12 CO 0.00 -0.93 1.25 -0.55 0.21 0.00 0.00 175.17 175.15 1ntr s SER 13 N -4.24 6.98 -0.03 0.27 0.15 -1.26 -3.11 113.70 112.45 1ntr s SER 13 Ca 0.42 2.42 -0.00 0.00 0.70 0.00 0.00 55.95 59.49 1ntr s SER 13 Cb -0.02 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1ntr s SER 13 CO 0.25 -0.42 0.01 -1.54 1.20 0.00 0.00 173.24 172.74 1ntr n SER 14 N 1.83 -1.43 0.11 5.45 3.41 -1.26 -4.96 113.62 116.78 1ntr n SER 14 Ca 0.03 -0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.45 1ntr n SER 14 Cb 0.43 -0.59 -0.15 0.00 -0.26 0.00 0.00 64.21 63.65 1ntr n SER 14 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1ntr h ILE 15 N -0.02 1.37 -0.56 -1.33 1.08 -1.96 -1.70 117.51 114.39 1ntr h ILE 15 Ca -0.01 -2.91 0.01 0.00 -0.39 0.00 0.00 64.86 61.56 1ntr h ILE 15 Cb 1.01 2.93 -0.03 0.00 -3.07 0.00 0.00 36.82 37.66 1ntr h ILE 15 CO 0.01 0.86 0.36 0.03 -0.69 0.00 0.00 178.15 178.72 1ntr h ARG 16 N 0.09 0.72 0.19 2.37 3.08 -1.88 -1.81 114.38 117.15 1ntr h ARG 16 Ca -0.19 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1ntr h ARG 16 Cb 2.04 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.93 1ntr h ARG 16 CO 0.21 0.47 -0.09 2.35 -1.07 0.00 0.00 179.97 181.85 1ntr h TRP 17 N 0.74 -0.24 -0.16 3.04 7.01 -1.96 -1.94 115.95 122.43 1ntr h TRP 17 Ca 0.21 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.22 1ntr h TRP 17 Cb -0.07 0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 1ntr h TRP 17 CO -0.04 -0.15 -0.09 0.28 -2.79 0.00 0.00 178.44 175.65 1ntr n VAL 18 N -2.85 -0.11 0.00 2.65 0.31 -0.64 -1.06 118.33 116.63 1ntr n VAL 18 Ca -0.03 1.53 0.00 0.00 -0.01 0.00 0.00 64.34 65.82 1ntr n VAL 18 Cb 0.10 -2.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.03 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 -3.31 0.00 -0.49 7.52 7.99 -0.68 -1.73 117.00 126.30 1ntr n LEU 19 Ca 0.00 0.81 0.38 0.00 -0.01 0.00 0.00 56.01 57.19 1ntr n LEU 19 Cb 0.04 -0.31 0.59 0.00 -0.11 0.00 0.00 43.42 43.62 1ntr n LEU 19 CO -0.03 -0.31 1.06 1.21 -1.51 0.00 0.00 177.39 177.81 1ntr n GLU 20 N -1.76 -0.01 0.20 3.23 2.13 -0.73 0.11 120.64 123.82 1ntr n GLU 20 Ca 0.00 0.82 -0.13 0.00 0.66 0.00 0.00 57.16 58.51 1ntr n GLU 20 Cb 0.00 -1.84 -0.07 0.00 0.27 0.00 0.00 31.44 29.80 1ntr n GLU 20 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ntr h ARG 21 N 0.00 -0.53 0.00 5.31 2.47 -0.22 0.18 114.38 121.59 1ntr h ARG 21 Ca 0.69 0.04 0.00 0.00 -1.26 0.00 0.00 59.98 59.44 1ntr h ARG 21 Cb 2.65 0.12 0.00 0.00 -1.65 0.00 0.00 29.97 31.09 1ntr h ARG 21 CO -0.07 -0.23 0.00 0.00 0.56 0.00 0.00 179.97 180.23 1ntr n ALA 22 N -2.58 1.88 0.85 0.04 0.00 0.30 -1.85 120.51 119.16 1ntr n ALA 22 Ca -0.10 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.36 1ntr n ALA 22 Cb 0.29 -1.26 -0.08 0.00 0.00 0.00 0.00 19.45 18.40 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 -1.30 1.09 0.10 0.00 7.99 0.29 -4.12 117.00 121.04 1ntr n LEU 23 Ca 0.07 -0.56 -0.22 0.00 -0.01 0.00 0.00 56.01 55.28 1ntr n LEU 23 Cb 0.13 0.00 -0.15 0.00 -0.11 0.00 0.00 43.42 43.29 1ntr n LEU 23 CO 0.13 0.25 -0.13 0.00 -1.51 0.00 0.00 177.39 176.13 1ntr h ALA 24 N 2.75 -0.11 -0.50 -1.18 0.00 0.12 -2.82 119.26 117.52 1ntr h ALA 24 Ca 0.00 -0.80 -0.02 0.00 0.00 0.00 0.00 54.91 54.09 1ntr h ALA 24 Cb 0.48 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ntr h ALA 24 CO 0.00 0.56 0.25 0.78 0.00 0.00 0.00 179.25 180.84 1ntr h GLY 25 N -0.08 0.77 0.60 0.00 0.00 -1.75 -1.85 103.07 100.75 1ntr h GLY 25 Ca -0.21 -0.38 0.10 0.00 0.00 0.00 0.00 47.33 46.84 1ntr h GLY 25 CO 0.21 0.36 0.64 0.00 0.00 0.00 0.00 176.54 177.74 1ntr h ALA 26 N 1.09 1.48 0.00 3.60 0.00 -1.71 -3.46 119.26 120.25 1ntr h ALA 26 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ntr h ALA 26 Cb 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1ntr h ALA 26 CO -0.02 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.95 1ntr n GLY 27 N -1.36 0.52 3.26 0.00 0.00 -0.70 -5.13 105.19 101.78 1ntr n GLY 27 Ca 0.17 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 1.30 -0.84 0.99 1.02 -1.08 -4.57 118.68 115.50 1ntr s LEU 28 Ca 0.00 -1.49 -0.14 0.00 0.02 0.00 0.00 54.13 52.51 1ntr s LEU 28 Cb 0.00 0.57 0.21 0.00 0.02 0.00 0.00 46.19 46.99 1ntr s LEU 28 CO 0.00 -0.95 0.81 -0.89 0.02 0.00 0.00 176.35 175.34 1ntr s THR 29 N -3.86 5.53 -0.89 5.49 2.01 -0.87 -4.66 115.64 118.39 1ntr s THR 29 Ca 0.38 -2.40 -0.18 0.00 0.31 0.00 0.00 61.69 59.80 1ntr s THR 29 Cb 0.05 -4.50 0.14 0.00 0.01 0.00 0.00 72.50 68.19 1ntr s THR 29 CO 0.17 -1.08 1.06 0.00 -0.69 0.00 0.00 174.62 174.09 1ntr s THR 31 N 2.49 5.01 -0.05 0.00 2.01 -0.36 -4.42 115.64 120.33 1ntr s THR 31 Ca 0.30 0.47 -0.03 0.00 0.31 0.00 0.00 61.69 62.74 1ntr s THR 31 Cb -0.07 -3.66 0.02 0.00 0.01 0.00 0.00 72.50 68.81 1ntr s THR 31 CO -0.08 0.16 0.11 0.42 -0.69 0.00 0.00 174.62 174.54 1ntr s THR 32 N -1.55 -0.02 -0.18 -0.82 -4.23 -1.26 -0.41 115.64 107.16 1ntr s THR 32 Ca 0.39 0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 60.94 1ntr s THR 32 Cb -0.13 -0.17 -0.02 0.00 1.34 0.00 0.00 72.50 73.51 1ntr s THR 32 CO 0.20 0.03 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.94 1ntr s PHE 33 N 0.54 3.03 0.61 3.99 0.40 -1.00 -4.78 117.98 120.77 1ntr s PHE 33 Ca -0.04 -0.42 0.27 0.00 -0.60 0.00 0.00 56.93 56.14 1ntr s PHE 33 Cb -0.06 -2.04 1.02 0.00 0.51 0.00 0.00 43.02 42.45 1ntr s PHE 33 CO -0.02 -0.18 1.40 0.93 0.70 0.00 0.00 175.22 178.05 1ntr h GLU 34 N 7.23 0.00 -4.74 0.44 5.08 -1.95 -1.81 114.58 118.83 1ntr h GLU 34 Ca -0.34 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.45 1ntr h GLU 34 Cb 1.18 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 30.09 1ntr h GLU 34 CO 0.62 0.00 -0.83 1.21 -1.00 0.00 0.00 179.01 179.00 1ntr s ASN 35 N -3.74 2.26 0.13 1.42 3.84 -1.26 -4.41 114.94 113.19 1ntr s ASN 35 Ca -0.03 -0.39 -0.20 0.00 0.21 0.00 0.00 52.86 52.45 1ntr s ASN 35 Cb 0.14 -1.03 -0.02 0.00 -0.55 0.00 0.00 41.25 39.80 1ntr s ASN 35 CO 0.48 0.04 1.70 1.23 -2.79 0.00 0.00 177.10 177.77 1ntr h GLY 36 N 7.13 0.15 -0.19 1.21 0.00 -1.92 -2.59 103.07 106.85 1ntr h GLY 36 Ca -0.29 0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.13 1ntr h GLY 36 CO 0.48 -0.08 -0.23 -0.57 0.00 0.00 0.00 176.54 176.14 1ntr h ASN 37 N 0.00 -0.78 -0.73 0.19 -0.73 -1.95 0.89 115.58 112.46 1ntr h ASN 37 Ca 0.10 0.10 0.17 0.00 1.87 0.00 0.00 56.30 58.54 1ntr h ASN 37 Cb 0.15 0.32 -0.14 0.00 0.27 0.00 0.00 38.32 38.93 1ntr h ASN 37 CO -0.22 -0.16 -0.10 1.21 -0.37 0.00 0.00 177.43 177.79 1ntr n GLU 38 N -3.82 -0.06 -0.13 6.67 2.13 -1.00 0.82 120.64 125.25 1ntr n GLU 38 Ca -0.01 1.12 -0.09 0.00 0.66 0.00 0.00 57.16 58.85 1ntr n GLU 38 Cb 0.14 -1.72 -0.03 0.00 0.27 0.00 0.00 31.44 30.10 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 0.17 0.00 6.31 2.07 -0.56 0.65 116.25 124.89 1ntr h VAL 39 Ca 0.39 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.87 1ntr h VAL 39 Cb 0.69 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1ntr h VAL 39 CO -0.73 0.00 -0.21 -0.07 0.02 0.00 0.00 177.57 176.59 1ntr h LEU 40 N -0.28 0.00 -1.84 2.57 -0.00 0.57 0.46 115.31 116.78 1ntr h LEU 40 Ca 0.16 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.02 1ntr h LEU 40 Cb 0.56 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.22 1ntr h LEU 40 CO -0.57 0.21 -0.11 0.00 -0.00 0.00 0.00 178.44 177.97 1ntr h ALA 41 N 1.79 1.73 0.12 1.53 0.00 0.18 -0.96 119.26 123.65 1ntr h ALA 41 Ca -0.00 -0.10 -0.29 0.00 0.00 0.00 0.00 54.91 54.52 1ntr h ALA 41 Cb 0.43 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ntr h ALA 41 CO 0.03 0.14 -1.38 0.00 0.00 0.00 0.00 179.25 178.04 1ntr h ALA 42 N 1.89 0.18 -0.66 0.00 0.00 0.12 -3.17 119.26 117.62 1ntr h ALA 42 Ca -0.00 -0.99 0.19 0.00 0.00 0.00 0.00 54.91 54.11 1ntr h ALA 42 Cb 0.20 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1ntr h ALA 42 CO 0.01 1.05 0.72 1.25 0.00 0.00 0.00 179.25 182.28 1ntr h LEU 43 N 0.07 0.00 -0.78 0.00 7.12 -0.04 -1.21 115.31 120.48 1ntr h LEU 43 Ca -0.18 0.00 0.17 0.00 0.13 0.00 0.00 57.88 58.00 1ntr h LEU 43 Cb 1.99 0.00 -0.15 0.00 -0.53 0.00 0.00 40.66 41.98 1ntr h LEU 43 CO 0.18 0.00 -0.13 0.00 -0.13 0.00 0.00 178.44 178.36 1ntr n ALA 44 N -2.33 0.25 -0.05 1.25 0.00 -1.15 0.56 120.51 119.03 1ntr n ALA 44 Ca 0.14 0.85 -0.12 0.00 0.00 0.00 0.00 53.44 54.31 1ntr n ALA 44 Cb 0.95 -0.54 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 1ntr n ALA 44 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ntr h SER 45 N 0.00 -0.02 0.00 0.00 0.87 -1.49 -3.49 113.55 109.42 1ntr h SER 45 Ca 0.40 -0.75 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 1ntr h SER 45 Cb 0.68 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1ntr h SER 45 CO -0.78 0.82 0.00 0.29 -0.53 0.00 0.00 176.83 176.63 1ntr n LYS 46 N -4.69 0.00 0.00 2.24 4.76 0.19 -5.16 118.16 115.50 1ntr n LYS 46 Ca -0.08 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 1ntr n LYS 46 Cb 0.37 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.56 1ntr n LYS 46 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1ntr n THR 47 N -0.57 0.00 0.00 -0.18 -2.24 -1.26 -4.71 114.28 105.32 1ntr n THR 47 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1ntr n THR 47 Cb 0.00 -1.12 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 1ntr n THR 47 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1ntr n PRO 48 N 0.00 0.00 0.00 -0.78 -0.04 -1.26 -5.09 135.00 127.83 1ntr n PRO 48 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ntr n PRO 48 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 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 -0.39 0.00 -4.18 3.54 9.92 -1.03 -4.96 116.55 119.45 1ntr n ASP 49 Ca 0.00 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 53.93 1ntr n ASP 49 Cb 0.00 -0.07 -0.16 0.00 -0.64 0.00 0.00 41.12 40.25 1ntr n ASP 49 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1ntr s VAL 50 N -0.63 2.18 -0.41 2.53 -7.23 -0.65 -4.24 120.40 111.95 1ntr s VAL 50 Ca 0.00 -0.93 -0.16 0.00 -1.81 0.00 0.00 61.98 59.08 1ntr s VAL 50 Cb 0.00 -1.89 0.02 0.00 0.56 0.00 0.00 36.38 35.07 1ntr s VAL 50 CO 0.00 0.54 0.34 -0.22 -0.31 0.00 0.00 175.10 175.45 1ntr s LEU 51 N 0.92 5.06 0.26 1.32 2.96 -1.06 -0.96 118.68 127.18 1ntr s LEU 51 Ca -0.04 -0.85 0.06 0.00 -0.22 0.00 0.00 54.13 53.08 1ntr s LEU 51 Cb -0.15 -2.22 -0.03 0.00 0.50 0.00 0.00 46.19 44.29 1ntr s LEU 51 CO -0.04 -0.49 0.28 -0.76 -1.32 0.00 0.00 176.35 174.03 1ntr s LEU 52 N 1.80 3.99 -0.16 -0.68 1.02 -0.82 -2.33 118.68 121.50 1ntr s LEU 52 Ca 0.07 -0.15 -0.03 0.00 0.02 0.00 0.00 54.13 54.04 1ntr s LEU 52 Cb -0.19 -2.55 0.05 0.00 0.02 0.00 0.00 46.19 43.52 1ntr s LEU 52 CO 0.11 -0.11 0.03 -0.55 0.02 0.00 0.00 176.35 175.85 1ntr s SER 53 N -3.93 2.51 0.00 2.29 0.15 -0.95 -0.34 113.70 113.43 1ntr s SER 53 Ca 0.35 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.39 1ntr s SER 53 Cb -0.08 -0.54 0.00 0.00 -1.71 0.00 0.00 66.02 63.69 1ntr s SER 53 CO 0.27 -0.28 0.00 -0.67 1.20 0.00 0.00 173.24 173.76 1ntr n ASP 54 N 5.09 0.00 -2.76 5.45 -0.08 -1.06 -2.31 116.55 120.87 1ntr n ASP 54 Ca -0.08 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.18 1ntr n ASP 54 Cb 0.48 0.00 0.02 0.00 2.34 0.00 0.00 41.12 43.96 1ntr n ASP 54 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1ntr s ILE 55 N 0.00 -0.38 0.00 5.18 1.10 -1.26 -4.36 121.20 121.48 1ntr s ILE 55 Ca 0.00 -0.23 0.00 0.00 -0.51 0.00 0.00 60.65 59.91 1ntr s ILE 55 Cb 0.00 0.00 0.00 0.00 0.15 0.00 0.00 42.46 42.61 1ntr s ILE 55 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 174.94 171.69 1ntr n ARG 56 N 3.16 0.00 0.00 3.50 3.00 -1.26 -4.80 116.66 120.26 1ntr n ARG 56 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 1ntr n ARG 56 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.08 1ntr n ARG 56 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.63 177.51 1ntr n MET 57 N 0.00 0.00 -2.27 -0.14 1.56 -1.26 -4.40 117.12 110.61 1ntr n MET 57 Ca 0.00 0.00 -0.39 0.00 -0.27 0.00 0.00 57.70 57.04 1ntr n MET 57 Cb 0.00 0.00 -0.02 0.00 2.15 0.00 0.00 33.22 35.35 1ntr n MET 57 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1ntr s PRO 58 N 0.00 4.21 0.59 2.12 0.04 -1.26 -4.90 135.00 135.79 1ntr s PRO 58 Ca 0.00 1.93 0.36 0.00 0.04 0.00 0.00 61.00 63.33 1ntr s PRO 58 Cb 0.00 -2.84 1.83 0.00 0.04 0.00 0.00 34.50 33.52 1ntr s PRO 58 CO 0.00 -0.22 2.17 0.78 0.04 0.00 0.00 177.00 179.78 1ntr h GLY 59 N 2.98 0.00 -7.16 0.56 0.00 -2.00 -3.40 103.07 94.05 1ntr h GLY 59 Ca -0.48 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.20 1ntr h GLY 59 CO 0.64 0.00 -0.07 -0.29 0.00 0.00 0.00 176.54 176.82 1ntr s MET 60 N -4.04 3.60 0.65 4.80 -2.45 -1.26 -4.96 119.30 115.64 1ntr s MET 60 Ca -0.03 -0.20 0.00 0.00 -1.25 0.00 0.00 55.69 54.22 1ntr s MET 60 Cb 0.12 -3.81 0.00 0.00 1.25 0.00 0.00 34.83 32.39 1ntr s MET 60 CO 0.50 -0.64 0.00 -0.25 1.05 0.00 0.00 175.02 175.68 1ntr n ASP 61 N 5.72 -0.64 0.00 1.11 8.00 -1.26 -4.79 116.55 124.69 1ntr n ASP 61 Ca -0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1ntr n ASP 61 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1ntr n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ntr n GLY 62 N 0.00 0.25 3.15 0.44 0.00 -1.26 -4.54 105.19 103.23 1ntr n GLY 62 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1ntr n GLY 62 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ntr s LEU 63 N 0.00 -0.32 0.00 0.99 2.34 -1.26 -4.54 118.68 115.89 1ntr s LEU 63 Ca 0.00 0.13 0.00 0.00 0.06 0.00 0.00 54.13 54.32 1ntr s LEU 63 Cb 0.00 1.24 0.00 0.00 -0.56 0.00 0.00 46.19 46.87 1ntr s LEU 63 CO 0.00 -0.06 0.51 0.00 -1.06 0.00 0.00 176.35 175.74 1ntr n ALA 64 N 5.32 -0.01 0.00 1.48 0.00 -1.26 -4.72 120.51 121.32 1ntr n ALA 64 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1ntr n ALA 64 Cb 0.56 0.03 0.00 0.00 0.00 0.00 0.00 19.45 20.04 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 -0.61 0.00 -0.26 0.00 4.77 -1.26 -4.81 117.00 114.84 1ntr n LEU 65 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 1ntr n LEU 65 Cb 0.00 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.15 1ntr n LEU 65 CO 0.00 0.00 1.17 0.25 -1.33 0.00 0.00 177.39 177.48 1ntr h LEU 66 N 0.00 0.82 -1.52 2.23 7.12 -1.93 0.16 115.31 122.20 1ntr h LEU 66 Ca 0.00 -0.03 -0.04 0.00 0.13 0.00 0.00 57.88 57.94 1ntr h LEU 66 Cb 0.00 -0.21 -0.01 0.00 -0.53 0.00 0.00 40.66 39.91 1ntr h LEU 66 CO 0.00 0.60 -0.10 0.50 -0.13 0.00 0.00 178.44 179.32 1ntr h LYS 67 N 0.96 0.19 0.76 1.25 3.64 -1.87 -2.93 116.57 118.57 1ntr h LYS 67 Ca 0.26 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 1ntr h LYS 67 Cb -0.10 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1ntr h LYS 67 CO -0.05 0.30 -0.37 0.37 -2.27 0.00 0.00 179.45 177.43 1ntr h GLN 68 N 0.18 -0.98 0.00 1.90 5.75 -1.37 -2.73 115.11 117.85 1ntr h GLN 68 Ca 0.04 0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1ntr h GLN 68 Cb 0.30 0.22 0.00 0.00 1.07 0.00 0.00 27.48 29.07 1ntr h GLN 68 CO 0.02 -0.66 0.00 -0.89 -2.65 0.00 0.00 178.83 174.65 1ntr n ILE 69 N -4.78 0.00 -0.15 2.39 -0.00 -0.76 -1.33 119.36 114.72 1ntr n ILE 69 Ca -0.13 0.90 -0.04 0.00 -0.00 0.00 0.00 62.75 63.48 1ntr n ILE 69 Cb 0.40 -1.30 -0.04 0.00 -0.00 0.00 0.00 39.64 38.71 1ntr n ILE 69 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1ntr n LYS 70 N -1.39 -0.16 -0.28 0.38 4.01 -1.21 0.61 118.16 120.12 1ntr n LYS 70 Ca 0.00 0.89 0.02 0.00 -0.51 0.00 0.00 58.31 58.71 1ntr n LYS 70 Cb 0.00 -1.32 0.07 0.00 -0.51 0.00 0.00 35.03 33.27 1ntr n LYS 70 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1ntr n GLN 71 N -3.84 -0.12 -2.69 1.97 1.13 -0.44 -1.21 117.38 112.19 1ntr n GLN 71 Ca 0.01 1.17 -0.25 0.00 -1.94 0.00 0.00 57.00 55.98 1ntr n GLN 71 Cb 0.10 -1.74 -0.01 0.00 0.11 0.00 0.00 30.24 28.69 1ntr n GLN 71 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1ntr n ARG 72 N -5.17 3.09 -4.32 -1.09 3.00 0.20 -5.05 116.66 107.31 1ntr n ARG 72 Ca 0.10 -4.49 -0.17 0.00 -0.01 0.00 0.00 57.85 53.28 1ntr n ARG 72 Cb 0.34 -2.15 -0.10 0.00 0.00 0.00 0.00 32.46 30.55 1ntr n ARG 72 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1ntr s HIS 73 N -3.44 1.53 -0.01 -1.55 2.46 0.73 -4.82 115.29 110.19 1ntr s HIS 73 Ca 0.46 -0.84 -0.00 0.00 0.47 0.00 0.00 55.06 55.15 1ntr s HIS 73 Cb 0.36 -0.85 -0.00 0.00 -0.13 0.00 0.00 32.58 31.96 1ntr s HIS 73 CO -0.15 0.04 -0.01 -1.00 -2.47 0.00 0.00 174.74 171.15 1ntr h PRO 74 N 2.54 0.00 0.00 2.88 0.13 -1.88 -3.47 132.00 132.20 1ntr h PRO 74 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1ntr h PRO 74 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ntr h PRO 74 CO 0.64 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.41 1ntr n MET 75 N -2.34 0.00 -4.13 0.86 0.00 -1.26 -5.13 117.12 105.12 1ntr n MET 75 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 57.70 57.47 1ntr n MET 75 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.17 1ntr n MET 75 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 175.97 175.49 1ntr s LEU 76 N 0.00 3.48 0.67 3.17 0.05 -1.26 -5.10 118.68 119.70 1ntr s LEU 76 Ca 0.00 -0.51 -0.15 0.00 0.05 0.00 0.00 54.13 53.53 1ntr s LEU 76 Cb 0.00 -2.01 0.01 0.00 -2.05 0.00 0.00 46.19 42.14 1ntr s LEU 76 CO 0.00 -0.11 1.12 -2.16 -0.55 0.00 0.00 176.35 174.65 1ntr s PRO 77 N -3.81 2.68 0.16 1.48 0.04 -1.26 -4.92 135.00 129.37 1ntr s PRO 77 Ca 0.34 1.44 0.01 0.00 0.04 0.00 0.00 61.00 62.83 1ntr s PRO 77 Cb -0.06 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1ntr s PRO 77 CO 0.23 -1.36 0.03 0.14 0.04 0.00 0.00 177.00 176.09 1ntr s VAL 78 N -2.31 0.43 0.03 -0.36 -7.23 -1.07 -2.58 120.40 107.31 1ntr s VAL 78 Ca 0.68 -1.96 0.04 0.00 -1.81 0.00 0.00 61.98 58.93 1ntr s VAL 78 Cb -0.22 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 1ntr s VAL 78 CO 0.42 -0.42 -0.11 -0.51 -0.31 0.00 0.00 175.10 174.18 1ntr s ILE 79 N -3.83 0.84 -0.62 -0.62 2.07 -0.98 -4.24 121.20 113.81 1ntr s ILE 79 Ca 0.26 -0.86 -0.07 0.00 -1.41 0.00 0.00 60.65 58.57 1ntr s ILE 79 Cb 0.07 -0.78 0.16 0.00 0.13 0.00 0.00 42.46 42.04 1ntr s ILE 79 CO 0.04 -0.06 0.48 -0.63 -1.91 0.00 0.00 174.94 172.86 1ntr s ILE 80 N -0.82 4.22 -0.65 2.00 1.01 -1.26 -2.24 121.20 123.46 1ntr s ILE 80 Ca -0.01 -2.53 -0.26 0.00 0.00 0.00 0.00 60.65 57.85 1ntr s ILE 80 Cb -0.07 -3.73 -0.06 0.00 0.01 0.00 0.00 42.46 38.61 1ntr s ILE 80 CO 0.01 -0.88 2.14 -0.32 0.00 0.00 0.00 174.94 175.89 1ntr s MET 81 N 0.38 2.28 0.00 2.79 1.75 -0.98 -2.31 119.30 123.21 1ntr s MET 81 Ca 0.14 0.70 0.00 0.00 -1.25 0.00 0.00 55.69 55.28 1ntr s MET 81 Cb -0.19 -4.62 0.00 0.00 2.84 0.00 0.00 34.83 32.85 1ntr s MET 81 CO -0.04 -3.28 0.00 -2.37 -0.65 0.00 0.00 175.02 168.68 1ntr n THR 82 N 7.81 0.00 -1.87 10.11 5.66 -0.70 -4.28 114.28 131.01 1ntr n THR 82 Ca 0.33 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.34 1ntr n THR 82 Cb 0.51 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.30 1ntr n THR 82 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ntr n ALA 83 N -1.05 2.01 -1.57 1.79 0.00 -1.26 -4.14 120.51 116.29 1ntr n ALA 83 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 53.44 52.26 1ntr n ALA 83 Cb 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 18.97 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 -0.17 0.00 -2.15 0.00 8.25 -1.26 -4.54 115.22 115.35 1ntr n HIS 84 Ca 0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.18 1ntr n HIS 84 Cb 0.69 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.75 1ntr n HIS 84 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1ntr s SER 85 N -1.00 5.39 0.00 0.41 0.01 -1.26 -3.23 113.70 114.02 1ntr s SER 85 Ca 0.00 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.08 1ntr s SER 85 Cb 0.00 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1ntr s SER 85 CO 0.00 -2.58 0.00 -0.67 0.41 0.00 0.00 173.24 170.40 1ntr n ASP 86 N 13.09 0.00 -0.55 2.44 2.03 -1.26 -4.23 116.55 128.07 1ntr n ASP 86 Ca 0.41 0.00 0.41 0.00 0.52 0.00 0.00 54.79 56.13 1ntr n ASP 86 Cb 0.47 0.00 0.63 0.00 -0.72 0.00 0.00 41.12 41.51 1ntr n ASP 86 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1ntr n LEU 87 N -0.38 0.01 -0.10 -2.67 7.99 -1.20 -0.30 117.00 120.35 1ntr n LEU 87 Ca 0.00 0.78 -0.17 0.00 -0.01 0.00 0.00 56.01 56.61 1ntr n LEU 87 Cb 0.00 -0.39 -0.08 0.00 -0.11 0.00 0.00 43.42 42.84 1ntr n LEU 87 CO 0.00 -0.78 -0.59 -0.67 -1.51 0.00 0.00 177.39 173.84 1ntr n ASP 88 N -3.51 1.86 0.25 -1.43 2.03 -1.26 -3.21 116.55 111.29 1ntr n ASP 88 Ca 0.34 0.47 0.11 0.00 0.52 0.00 0.00 54.79 56.24 1ntr n ASP 88 Cb 1.56 -0.91 0.60 0.00 -0.72 0.00 0.00 41.12 41.64 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 -0.73 1.27 -1.35 -1.67 0.00 -1.03 -2.64 119.26 113.11 1ntr h ALA 89 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1ntr h ALA 89 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ntr h ALA 89 CO -0.16 -0.27 0.00 0.00 0.00 0.00 0.00 179.25 178.81 1ntr n ALA 90 N -1.74 0.00 -0.40 0.00 0.00 -0.41 -4.44 120.51 113.53 1ntr n ALA 90 Ca -0.01 -0.11 0.32 0.00 0.00 0.00 0.00 53.44 53.63 1ntr n ALA 90 Cb 0.35 0.00 0.51 0.00 0.00 0.00 0.00 19.45 20.31 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 -1.92 -0.10 -1.80 0.00 0.31 -1.20 -4.27 118.33 109.36 1ntr n VAL 91 Ca 0.00 1.16 0.00 0.00 -0.01 0.00 0.00 64.34 65.49 1ntr n VAL 91 Cb 0.00 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.02 1ntr n VAL 91 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ntr n SER 92 N -3.75 0.00 -0.22 4.52 2.88 -1.00 -4.68 113.62 111.37 1ntr n SER 92 Ca 0.29 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 1ntr n SER 92 Cb 1.22 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.68 1ntr n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ntr n ALA 93 N -3.00 0.00 -1.55 -1.46 0.00 -1.26 -3.36 120.51 109.88 1ntr n ALA 93 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1ntr n ALA 93 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -0.45 1.06 -0.07 0.00 4.01 -1.26 -4.66 117.16 115.79 1ntr n TYR 94 Ca 0.00 -0.02 0.07 0.00 -0.16 0.00 0.00 57.90 57.79 1ntr n TYR 94 Cb 0.00 -2.44 0.27 0.00 -0.31 0.00 0.00 39.34 36.86 1ntr n TYR 94 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ntr n GLN 95 N 8.50 3.09 -0.34 -0.72 -0.00 -1.21 -4.42 117.38 122.28 1ntr n GLN 95 Ca 0.49 -2.13 0.19 0.00 -0.00 0.00 0.00 57.00 55.54 1ntr n GLN 95 Cb 0.41 -1.75 0.42 0.00 -0.00 0.00 0.00 30.24 29.31 1ntr n GLN 95 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 1ntr h GLN 96 N 3.03 0.52 0.00 2.61 4.15 -1.91 -3.46 115.11 120.05 1ntr h GLN 96 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1ntr h GLN 96 Cb 1.17 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.74 1ntr h GLN 96 CO 0.19 0.35 0.00 0.41 -1.93 0.00 0.00 178.83 177.84 1ntr n GLY 97 N -1.37 -1.52 2.79 2.39 0.00 -1.26 -4.99 105.19 101.23 1ntr n GLY 97 Ca 0.26 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.87 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 0.00 0.00 -2.06 4.61 0.00 -1.26 -4.48 120.51 117.32 1ntr n ALA 98 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ntr n ALA 98 Cb 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1ntr n ALA 98 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1ntr n PHE 99 N -2.35 -2.29 -3.57 0.00 -1.74 -1.26 -2.59 117.46 103.66 1ntr n PHE 99 Ca 0.00 1.37 0.00 0.00 -0.56 0.00 0.00 57.45 58.26 1ntr n PHE 99 Cb 0.19 -2.22 0.00 0.00 1.52 0.00 0.00 39.48 38.96 1ntr n PHE 99 CO 0.00 0.00 0.00 -0.40 -0.56 0.00 0.00 176.76 175.80 1ntr n ASP 100 N 1.88 0.00 -2.34 5.98 5.75 -1.26 -4.21 116.55 122.34 1ntr n ASP 100 Ca 0.00 -0.92 -0.03 0.00 -0.01 0.00 0.00 54.79 53.83 1ntr n ASP 100 Cb 0.00 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.07 1ntr n ASP 100 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1ntr n TYR 101 N 0.00 -3.21 -3.52 2.11 4.02 -1.26 -4.82 117.16 110.49 1ntr n TYR 101 Ca 0.00 1.71 -0.29 0.00 -0.01 0.00 0.00 57.90 59.31 1ntr n TYR 101 Cb 0.00 -3.33 -0.14 0.00 -0.02 0.00 0.00 39.34 35.85 1ntr n TYR 101 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1ntr s LEU 102 N -0.77 0.85 0.00 7.72 2.96 -0.98 -4.91 118.68 123.55 1ntr s LEU 102 Ca -0.13 -1.71 -0.05 0.00 -0.22 0.00 0.00 54.13 52.02 1ntr s LEU 102 Cb 0.01 -0.41 0.07 0.00 0.50 0.00 0.00 46.19 46.36 1ntr s LEU 102 CO 0.59 -0.38 0.28 -0.81 -1.32 0.00 0.00 176.35 174.71 1ntr n PRO 103 N 4.69 -1.41 -4.13 0.98 -0.04 -1.26 -1.73 135.00 132.11 1ntr n PRO 103 Ca 0.02 -0.44 -0.10 0.00 -0.04 0.00 0.00 63.50 62.94 1ntr n PRO 103 Cb 0.40 -0.40 -0.09 0.00 -0.04 0.00 0.00 33.50 33.36 1ntr n PRO 103 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1ntr s LYS 104 N -3.63 1.02 -0.18 0.54 -2.85 -1.26 -3.60 119.74 109.79 1ntr s LYS 104 Ca 0.18 -1.43 -0.29 0.00 -1.00 0.00 0.00 55.97 53.43 1ntr s LYS 104 Cb -0.02 0.27 -0.01 0.00 -2.06 0.00 0.00 37.83 36.01 1ntr s LYS 104 CO 0.14 -0.31 1.25 -1.25 0.10 0.00 0.00 175.35 175.27 1ntr s PRO 105 N -4.05 4.22 0.50 1.78 0.04 -1.26 -5.16 135.00 131.07 1ntr s PRO 105 Ca 0.26 1.62 0.01 0.00 0.04 0.00 0.00 61.00 62.92 1ntr s PRO 105 Cb 0.07 -3.76 0.01 0.00 0.04 0.00 0.00 34.50 30.86 1ntr s PRO 105 CO 0.03 -0.72 0.72 0.12 0.04 0.00 0.00 177.00 177.20 1ntr s PHE 106 N 3.52 3.04 0.00 0.56 5.36 -1.24 -5.10 117.98 124.12 1ntr s PHE 106 Ca 0.54 0.12 0.00 0.00 -0.96 0.00 0.00 56.93 56.62 1ntr s PHE 106 Cb -0.21 -2.54 0.00 0.00 -0.34 0.00 0.00 43.02 39.94 1ntr s PHE 106 CO 0.14 -0.62 0.00 -3.47 -1.46 0.00 0.00 175.22 169.81 1ntr n ASP 107 N -2.21 0.00 0.00 6.13 2.03 -1.26 -5.08 116.55 116.16 1ntr n ASP 107 Ca 0.05 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.36 1ntr n ASP 107 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1ntr n ASP 107 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1ntr n ILE 108 N 0.00 0.00 0.14 5.18 2.08 -1.26 -4.79 119.36 120.71 1ntr n ILE 108 Ca 0.00 0.00 0.06 0.00 0.56 0.00 0.00 62.75 63.37 1ntr n ILE 108 Cb 0.00 -0.00 0.52 0.00 -0.75 0.00 0.00 39.64 39.40 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 0.00 0.21 -0.90 4.38 1.82 -1.98 0.71 116.42 120.65 1ntr h ASP 109 Ca 0.00 -0.01 0.10 0.00 -0.39 0.00 0.00 57.03 56.73 1ntr h ASP 109 Cb 0.00 -0.05 -0.07 0.00 0.68 0.00 0.00 39.33 39.89 1ntr h ASP 109 CO 0.00 0.19 0.58 -0.08 -1.61 0.00 0.00 179.24 178.32 1ntr h GLU 110 N 0.24 0.86 0.00 0.28 4.81 -1.98 -0.61 114.58 118.18 1ntr h GLU 110 Ca 0.06 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1ntr h GLU 110 Cb 0.04 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.23 1ntr h GLU 110 CO -0.01 0.57 0.00 0.00 -0.73 0.00 0.00 179.01 178.84 1ntr n ALA 111 N -2.40 -0.10 -0.29 2.92 0.00 0.19 -1.50 120.51 119.32 1ntr n ALA 111 Ca 0.16 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.75 1ntr n ALA 111 Cb 0.32 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.06 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 -1.87 -0.36 0.00 0.00 0.31 -0.87 -1.43 118.33 114.10 1ntr n VAL 112 Ca 0.00 1.84 0.00 0.00 -0.01 0.00 0.00 64.34 66.17 1ntr n VAL 112 Cb 0.00 -2.74 0.00 0.00 -0.91 0.00 0.00 33.84 30.19 1ntr n VAL 112 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ntr n ALA 113 N -3.08 -0.06 -0.26 3.52 0.00 -0.24 -1.61 120.51 118.77 1ntr n ALA 113 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.63 1ntr n ALA 113 Cb 0.73 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.17 1ntr n ALA 113 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ntr n LEU 114 N -1.70 -0.53 0.28 0.00 7.94 -0.56 0.12 117.00 122.55 1ntr n LEU 114 Ca 0.00 1.15 -0.16 0.00 -1.11 0.00 0.00 56.01 55.89 1ntr n LEU 114 Cb 0.00 -0.22 -0.08 0.00 0.53 0.00 0.00 43.42 43.65 1ntr n LEU 114 CO 0.00 -1.00 0.64 0.58 -1.11 0.00 0.00 177.39 176.51 1ntr h VAL 115 N 0.00 0.49 -0.99 1.96 2.07 -1.41 -2.54 116.25 115.84 1ntr h VAL 115 Ca 0.18 -0.15 0.33 0.00 0.82 0.00 0.00 66.70 67.88 1ntr h VAL 115 Cb 0.34 0.56 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 1ntr h VAL 115 CO -0.64 0.03 0.65 1.21 0.02 0.00 0.00 177.57 178.84 1ntr n GLU 116 N -5.35 -0.02 0.50 1.57 2.13 0.32 0.11 120.64 119.90 1ntr n GLU 116 Ca -0.12 0.81 -0.19 0.00 0.66 0.00 0.00 57.16 58.32 1ntr n GLU 116 Cb 0.30 -1.64 -0.09 0.00 0.27 0.00 0.00 31.44 30.28 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 -1.22 -0.02 5.31 3.08 -0.89 -2.41 114.38 118.24 1ntr h ARG 117 Ca 0.59 0.08 0.03 0.00 0.07 0.00 0.00 59.98 60.75 1ntr h ARG 117 Cb 2.00 0.28 -0.04 0.00 0.08 0.00 0.00 29.97 32.29 1ntr h ARG 117 CO -0.25 -0.81 -0.19 0.00 -1.07 0.00 0.00 179.97 177.65 1ntr h ALA 118 N -1.41 -0.22 -1.17 0.04 0.00 0.65 -0.64 119.26 116.50 1ntr h ALA 118 Ca -0.13 0.01 0.39 0.00 0.00 0.00 0.00 54.91 55.18 1ntr h ALA 118 Cb 0.97 0.34 -0.10 0.00 0.00 0.00 0.00 17.79 19.00 1ntr h ALA 118 CO 0.21 -0.68 0.77 -0.89 0.00 0.00 0.00 179.25 178.66 1ntr n ILE 119 N -5.32 -0.17 0.68 0.00 5.41 -0.63 0.11 119.36 119.44 1ntr n ILE 119 Ca -0.05 1.38 0.00 0.00 1.00 0.00 0.00 62.75 65.08 1ntr n ILE 119 Cb 0.24 -2.27 0.00 0.00 -0.71 0.00 0.00 39.64 36.90 1ntr n ILE 119 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1ntr n SER 120 N -4.14 2.90 0.25 4.38 3.41 -0.25 -4.11 113.62 116.06 1ntr n SER 120 Ca 0.32 -1.81 0.17 0.00 -0.26 0.00 0.00 58.87 57.30 1ntr n SER 120 Cb 1.30 -0.51 0.81 0.00 -0.26 0.00 0.00 64.21 65.55 1ntr n SER 120 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1ntr h HIS 121 N 0.43 0.00 -0.34 7.33 2.76 0.66 -2.76 115.15 123.23 1ntr h HIS 121 Ca 0.00 0.00 -0.23 0.00 -2.20 0.00 0.00 60.37 57.94 1ntr h HIS 121 Cb 0.87 0.00 -0.10 0.00 1.55 0.00 0.00 27.41 29.73 1ntr h HIS 121 CO 0.04 0.00 0.30 0.66 -1.30 0.00 0.00 177.93 177.63 1ntr n TYR 122 N -2.77 1.10 -1.33 5.26 4.01 -1.26 -4.62 117.16 117.55 1ntr n TYR 122 Ca -0.01 -1.69 -0.23 0.00 -0.16 0.00 0.00 57.90 55.82 1ntr n TYR 122 Cb 0.16 -0.83 -0.10 0.00 -0.31 0.00 0.00 39.34 38.27 1ntr n TYR 122 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1ntr n GLN 123 N 0.68 2.42 0.00 -0.72 7.27 -1.04 -5.25 117.38 120.73 1ntr n GLN 123 Ca 0.21 -1.90 0.07 0.00 0.07 0.00 0.00 57.00 55.46 1ntr n GLN 123 Cb 0.55 -2.14 0.06 0.00 2.41 0.00 0.00 30.24 31.13 1ntr n GLN 123 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52