#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 0.95 -0.56 0.03 -2.07 -0.75 -2.57 119.66 114.68 1ntr s GLN 2 Ca 0.00 -1.15 0.06 0.00 -1.82 0.00 0.00 55.36 52.45 1ntr s GLN 2 Cb 0.00 -0.40 0.33 0.00 -1.09 0.00 0.00 33.01 31.86 1ntr s GLN 2 CO 0.00 -1.31 0.91 -2.13 -1.32 0.00 0.00 175.29 171.45 1ntr n ARG 3 N 3.29 2.98 0.00 9.60 3.00 -0.94 -4.85 116.66 129.75 1ntr n ARG 3 Ca 0.19 -4.71 0.00 0.00 -0.00 0.00 0.00 57.85 53.32 1ntr n ARG 3 Cb 0.53 -2.19 0.00 0.00 0.00 0.00 0.00 32.46 30.80 1ntr n ARG 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ntr n GLY 4 N -0.12 -0.66 3.52 5.14 0.00 -1.26 -4.86 105.19 106.94 1ntr n GLY 4 Ca 0.30 0.75 -0.42 0.00 0.00 0.00 0.00 46.02 46.65 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 0.00 4.14 -0.24 -0.61 1.01 -1.26 -2.25 121.20 121.98 1ntr s ILE 5 Ca 0.00 -0.70 -0.14 0.00 0.00 0.00 0.00 60.65 59.81 1ntr s ILE 5 Cb 0.00 -4.92 -0.04 0.00 0.01 0.00 0.00 42.46 37.51 1ntr s ILE 5 CO 0.00 -1.76 0.34 0.54 0.00 0.00 0.00 174.94 174.06 1ntr s VAL 6 N 4.43 5.22 -0.49 2.92 0.11 -0.39 -2.04 120.40 130.15 1ntr s VAL 6 Ca 0.38 0.54 -0.15 0.00 -2.93 0.00 0.00 61.98 59.81 1ntr s VAL 6 Cb -0.05 -3.67 0.10 0.00 -1.53 0.00 0.00 36.38 31.23 1ntr s VAL 6 CO -0.03 0.22 0.43 0.86 -3.33 0.00 0.00 175.10 173.25 1ntr s TRP 7 N 1.66 3.26 -0.24 1.54 -0.11 0.27 -1.33 118.94 123.99 1ntr s TRP 7 Ca 0.15 -1.14 -0.10 0.00 1.22 0.00 0.00 56.10 56.23 1ntr s TRP 7 Cb -0.15 -3.41 -0.05 0.00 -1.50 0.00 0.00 33.47 28.36 1ntr s TRP 7 CO 0.08 -0.89 0.14 0.08 -4.62 0.00 0.00 176.95 171.74 1ntr s VAL 8 N 1.60 5.21 -0.16 5.86 1.01 -0.12 -0.26 120.40 133.54 1ntr s VAL 8 Ca 0.04 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 1ntr s VAL 8 Cb -0.26 -3.42 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 1ntr s VAL 8 CO 0.05 0.36 2.15 0.55 0.00 0.00 0.00 175.10 178.21 1ntr n VAL 9 N 4.28 0.44 -1.10 2.92 3.14 -1.04 -2.24 118.33 124.73 1ntr n VAL 9 Ca -0.15 -0.36 -0.30 0.00 -2.96 0.00 0.00 64.34 60.57 1ntr n VAL 9 Cb 0.52 -2.43 0.15 0.00 -1.06 0.00 0.00 33.84 31.02 1ntr n VAL 9 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1ntr s ASP 10 N 7.23 3.19 0.00 6.55 2.15 0.14 -2.71 116.67 133.22 1ntr s ASP 10 Ca 0.98 1.55 0.00 0.00 0.43 0.00 0.00 52.55 55.52 1ntr s ASP 10 Cb -0.41 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 1ntr s ASP 10 CO 0.38 -2.83 0.00 0.47 -0.17 0.00 0.00 175.17 173.03 1ntr n ASP 11 N -4.01 0.00 -4.92 -0.34 9.92 -1.26 -3.89 116.55 112.05 1ntr n ASP 11 Ca 0.07 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.10 1ntr n ASP 11 Cb 0.55 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 41.02 1ntr n ASP 11 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1ntr s ASP 12 N -1.00 4.91 0.58 -2.24 1.11 -1.26 -4.65 116.67 114.12 1ntr s ASP 12 Ca 0.00 -0.95 -0.20 0.00 0.18 0.00 0.00 52.55 51.59 1ntr s ASP 12 Cb 0.00 -0.05 -0.04 0.00 1.07 0.00 0.00 42.92 43.90 1ntr s ASP 12 CO 0.00 -0.95 1.19 -1.20 1.18 0.00 0.00 175.17 175.39 1ntr n SER 13 N -1.76 1.79 0.00 0.27 7.64 -1.26 -1.62 113.62 118.68 1ntr n SER 13 Ca 0.04 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.80 1ntr n SER 13 Cb 0.63 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 1ntr n SER 13 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1ntr n SER 14 N -1.05 0.00 0.10 6.43 2.88 -1.26 -4.81 113.62 115.91 1ntr n SER 14 Ca 0.13 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.50 1ntr n SER 14 Cb 0.46 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.80 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 1.45 -0.40 2.46 1.08 -1.70 -2.92 117.51 117.48 1ntr h ILE 15 Ca 0.00 -2.90 0.00 0.00 -0.39 0.00 0.00 64.86 61.58 1ntr h ILE 15 Cb 0.00 2.86 -0.02 0.00 -3.07 0.00 0.00 36.82 36.59 1ntr h ILE 15 CO 0.00 0.85 0.27 -0.09 -0.69 0.00 0.00 178.15 178.49 1ntr h ARG 16 N 0.12 0.53 0.82 2.37 2.43 -1.88 -2.83 114.38 115.94 1ntr h ARG 16 Ca -0.14 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 58.96 1ntr h ARG 16 Cb 1.92 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 31.35 1ntr h ARG 16 CO 0.21 0.35 -0.48 2.35 -1.51 0.00 0.00 179.97 180.88 1ntr h TRP 17 N 0.54 -1.28 -0.70 2.20 7.01 -1.95 -2.54 115.95 119.24 1ntr h TRP 17 Ca 0.15 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.20 1ntr h TRP 17 Cb -0.06 0.45 -0.08 0.00 -2.10 0.00 0.00 29.16 27.37 1ntr h TRP 17 CO -0.05 -0.73 -0.41 0.28 -2.79 0.00 0.00 178.44 174.74 1ntr n VAL 18 N -5.63 -0.48 0.00 2.65 0.31 -1.10 -0.91 118.33 113.18 1ntr n VAL 18 Ca -0.15 1.76 0.00 0.00 -0.01 0.00 0.00 64.34 65.94 1ntr n VAL 18 Cb 0.50 -2.18 0.00 0.00 -0.91 0.00 0.00 33.84 31.25 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 -4.79 0.00 -0.44 7.52 4.77 -1.08 -1.48 117.00 121.49 1ntr n LEU 19 Ca 0.01 0.92 0.35 0.00 -0.03 0.00 0.00 56.01 57.27 1ntr n LEU 19 Cb 0.18 -0.42 0.57 0.00 -2.33 0.00 0.00 43.42 41.41 1ntr n LEU 19 CO -0.11 -0.42 1.02 1.21 -1.33 0.00 0.00 177.39 177.75 1ntr n GLU 20 N -2.09 -0.02 0.29 3.23 2.13 -0.55 0.11 120.64 123.74 1ntr n GLU 20 Ca 0.00 0.90 -0.16 0.00 0.66 0.00 0.00 57.16 58.56 1ntr n GLU 20 Cb 0.00 -1.90 -0.08 0.00 0.27 0.00 0.00 31.44 29.73 1ntr n GLU 20 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 1ntr h ARG 21 N 0.00 -0.69 0.00 5.31 9.65 0.11 -0.91 114.38 127.86 1ntr h ARG 21 Ca 0.69 0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.62 1ntr h ARG 21 Cb 2.48 0.16 0.00 0.00 -1.39 0.00 0.00 29.97 31.22 1ntr h ARG 21 CO -0.20 -0.40 0.00 0.00 2.80 0.00 0.00 179.97 182.17 1ntr n ALA 22 N -2.49 1.34 0.09 2.80 0.00 0.31 -1.29 120.51 121.26 1ntr n ALA 22 Ca -0.12 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.33 1ntr n ALA 22 Cb 0.32 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.63 1ntr n ALA 22 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ntr h LEU 23 N 0.00 0.00 -0.65 0.00 7.12 -0.12 -3.18 115.31 118.48 1ntr h LEU 23 Ca 0.00 0.00 0.04 0.00 0.13 0.00 0.00 57.88 58.05 1ntr h LEU 23 Cb 0.12 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.20 1ntr h LEU 23 CO 0.00 0.45 0.38 0.00 -0.13 0.00 0.00 178.44 179.14 1ntr h ALA 24 N 1.55 0.86 -0.05 1.25 0.00 -0.18 0.26 119.26 122.95 1ntr h ALA 24 Ca -0.07 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1ntr h ALA 24 Cb 1.41 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ntr h ALA 24 CO 0.05 0.10 -0.14 0.78 0.00 0.00 0.00 179.25 180.03 1ntr h GLY 25 N 0.73 0.21 1.84 0.00 0.00 -1.70 -2.78 103.07 101.38 1ntr h GLY 25 Ca 0.28 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1ntr h GLY 25 CO -0.14 0.24 0.07 0.00 0.00 0.00 0.00 176.54 176.70 1ntr h ALA 26 N 0.44 1.06 -5.08 3.60 0.00 -1.43 -3.46 119.26 114.39 1ntr h ALA 26 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 1ntr h ALA 26 Cb 0.76 0.00 0.15 0.00 0.00 0.00 0.00 17.79 18.70 1ntr h ALA 26 CO 0.03 -0.06 -0.68 0.41 0.00 0.00 0.00 179.25 178.95 1ntr n GLY 27 N -1.20 -0.48 3.38 0.00 0.00 0.87 -4.86 105.19 102.90 1ntr n GLY 27 Ca -0.02 0.19 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 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 -5.42 1.14 -0.83 0.99 1.02 -1.06 -1.82 118.68 112.71 1ntr s LEU 28 Ca 0.16 -1.46 -0.05 0.00 0.02 0.00 0.00 54.13 52.80 1ntr s LEU 28 Cb -0.02 1.00 0.21 0.00 0.02 0.00 0.00 46.19 47.40 1ntr s LEU 28 CO 0.62 -1.10 0.71 -0.89 0.02 0.00 0.00 176.35 175.71 1ntr s THR 29 N -3.56 4.61 -1.13 5.49 2.01 -0.96 -4.73 115.64 117.38 1ntr s THR 29 Ca 0.34 -3.26 -0.16 0.00 0.31 0.00 0.00 61.69 58.92 1ntr s THR 29 Cb 0.02 -3.88 0.15 0.00 0.01 0.00 0.00 72.50 68.80 1ntr s THR 29 CO 0.19 -1.02 1.37 0.00 -0.69 0.00 0.00 174.62 174.46 1ntr s THR 31 N 2.18 4.78 -0.02 0.00 2.01 -0.44 -4.42 115.64 119.73 1ntr s THR 31 Ca 0.41 2.04 0.07 0.00 0.31 0.00 0.00 61.69 64.52 1ntr s THR 31 Cb -0.03 -4.31 -0.02 0.00 0.01 0.00 0.00 72.50 68.15 1ntr s THR 31 CO -0.02 -0.00 -0.23 0.42 -0.69 0.00 0.00 174.62 174.09 1ntr s THR 32 N 2.07 2.32 -0.26 -0.82 -4.23 -1.25 -0.94 115.64 112.53 1ntr s THR 32 Ca 0.48 -1.05 -0.01 0.00 -1.18 0.00 0.00 61.69 59.93 1ntr s THR 32 Cb -0.18 -1.84 0.04 0.00 1.34 0.00 0.00 72.50 71.85 1ntr s THR 32 CO 0.17 0.55 -0.06 -0.36 -0.54 0.00 0.00 174.62 174.38 1ntr s PHE 33 N -0.67 3.13 0.49 3.99 0.40 -0.95 -4.55 117.98 119.83 1ntr s PHE 33 Ca 0.11 -1.77 0.39 0.00 -0.60 0.00 0.00 56.93 55.05 1ntr s PHE 33 Cb -0.10 -2.04 1.32 0.00 0.51 0.00 0.00 43.02 42.71 1ntr s PHE 33 CO -0.00 -0.78 1.29 0.39 0.70 0.00 0.00 175.22 176.82 1ntr n GLU 34 N 4.61 0.00 -4.06 0.44 1.02 -1.25 0.27 120.64 121.68 1ntr n GLU 34 Ca -0.16 0.92 -0.33 0.00 -0.02 0.00 0.00 57.16 57.58 1ntr n GLU 34 Cb 0.45 -2.18 -0.15 0.00 -0.02 0.00 0.00 31.44 29.54 1ntr n GLU 34 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1ntr s ASN 35 N -3.75 3.78 0.18 1.62 0.01 -1.26 -4.31 114.94 111.21 1ntr s ASN 35 Ca -0.04 -0.85 -0.19 0.00 -0.71 0.00 0.00 52.86 51.07 1ntr s ASN 35 Cb 0.20 -1.56 0.12 0.00 0.41 0.00 0.00 41.25 40.43 1ntr s ASN 35 CO 0.68 -0.07 1.63 1.23 -1.51 0.00 0.00 177.10 179.05 1ntr h GLY 36 N 7.93 0.11 0.00 0.66 0.00 -1.83 -2.56 103.07 107.38 1ntr h GLY 36 Ca -0.37 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1ntr h GLY 36 CO 0.58 -0.21 0.00 -2.01 0.00 0.00 0.00 176.54 174.91 1ntr n ASN 37 N -5.39 0.00 -0.20 0.19 5.15 -1.26 0.19 115.26 113.93 1ntr n ASN 37 Ca 0.03 0.86 0.19 0.00 -0.60 0.00 0.00 54.58 55.06 1ntr n ASN 37 Cb 0.30 -0.36 0.35 0.00 -0.53 0.00 0.00 39.78 39.54 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 -2.28 -0.03 0.28 1.20 4.07 -0.98 0.10 120.64 122.99 1ntr n GLU 38 Ca 0.00 0.78 -0.15 0.00 -0.06 0.00 0.00 57.16 57.73 1ntr n GLU 38 Cb 0.00 -1.43 -0.08 0.00 -0.06 0.00 0.00 31.44 29.87 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 0.42 0.00 6.31 2.07 -0.04 0.91 116.25 125.92 1ntr h VAL 39 Ca 0.49 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.72 1ntr h VAL 39 Cb 1.35 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1ntr h VAL 39 CO -0.41 0.04 0.00 0.00 0.02 0.00 0.00 177.57 177.22 1ntr n LEU 40 N -5.32 0.00 -0.04 2.57 -0.00 0.28 -1.07 117.00 113.43 1ntr n LEU 40 Ca -0.11 0.00 0.02 0.00 -0.00 0.00 0.00 56.01 55.92 1ntr n LEU 40 Cb 0.32 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.58 1ntr n LEU 40 CO 0.33 0.00 -0.88 0.00 -0.00 0.00 0.00 177.39 176.84 1ntr n ALA 41 N -0.85 2.27 0.00 1.47 0.00 0.45 -3.81 120.51 120.04 1ntr n ALA 41 Ca 0.16 -0.83 0.10 0.00 0.00 0.00 0.00 53.44 52.87 1ntr n ALA 41 Cb 0.07 -0.54 -0.16 0.00 0.00 0.00 0.00 19.45 18.82 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 -2.45 2.78 1.45 0.00 0.00 0.28 -4.13 120.51 118.43 1ntr n ALA 42 Ca -0.15 -0.49 0.13 0.00 0.00 0.00 0.00 53.44 52.94 1ntr n ALA 42 Cb 0.81 -0.70 0.50 0.00 0.00 0.00 0.00 19.45 20.05 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 -2.20 1.55 -0.51 0.00 4.77 -0.23 -4.39 117.00 115.99 1ntr n LEU 43 Ca -0.04 -0.54 0.39 0.00 -0.03 0.00 0.00 56.01 55.80 1ntr n LEU 43 Cb 0.53 -0.02 0.61 0.00 -2.33 0.00 0.00 43.42 42.21 1ntr n LEU 43 CO 0.43 0.27 1.10 0.00 -1.33 0.00 0.00 177.39 177.86 1ntr n ALA 44 N 0.22 1.39 0.20 -1.18 0.00 -1.25 0.11 120.51 120.00 1ntr n ALA 44 Ca 0.19 0.53 -0.14 0.00 0.00 0.00 0.00 53.44 54.02 1ntr n ALA 44 Cb 0.36 -0.86 -0.08 0.00 0.00 0.00 0.00 19.45 18.86 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 -0.44 0.00 0.00 0.87 -1.93 -3.47 113.55 108.58 1ntr h SER 45 Ca 0.71 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 61.16 1ntr h SER 45 Cb 2.77 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 64.85 1ntr h SER 45 CO -0.07 -0.11 0.00 0.29 -0.53 0.00 0.00 176.83 176.41 1ntr n LYS 46 N -5.21 0.00 -0.89 2.24 5.02 0.31 -5.00 118.16 114.63 1ntr n LYS 46 Ca -0.10 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.83 1ntr n LYS 46 Cb 0.28 0.00 0.08 0.00 -0.02 0.00 0.00 35.03 35.37 1ntr n LYS 46 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1ntr n THR 47 N 0.00 0.00 -0.03 -0.18 -1.04 -1.25 -4.96 114.28 106.82 1ntr n THR 47 Ca 0.00 -0.18 -0.02 0.00 -2.04 0.00 0.00 64.05 61.81 1ntr n THR 47 Cb 0.00 -0.23 -0.01 0.00 -1.82 0.00 0.00 70.33 68.27 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 0.80 0.18 0.03 -2.82 -0.04 -1.26 -4.96 135.00 126.93 1ntr n PRO 48 Ca -0.01 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 1ntr n PRO 48 Cb 0.67 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 33.02 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 -3.21 0.55 -3.76 3.54 9.92 -0.99 -4.92 116.55 117.68 1ntr n ASP 49 Ca -0.03 0.09 -0.13 0.00 -0.53 0.00 0.00 54.79 54.19 1ntr n ASP 49 Cb 0.11 -0.15 -0.11 0.00 -0.64 0.00 0.00 41.12 40.33 1ntr n ASP 49 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1ntr s VAL 50 N -2.00 -0.00 -0.42 2.53 0.11 -0.87 -4.66 120.40 115.09 1ntr s VAL 50 Ca 0.00 0.01 -0.14 0.00 -2.93 0.00 0.00 61.98 58.92 1ntr s VAL 50 Cb 0.00 -0.46 0.04 0.00 -1.53 0.00 0.00 36.38 34.43 1ntr s VAL 50 CO 0.00 0.00 0.31 -0.22 -3.33 0.00 0.00 175.10 171.86 1ntr s LEU 51 N 0.26 5.18 0.61 2.54 0.20 -0.97 -0.56 118.68 125.93 1ntr s LEU 51 Ca -0.01 -1.07 0.08 0.00 0.69 0.00 0.00 54.13 53.82 1ntr s LEU 51 Cb -0.03 -2.13 0.10 0.00 -0.43 0.00 0.00 46.19 43.70 1ntr s LEU 51 CO -0.00 -0.50 0.84 -0.22 -0.29 0.00 0.00 176.35 176.18 1ntr s LEU 52 N 1.63 3.05 -0.29 -0.68 2.96 0.64 -2.41 118.68 123.59 1ntr s LEU 52 Ca 0.04 -0.79 -0.14 0.00 -0.22 0.00 0.00 54.13 53.02 1ntr s LEU 52 Cb -0.21 -1.63 0.11 0.00 0.50 0.00 0.00 46.19 44.96 1ntr s LEU 52 CO 0.08 -1.48 0.75 -0.44 -1.32 0.00 0.00 176.35 173.94 1ntr s SER 53 N -4.70 -0.90 0.00 3.68 0.01 0.27 -2.48 113.70 109.58 1ntr s SER 53 Ca 0.63 1.35 0.00 0.00 1.31 0.00 0.00 55.95 59.25 1ntr s SER 53 Cb -0.05 1.62 0.00 0.00 0.21 0.00 0.00 66.02 67.80 1ntr s SER 53 CO 0.40 -0.20 0.00 -0.67 0.41 0.00 0.00 173.24 173.18 1ntr n ASP 54 N 4.57 0.00 0.00 2.44 2.03 -1.10 -2.25 116.55 122.24 1ntr n ASP 54 Ca -0.17 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.14 1ntr n ASP 54 Cb 0.56 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 1ntr n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ntr n ILE 55 N 0.00 0.00 -2.71 5.18 0.13 -1.26 -4.08 119.36 116.62 1ntr n ILE 55 Ca 0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 62.75 61.63 1ntr n ILE 55 Cb 0.00 0.00 0.02 0.00 -0.84 0.00 0.00 39.64 38.82 1ntr n ILE 55 CO 0.00 0.00 0.00 -0.60 2.80 0.00 0.00 176.55 178.75 1ntr s ARG 56 N 0.00 0.25 -0.08 9.51 3.00 -1.26 -4.87 118.95 125.50 1ntr s ARG 56 Ca 0.00 -0.20 0.01 0.00 -1.00 0.00 0.00 55.73 54.53 1ntr s ARG 56 Cb 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 34.95 34.97 1ntr s ARG 56 CO 0.00 -0.32 -0.07 -1.64 0.00 0.00 0.00 175.30 173.27 1ntr s MET 57 N 1.28 1.28 -0.46 5.12 -1.94 -1.26 -4.71 119.30 118.61 1ntr s MET 57 Ca 0.21 -0.21 -0.35 0.00 -1.71 0.00 0.00 55.69 53.63 1ntr s MET 57 Cb 0.09 -1.27 -0.13 0.00 2.01 0.00 0.00 34.83 35.52 1ntr s MET 57 CO -0.12 -0.15 2.26 -0.35 -0.01 0.00 0.00 175.02 176.66 1ntr n PRO 58 N 4.45 0.77 0.00 2.03 -0.04 -1.26 -3.96 135.00 136.99 1ntr n PRO 58 Ca -0.17 0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1ntr n PRO 58 Cb 0.51 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 1ntr n PRO 58 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ntr n GLY 59 N 6.65 3.90 2.85 0.55 0.00 -1.26 -4.94 105.19 112.95 1ntr n GLY 59 Ca 0.46 -1.40 -0.04 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.56 -1.75 -3.35 1.61 2.81 -1.26 -3.69 117.12 110.93 1ntr n MET 60 Ca 0.00 0.59 -0.31 0.00 -1.81 0.00 0.00 57.70 56.17 1ntr n MET 60 Cb 0.00 -4.96 0.03 0.00 -0.71 0.00 0.00 33.22 27.59 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 -0.95 -6.07 -2.32 7.83 9.92 -1.26 -4.24 116.55 119.45 1ntr n ASP 61 Ca -0.04 0.02 -0.00 0.00 -0.53 0.00 0.00 54.79 54.24 1ntr n ASP 61 Cb 0.49 -2.48 -0.00 0.00 -0.64 0.00 0.00 41.12 38.49 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 -0.16 -3.86 0.00 0.44 0.00 -1.24 -4.39 105.19 95.98 1ntr n GLY 62 Ca -0.04 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1ntr n GLY 62 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ntr n LEU 63 N 0.48 0.00 -2.88 0.99 -0.00 -1.26 -4.60 117.00 109.73 1ntr n LEU 63 Ca -0.00 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.02 1ntr n LEU 63 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.43 1ntr n LEU 63 CO 0.30 -0.70 0.36 0.00 -0.00 0.00 0.00 177.39 177.35 1ntr s ALA 64 N -2.13 -3.86 -1.49 1.47 0.00 -1.26 -4.53 121.76 109.96 1ntr s ALA 64 Ca 0.00 0.95 0.27 0.00 0.00 0.00 0.00 51.96 53.18 1ntr s ALA 64 Cb 0.00 -2.94 0.83 0.00 0.00 0.00 0.00 23.12 21.02 1ntr s ALA 64 CO 0.00 -2.42 1.62 1.28 0.00 0.00 0.00 175.76 176.24 1ntr n LEU 65 N 3.84 0.70 0.22 0.00 7.99 -1.26 -3.97 117.00 124.52 1ntr n LEU 65 Ca 0.07 -0.09 0.15 0.00 -0.01 0.00 0.00 56.01 56.14 1ntr n LEU 65 Cb 0.62 -0.19 0.63 0.00 -0.11 0.00 0.00 43.42 44.36 1ntr n LEU 65 CO -0.08 0.14 1.13 0.25 -1.51 0.00 0.00 177.39 177.32 1ntr h LEU 66 N 0.68 0.00 -0.27 2.23 6.46 -1.97 0.10 115.31 122.54 1ntr h LEU 66 Ca 0.00 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.71 1ntr h LEU 66 Cb 0.47 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 1ntr h LEU 66 CO 0.00 0.00 -0.01 0.50 -0.62 0.00 0.00 178.44 178.31 1ntr h LYS 67 N 0.00 0.49 0.04 1.25 1.63 -1.88 -3.24 116.57 114.86 1ntr h LYS 67 Ca 0.10 -0.16 -0.12 0.00 -0.85 0.00 0.00 60.65 59.62 1ntr h LYS 67 Cb 1.21 -0.04 0.01 0.00 -0.60 0.00 0.00 32.23 32.81 1ntr h LYS 67 CO -0.00 0.65 -0.50 -0.56 -3.45 0.00 0.00 179.45 175.60 1ntr h GLN 68 N 0.27 0.26 -1.67 1.90 -0.00 -1.12 -2.69 115.11 112.07 1ntr h GLN 68 Ca 0.08 -0.34 0.51 0.00 -0.00 0.00 0.00 58.65 58.90 1ntr h GLN 68 Cb 0.44 0.11 -0.10 0.00 -0.00 0.00 0.00 27.48 27.93 1ntr h GLN 68 CO 0.02 1.08 1.16 -0.89 -0.00 0.00 0.00 178.83 180.20 1ntr n ILE 69 N -4.32 -0.09 -0.02 1.86 -0.00 -0.94 -0.98 119.36 114.87 1ntr n ILE 69 Ca -0.11 1.52 -0.02 0.00 -0.00 0.00 0.00 62.75 64.15 1ntr n ILE 69 Cb 0.65 -2.52 -0.01 0.00 -0.00 0.00 0.00 39.64 37.76 1ntr n ILE 69 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1ntr n LYS 70 N -4.11 0.12 -0.58 0.38 0.00 -1.22 -3.59 118.16 109.16 1ntr n LYS 70 Ca 0.41 0.17 0.43 0.00 0.00 0.00 0.00 58.31 59.32 1ntr n LYS 70 Cb 1.76 -0.84 0.67 0.00 0.00 0.00 0.00 35.03 36.61 1ntr n LYS 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1ntr n GLN 71 N -2.92 -0.00 0.00 1.64 6.02 -0.99 -3.14 117.38 117.99 1ntr n GLN 71 Ca -0.03 0.89 0.00 0.00 -0.01 0.00 0.00 57.00 57.85 1ntr n GLN 71 Cb 0.10 -2.05 0.00 0.00 1.02 0.00 0.00 30.24 29.31 1ntr n GLN 71 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1ntr n ARG 72 N -3.60 0.00 -1.61 -1.09 5.12 -0.15 -4.94 116.66 110.39 1ntr n ARG 72 Ca 0.36 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.87 1ntr n ARG 72 Cb 1.64 0.00 0.02 0.00 -1.16 0.00 0.00 32.46 32.96 1ntr n ARG 72 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1ntr n HIS 73 N 0.00 1.13 0.00 -1.55 8.25 -1.19 -4.90 115.22 116.97 1ntr n HIS 73 Ca 0.00 0.54 0.00 0.00 -0.26 0.00 0.00 57.72 58.00 1ntr n HIS 73 Cb 0.00 -2.22 0.00 0.00 1.12 0.00 0.00 29.99 28.89 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 0.03 0.00 -2.92 -0.41 -0.04 -1.26 -4.63 135.00 125.78 1ntr n PRO 74 Ca 0.10 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.59 1ntr n PRO 74 Cb 0.40 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.62 1ntr n PRO 74 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ntr s MET 75 N 0.00 0.09 0.12 0.54 0.23 -1.26 -4.83 119.30 114.18 1ntr s MET 75 Ca 0.00 0.01 0.08 0.00 -1.03 0.00 0.00 55.69 54.75 1ntr s MET 75 Cb 0.00 0.02 -0.04 0.00 -1.53 0.00 0.00 34.83 33.29 1ntr s MET 75 CO 0.00 -0.15 -0.19 -0.48 -2.03 0.00 0.00 175.02 172.17 1ntr s LEU 76 N 2.44 2.34 0.05 0.18 0.05 -1.26 -5.07 118.68 117.41 1ntr s LEU 76 Ca 0.22 -0.74 -0.15 0.00 0.05 0.00 0.00 54.13 53.51 1ntr s LEU 76 Cb 0.02 -0.83 -0.08 0.00 -2.05 0.00 0.00 46.19 43.25 1ntr s LEU 76 CO -0.19 0.01 0.33 -0.81 -0.55 0.00 0.00 176.35 175.15 1ntr n PRO 77 N 0.84 0.00 -3.88 1.48 -0.04 -1.26 -4.63 135.00 127.50 1ntr n PRO 77 Ca -0.18 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.17 1ntr n PRO 77 Cb 0.55 -0.53 -0.11 0.00 -0.04 0.00 0.00 33.50 33.36 1ntr n PRO 77 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ntr s VAL 78 N -0.26 0.06 -0.00 0.52 -7.23 -0.88 -2.30 120.40 110.30 1ntr s VAL 78 Ca 0.33 -0.47 -0.06 0.00 -1.81 0.00 0.00 61.98 59.97 1ntr s VAL 78 Cb -0.47 -0.28 0.00 0.00 0.56 0.00 0.00 36.38 36.18 1ntr s VAL 78 CO 0.25 -0.26 0.11 -0.63 -0.31 0.00 0.00 175.10 174.26 1ntr s ILE 79 N -0.84 0.08 0.06 -0.62 1.01 -1.01 -3.31 121.20 116.56 1ntr s ILE 79 Ca -0.09 -0.62 0.04 0.00 0.00 0.00 0.00 60.65 59.97 1ntr s ILE 79 Cb -0.05 -0.37 -0.03 0.00 0.01 0.00 0.00 42.46 42.01 1ntr s ILE 79 CO 0.00 -0.34 -0.11 -0.63 0.00 0.00 0.00 174.94 173.87 1ntr s ILE 80 N -1.18 0.80 0.75 2.92 1.09 -1.21 -0.57 121.20 123.80 1ntr s ILE 80 Ca -0.13 -1.21 -0.11 0.00 -1.10 0.00 0.00 60.65 58.10 1ntr s ILE 80 Cb -0.07 -0.84 0.04 0.00 -1.06 0.00 0.00 42.46 40.52 1ntr s ILE 80 CO 0.01 -0.33 1.10 -0.04 -0.10 0.00 0.00 174.94 175.58 1ntr s MET 81 N -1.72 2.52 0.42 2.79 -1.94 -0.96 -0.75 119.30 119.67 1ntr s MET 81 Ca -0.06 0.56 -0.00 0.00 -1.71 0.00 0.00 55.69 54.48 1ntr s MET 81 Cb -0.10 -1.97 -0.01 0.00 2.01 0.00 0.00 34.83 34.76 1ntr s MET 81 CO 0.01 -1.30 0.65 0.99 -0.01 0.00 0.00 175.02 175.36 1ntr s THR 82 N -3.26 4.40 0.00 2.05 2.01 0.09 -4.78 115.64 116.15 1ntr s THR 82 Ca 0.59 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.17 1ntr s THR 82 Cb -0.13 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.76 1ntr s THR 82 CO 0.53 -0.44 0.00 0.00 -0.69 0.00 0.00 174.62 174.01 1ntr n ALA 83 N -2.01 0.00 -3.63 7.40 0.00 -1.26 -4.86 120.51 116.15 1ntr n ALA 83 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.54 1ntr n ALA 83 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.03 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 0.00 -0.33 0.00 0.00 -0.00 -1.26 -5.10 115.22 108.52 1ntr n HIS 84 Ca 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 57.72 57.25 1ntr n HIS 84 Cb 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 29.99 30.20 1ntr n HIS 84 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1ntr n SER 85 N -0.75 0.00 0.00 0.26 2.88 -1.26 -4.69 113.62 110.06 1ntr n SER 85 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1ntr n SER 85 Cb 0.37 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 1ntr n SER 85 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1ntr n ASP 86 N 7.44 0.00 0.00 -3.46 5.68 -1.26 -4.06 116.55 120.88 1ntr n ASP 86 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1ntr n ASP 86 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1ntr n ASP 86 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1ntr n LEU 87 N 0.00 0.00 0.11 -2.12 -0.00 -1.26 0.15 117.00 113.89 1ntr n LEU 87 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.92 1ntr n LEU 87 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.37 1ntr n LEU 87 CO 0.00 0.00 0.51 -0.78 -0.00 0.00 0.00 177.39 177.12 1ntr h ASP 88 N 0.00 -0.79 -0.62 1.96 1.82 -1.99 0.41 116.42 117.20 1ntr h ASP 88 Ca 0.00 0.07 0.11 0.00 -0.39 0.00 0.00 57.03 56.82 1ntr h ASP 88 Cb 0.00 0.27 -0.08 0.00 0.68 0.00 0.00 39.33 40.20 1ntr h ASP 88 CO 0.00 -0.33 0.18 0.00 -1.61 0.00 0.00 179.24 177.48 1ntr h ALA 89 N -1.18 0.78 -1.19 -0.78 0.00 0.11 -2.62 119.26 114.38 1ntr h ALA 89 Ca -0.02 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ntr h ALA 89 Cb 0.44 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ntr h ALA 89 CO -0.09 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 178.90 1ntr n ALA 90 N -2.55 -0.19 -0.38 0.00 0.00 -0.97 -3.35 120.51 113.08 1ntr n ALA 90 Ca 0.10 0.00 0.29 0.00 0.00 0.00 0.00 53.44 53.83 1ntr n ALA 90 Cb 0.32 0.00 0.47 0.00 0.00 0.00 0.00 19.45 20.24 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 -0.06 -3.93 0.00 0.31 0.14 -4.21 118.33 109.17 1ntr n VAL 91 Ca 0.00 0.97 -0.21 0.00 -0.01 0.00 0.00 64.34 65.09 1ntr n VAL 91 Cb 0.00 -1.61 -0.03 0.00 -0.91 0.00 0.00 33.84 31.29 1ntr n VAL 91 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ntr s SER 92 N -4.10 5.84 -0.02 4.52 0.15 -0.99 -4.30 113.70 114.80 1ntr s SER 92 Ca -0.04 -0.16 -0.01 0.00 0.70 0.00 0.00 55.95 56.45 1ntr s SER 92 Cb 0.17 -1.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.00 1ntr s SER 92 CO 0.52 -0.15 0.02 0.00 1.20 0.00 0.00 173.24 174.84 1ntr n ALA 93 N -1.36 -3.01 -3.91 5.45 0.00 -1.26 -4.46 120.51 111.97 1ntr n ALA 93 Ca -0.06 0.05 -0.37 0.00 0.00 0.00 0.00 53.44 53.06 1ntr n ALA 93 Cb 0.58 -0.15 0.02 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.38 -1.70 -2.20 0.00 4.01 -1.26 -4.83 117.16 110.79 1ntr n TYR 94 Ca 0.00 0.37 -0.41 0.00 -0.16 0.00 0.00 57.90 57.71 1ntr n TYR 94 Cb 0.02 -2.92 -0.03 0.00 -0.31 0.00 0.00 39.34 36.10 1ntr n TYR 94 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 1ntr s GLN 95 N -6.38 4.38 0.11 -0.72 -2.07 -1.26 -4.72 119.66 109.00 1ntr s GLN 95 Ca 0.34 2.07 0.00 0.00 -1.82 0.00 0.00 55.36 55.95 1ntr s GLN 95 Cb -0.17 -3.18 0.00 0.00 -1.09 0.00 0.00 33.01 28.56 1ntr s GLN 95 CO 0.93 -0.26 0.00 0.94 -1.32 0.00 0.00 175.29 175.58 1ntr n GLN 96 N 2.54 -0.72 -1.47 9.60 7.27 -1.26 -5.02 117.38 128.32 1ntr n GLN 96 Ca 0.06 0.56 0.00 0.00 0.07 0.00 0.00 57.00 57.69 1ntr n GLN 96 Cb 0.43 -0.71 0.00 0.00 2.41 0.00 0.00 30.24 32.36 1ntr n GLN 96 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ntr n GLY 97 N -1.78 -2.82 2.67 1.69 0.00 -1.26 -4.46 105.19 99.23 1ntr n GLY 97 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.01 0.00 -3.92 4.61 0.00 -1.26 -4.97 120.51 114.97 1ntr n ALA 98 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1ntr n ALA 98 Cb 0.00 -0.25 -0.16 0.00 0.00 0.00 0.00 19.45 19.04 1ntr n ALA 98 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ntr s PHE 99 N -2.57 2.13 0.33 0.00 0.08 -1.26 -2.08 117.98 114.60 1ntr s PHE 99 Ca 0.00 -1.48 0.06 0.00 0.12 0.00 0.00 56.93 55.63 1ntr s PHE 99 Cb 0.00 -1.49 -0.06 0.00 -0.57 0.00 0.00 43.02 40.90 1ntr s PHE 99 CO 0.00 -0.72 -0.01 0.34 -0.10 0.00 0.00 175.22 174.73 1ntr s ASP 100 N 1.49 2.97 -0.29 1.36 2.15 -1.21 -4.41 116.67 118.73 1ntr s ASP 100 Ca -0.03 -1.29 0.02 0.00 0.43 0.00 0.00 52.55 51.69 1ntr s ASP 100 Cb -0.17 -0.21 0.08 0.00 -0.30 0.00 0.00 42.92 42.32 1ntr s ASP 100 CO -0.07 -0.43 -0.01 -0.31 -0.17 0.00 0.00 175.17 174.17 1ntr s TYR 101 N -3.00 2.99 -0.04 -5.34 2.02 -1.26 -3.34 117.35 109.38 1ntr s TYR 101 Ca 0.33 -2.33 -0.30 0.00 -0.37 0.00 0.00 57.07 54.40 1ntr s TYR 101 Cb 0.07 -2.15 -0.04 0.00 -0.40 0.00 0.00 41.96 39.43 1ntr s TYR 101 CO 0.15 -0.87 1.29 -1.17 -1.57 0.00 0.00 175.55 173.38 1ntr s LEU 102 N 1.18 4.29 0.62 -1.29 2.96 0.07 -4.83 118.68 121.68 1ntr s LEU 102 Ca 0.01 1.93 -0.01 0.00 -0.22 0.00 0.00 54.13 55.85 1ntr s LEU 102 Cb -0.19 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 43.00 1ntr s LEU 102 CO -0.09 -0.66 0.87 -2.16 -1.32 0.00 0.00 176.35 172.99 1ntr s PRO 103 N 2.41 2.28 0.06 0.98 0.04 -1.26 -0.74 135.00 138.78 1ntr s PRO 103 Ca 0.59 -0.74 0.08 0.00 0.04 0.00 0.00 61.00 60.97 1ntr s PRO 103 Cb -0.27 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.85 1ntr s PRO 103 CO 0.23 -0.98 -0.20 -1.59 0.04 0.00 0.00 177.00 174.50 1ntr s LYS 104 N -4.95 1.94 0.71 4.56 -2.85 -1.26 -3.66 119.74 114.24 1ntr s LYS 104 Ca 0.60 -1.05 -0.10 0.00 -1.00 0.00 0.00 55.97 54.42 1ntr s LYS 104 Cb -0.09 -2.12 0.04 0.00 -2.06 0.00 0.00 37.83 33.60 1ntr s LYS 104 CO 0.41 0.52 1.07 -1.25 0.10 0.00 0.00 175.35 176.20 1ntr s PRO 105 N -1.51 2.51 0.00 1.78 0.04 -1.26 -5.12 135.00 131.44 1ntr s PRO 105 Ca 0.14 0.16 0.01 0.00 0.04 0.00 0.00 61.00 61.36 1ntr s PRO 105 Cb -0.10 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.36 1ntr s PRO 105 CO 0.05 -1.16 -0.05 -0.59 0.04 0.00 0.00 177.00 175.29 1ntr s PHE 106 N -3.33 0.41 -0.07 0.56 -0.71 -1.24 -5.11 117.98 108.49 1ntr s PHE 106 Ca 0.59 -0.11 -0.30 0.00 -1.04 0.00 0.00 56.93 56.07 1ntr s PHE 106 Cb -0.11 -0.26 -0.04 0.00 -1.21 0.00 0.00 43.02 41.40 1ntr s PHE 106 CO 0.49 -0.01 1.36 0.34 -1.34 0.00 0.00 175.22 176.05 1ntr s ASP 107 N -0.23 6.89 0.50 1.98 -1.08 -1.26 -4.88 116.67 118.59 1ntr s ASP 107 Ca 0.01 1.95 0.17 0.00 -0.52 0.00 0.00 52.55 54.15 1ntr s ASP 107 Cb -0.02 -2.55 1.21 0.00 -1.46 0.00 0.00 42.92 40.10 1ntr s ASP 107 CO -0.00 -0.73 2.10 -0.29 0.52 0.00 0.00 175.17 176.76 1ntr h ILE 108 N 5.20 1.01 0.01 4.11 6.09 -1.99 -0.93 117.51 131.02 1ntr h ILE 108 Ca -0.34 -0.24 -0.03 0.00 -1.37 0.00 0.00 64.86 62.88 1ntr h ILE 108 Cb 1.15 1.13 0.00 0.00 0.47 0.00 0.00 36.82 39.57 1ntr h ILE 108 CO 0.93 0.07 -0.14 -0.78 -3.07 0.00 0.00 178.15 175.15 1ntr h ASP 109 N 0.00 0.05 -0.81 2.19 1.82 -1.90 -1.28 116.42 116.49 1ntr h ASP 109 Ca -0.00 -0.97 0.21 0.00 -0.39 0.00 0.00 57.03 55.88 1ntr h ASP 109 Cb 0.13 -0.02 -0.04 0.00 0.68 0.00 0.00 39.33 40.08 1ntr h ASP 109 CO 0.01 1.06 0.57 -0.08 -1.61 0.00 0.00 179.24 179.19 1ntr h GLU 110 N -0.93 0.13 0.00 0.28 4.57 -1.89 -1.21 114.58 115.53 1ntr h GLU 110 Ca -0.03 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1ntr h GLU 110 Cb 1.08 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 1ntr h GLU 110 CO 0.01 0.09 -0.00 0.00 -1.18 0.00 0.00 179.01 177.92 1ntr h ALA 111 N 1.61 -0.07 -0.77 2.92 0.00 -1.17 -2.24 119.26 119.55 1ntr h ALA 111 Ca 0.40 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.42 1ntr h ALA 111 Cb 1.36 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.03 1ntr h ALA 111 CO -0.06 -0.06 -0.32 0.28 0.00 0.00 0.00 179.25 179.08 1ntr n VAL 112 N -2.10 -0.42 0.19 0.00 0.31 -0.49 -1.52 118.33 114.30 1ntr n VAL 112 Ca -0.00 1.81 -0.07 0.00 -0.01 0.00 0.00 64.34 66.06 1ntr n VAL 112 Cb 0.00 -2.37 -0.04 0.00 -0.91 0.00 0.00 33.84 30.53 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 0.96 -0.90 -0.58 3.52 0.00 -1.38 -1.63 119.26 119.24 1ntr h ALA 113 Ca 0.25 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1ntr h ALA 113 Cb 0.44 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1ntr h ALA 113 CO -0.76 -0.87 -0.34 -0.11 0.00 0.00 0.00 179.25 177.17 1ntr n LEU 114 N -3.60 -0.61 0.06 0.00 -0.00 -0.58 0.77 117.00 113.05 1ntr n LEU 114 Ca -0.06 1.12 -0.11 0.00 -0.00 0.00 0.00 56.01 56.96 1ntr n LEU 114 Cb 0.19 -0.18 -0.05 0.00 -0.00 0.00 0.00 43.42 43.38 1ntr n LEU 114 CO 0.15 -0.88 0.77 0.58 -0.00 0.00 0.00 177.39 178.00 1ntr h VAL 115 N 0.00 0.65 -0.77 1.96 2.07 -1.34 -2.38 116.25 116.44 1ntr h VAL 115 Ca 0.09 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.85 1ntr h VAL 115 Cb 0.24 0.65 -0.14 0.00 -1.52 0.00 0.00 31.29 30.52 1ntr h VAL 115 CO -0.54 0.00 0.10 1.21 0.02 0.00 0.00 177.57 178.36 1ntr n GLU 116 N -5.27 -0.06 0.06 1.57 4.07 0.23 0.10 120.64 121.35 1ntr n GLU 116 Ca -0.05 1.13 -0.12 0.00 -0.06 0.00 0.00 57.16 58.06 1ntr n GLU 116 Cb 0.19 -1.85 -0.06 0.00 -0.06 0.00 0.00 31.44 29.66 1ntr n GLU 116 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ntr h ARG 117 N 0.00 -0.49 -0.06 5.31 3.08 -0.95 -2.14 114.38 119.14 1ntr h ARG 117 Ca 0.51 0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.62 1ntr h ARG 117 Cb 1.13 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 31.24 1ntr h ARG 117 CO -0.70 -0.33 -0.47 0.00 -1.07 0.00 0.00 179.97 177.41 1ntr h ALA 118 N 0.16 -0.76 -1.03 0.04 0.00 0.60 0.12 119.26 118.39 1ntr h ALA 118 Ca 0.06 -0.05 0.39 0.00 0.00 0.00 0.00 54.91 55.31 1ntr h ALA 118 Cb 0.59 0.86 -0.14 0.00 0.00 0.00 0.00 17.79 19.10 1ntr h ALA 118 CO -0.28 -1.01 0.62 -0.89 0.00 0.00 0.00 179.25 177.69 1ntr n ILE 119 N -5.45 -0.30 0.00 0.00 2.08 -0.85 -2.54 119.36 112.31 1ntr n ILE 119 Ca -0.06 1.68 0.00 0.00 0.56 0.00 0.00 62.75 64.93 1ntr n ILE 119 Cb 0.38 -2.74 0.00 0.00 -0.75 0.00 0.00 39.64 36.53 1ntr n ILE 119 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1ntr n SER 120 N -4.72 0.00 0.00 4.38 2.88 0.42 -4.51 113.62 112.07 1ntr n SER 120 Ca 0.34 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.88 1ntr n SER 120 Cb 1.24 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.70 1ntr n SER 120 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1ntr n HIS 121 N -2.62 0.00 -2.40 0.66 -0.00 -1.05 -4.89 115.22 104.91 1ntr n HIS 121 Ca 0.00 0.00 -0.02 0.00 0.46 0.00 0.00 57.72 58.16 1ntr n HIS 121 Cb 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1ntr n HIS 121 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1ntr n TYR 122 N 0.00 -1.75 0.07 1.57 4.01 -1.26 -4.64 117.16 115.16 1ntr n TYR 122 Ca 0.00 0.04 0.21 0.00 -0.16 0.00 0.00 57.90 57.98 1ntr n TYR 122 Cb 0.00 -0.94 0.67 0.00 -0.31 0.00 0.00 39.34 38.76 1ntr n TYR 122 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1ntr h GLN 123 N -0.04 0.00 0.00 -0.72 -0.00 -1.90 -3.54 115.11 108.90 1ntr h GLN 123 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1ntr h GLN 123 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.40 1ntr h GLN 123 CO 0.05 0.00 0.00 -0.85 0.00 0.00 0.00 178.83 178.03