#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1srh h GLY 16 N 0.00 -0.07 1.10 0.00 0.00 -2.02 -3.30 103.07 98.77 1srh h GLY 16 Ca 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 47.33 47.22 1srh h GLY 16 CO 0.00 -0.03 -0.26 -2.22 0.00 0.00 0.00 176.54 174.03 1srh h ILE 17 N -0.64 1.27 -3.10 2.60 2.04 -1.98 -3.44 117.51 114.26 1srh h ILE 17 Ca -0.01 -1.43 -0.53 0.00 1.00 0.00 0.00 64.86 63.89 1srh h ILE 17 Cb 0.56 1.24 0.08 0.00 -0.74 0.00 0.00 36.82 37.96 1srh h ILE 17 CO 0.01 0.48 0.90 0.41 0.00 0.00 0.00 178.15 179.96 1srh n THR 18 N -4.13 0.78 -0.93 -0.27 -1.04 -1.24 -4.82 114.28 102.64 1srh n THR 18 Ca -0.01 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 1srh n THR 18 Cb 0.48 -1.94 0.00 0.00 -1.82 0.00 0.00 70.33 67.04 1srh n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1srh n GLY 19 N 2.57 0.48 3.48 3.41 0.00 -0.71 -4.69 105.19 109.73 1srh n GLY 19 Ca 0.10 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.03 1srh n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1srh s THR 20 N -2.35 4.01 0.17 2.61 2.01 -1.26 -1.00 115.64 119.83 1srh s THR 20 Ca 0.00 -0.30 0.08 0.00 0.31 0.00 0.00 61.69 61.78 1srh s THR 20 Cb 0.00 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 1srh s THR 20 CO 0.00 0.45 -0.17 0.26 -0.69 0.00 0.00 174.62 174.47 1srh s TRP 21 N 0.71 1.75 -0.01 4.92 0.52 0.18 -4.55 118.94 122.46 1srh s TRP 21 Ca -0.00 -0.50 0.03 0.00 0.02 0.00 0.00 56.10 55.65 1srh s TRP 21 Cb -0.14 -0.87 -0.01 0.00 -1.15 0.00 0.00 33.47 31.30 1srh s TRP 21 CO 0.02 0.31 -0.10 0.71 0.02 0.00 0.00 176.95 177.92 1srh s TYR 22 N -2.21 0.85 0.57 -1.98 1.51 0.12 -0.72 117.35 115.49 1srh s TYR 22 Ca 0.16 -0.16 0.03 0.00 -1.01 0.00 0.00 57.07 56.09 1srh s TYR 22 Cb -0.05 -0.55 0.11 0.00 -0.11 0.00 0.00 41.96 41.36 1srh s TYR 22 CO 0.06 -0.01 0.78 0.27 -1.11 0.00 0.00 175.55 175.54 1srh n ASN 23 N 2.83 1.38 -0.03 2.29 0.23 -1.01 -0.26 115.26 120.69 1srh n ASN 23 Ca -0.14 -2.09 0.03 0.00 -0.53 0.00 0.00 54.58 51.85 1srh n ASN 23 Cb 0.57 -0.47 0.38 0.00 -2.08 0.00 0.00 39.78 38.18 1srh n ASN 23 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1srh h GLN 24 N 0.00 0.60 0.00 -3.83 -0.00 -1.90 -2.61 115.11 107.37 1srh h GLN 24 Ca -0.26 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.34 1srh h GLN 24 Cb 1.04 -0.13 0.00 0.00 -0.00 0.00 0.00 27.48 28.39 1srh h GLN 24 CO 0.31 0.42 0.00 -0.07 -0.00 0.00 0.00 178.83 179.49 1srh h LEU 25 N 0.62 0.00 0.00 0.06 3.38 -1.94 -3.47 115.31 113.96 1srh h LEU 25 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1srh h LEU 25 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1srh h LEU 25 CO -0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.11 1srh n GLY 26 N 0.58 0.92 3.79 0.83 0.00 -0.98 -4.78 105.19 105.54 1srh n GLY 26 Ca 0.03 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1srh n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1srh s SER 27 N -2.00 5.96 -0.13 1.61 0.01 -1.26 -4.72 113.70 113.17 1srh s SER 27 Ca 0.00 1.99 0.01 0.00 1.31 0.00 0.00 55.95 59.26 1srh s SER 27 Cb 0.00 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 1srh s SER 27 CO 0.00 -1.05 -0.17 -0.89 0.41 0.00 0.00 173.24 171.54 1srh s THR 28 N -2.03 2.67 -0.30 1.44 2.01 0.81 -2.40 115.64 117.84 1srh s THR 28 Ca 0.68 -0.79 0.01 0.00 0.31 0.00 0.00 61.69 61.90 1srh s THR 28 Cb -0.19 -2.10 0.07 0.00 0.01 0.00 0.00 72.50 70.29 1srh s THR 28 CO 0.27 0.53 -0.02 0.12 -0.69 0.00 0.00 174.62 174.83 1srh s PHE 29 N 0.44 3.38 -0.35 4.92 5.36 0.10 -0.21 117.98 131.63 1srh s PHE 29 Ca -0.12 -2.30 -0.13 0.00 -0.96 0.00 0.00 56.93 53.42 1srh s PHE 29 Cb -0.16 -2.26 -0.01 0.00 -0.34 0.00 0.00 43.02 40.24 1srh s PHE 29 CO 0.05 -0.87 0.27 0.42 -1.46 0.00 0.00 175.22 173.63 1srh s ILE 30 N 1.12 5.26 0.07 3.12 1.01 0.05 -0.65 121.20 131.19 1srh s ILE 30 Ca -0.03 -0.22 0.07 0.00 0.00 0.00 0.00 60.65 60.47 1srh s ILE 30 Cb -0.20 -3.76 -0.03 0.00 0.01 0.00 0.00 42.46 38.48 1srh s ILE 30 CO -0.04 -0.05 -0.19 0.54 0.00 0.00 0.00 174.94 175.19 1srh s VAL 31 N 1.77 1.55 -0.16 2.92 0.11 -0.17 -0.72 120.40 125.70 1srh s VAL 31 Ca 0.07 -1.35 0.01 0.00 -2.93 0.00 0.00 61.98 57.78 1srh s VAL 31 Cb -0.17 -1.40 0.02 0.00 -1.53 0.00 0.00 36.38 33.30 1srh s VAL 31 CO 0.11 -0.01 -0.19 -0.89 -3.33 0.00 0.00 175.10 170.79 1srh s THR 32 N -1.04 1.94 -0.36 5.04 2.01 0.12 -1.74 115.64 121.61 1srh s THR 32 Ca 0.05 -0.87 -0.15 0.00 0.31 0.00 0.00 61.69 61.03 1srh s THR 32 Cb -0.09 -1.76 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 1srh s THR 32 CO 0.03 0.52 0.34 0.00 -0.69 0.00 0.00 174.62 174.82 1srh s ALA 33 N 1.24 3.49 0.57 7.40 0.00 -1.26 -1.37 121.76 131.83 1srh s ALA 33 Ca 0.03 -1.34 -0.16 0.00 0.00 0.00 0.00 51.96 50.49 1srh s ALA 33 Cb -0.13 -2.82 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 1srh s ALA 33 CO -0.10 -1.15 1.03 0.20 0.00 0.00 0.00 175.76 175.74 1srh s GLY 34 N 1.74 2.08 0.42 0.00 0.00 0.12 -4.64 107.32 107.04 1srh s GLY 34 Ca 0.10 0.30 0.15 0.00 0.00 0.00 0.00 44.72 45.27 1srh s GLY 34 CO 0.11 0.61 1.92 0.00 0.00 0.00 0.00 173.10 175.74 1srh h ALA 35 N 0.53 1.50 -0.00 3.20 0.00 -1.98 -2.68 119.26 119.83 1srh h ALA 35 Ca -0.47 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1srh h ALA 35 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1srh h ALA 35 CO 0.59 0.33 -0.01 -0.40 0.00 0.00 0.00 179.25 179.75 1srh n ASP 36 N -4.13 0.03 0.00 0.00 5.75 -1.26 -4.88 116.55 112.06 1srh n ASP 36 Ca -0.02 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.75 1srh n ASP 36 Cb 0.32 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1srh n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1srh n GLY 37 N 1.34 1.18 3.82 6.12 0.00 -1.01 -4.89 105.19 111.76 1srh n GLY 37 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1srh n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1srh s ALA 38 N -2.00 3.54 -0.13 4.61 0.00 -1.25 -0.65 121.76 125.88 1srh s ALA 38 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.00 1srh s ALA 38 Cb 0.00 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.48 1srh s ALA 38 CO 0.00 0.40 -0.21 -0.51 0.00 0.00 0.00 175.76 175.44 1srh s LEU 39 N -1.62 2.21 0.02 0.00 1.43 -0.38 0.11 118.68 120.45 1srh s LEU 39 Ca 0.36 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1srh s LEU 39 Cb -0.17 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 1srh s LEU 39 CO 0.20 0.10 -0.04 0.42 0.23 0.00 0.00 176.35 177.26 1srh s THR 40 N 0.68 0.17 -3.32 5.49 -4.23 -0.47 -1.06 115.64 112.90 1srh s THR 40 Ca -0.10 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.49 1srh s THR 40 Cb -0.16 -0.31 0.00 0.00 1.34 0.00 0.00 72.50 73.37 1srh s THR 40 CO 0.01 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 1srh n GLY 41 N 1.59 -0.55 3.03 3.99 0.00 -1.08 0.13 105.19 112.30 1srh n GLY 41 Ca -0.24 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 44.81 1srh n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1srh s THR 42 N -3.38 0.62 -0.09 2.61 2.01 0.10 -1.50 115.64 116.00 1srh s THR 42 Ca 0.00 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.46 1srh s THR 42 Cb 0.00 -0.57 0.01 0.00 0.01 0.00 0.00 72.50 71.95 1srh s THR 42 CO 0.00 0.01 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.29 1srh s TYR 43 N -0.53 2.11 -0.20 4.92 6.14 0.15 -0.77 117.35 129.17 1srh s TYR 43 Ca -0.00 -0.89 0.01 0.00 0.64 0.00 0.00 57.07 56.83 1srh s TYR 43 Cb -0.05 -1.47 0.04 0.00 0.42 0.00 0.00 41.96 40.90 1srh s TYR 43 CO 0.00 -0.40 -0.15 -2.00 0.64 0.00 0.00 175.55 173.64 1srh s GLU 44 N 0.61 2.54 0.48 4.97 2.12 0.70 0.20 118.70 130.31 1srh s GLU 44 Ca -0.14 -0.96 -0.07 0.00 0.36 0.00 0.00 54.97 54.16 1srh s GLU 44 Cb -0.17 -2.60 -0.04 0.00 0.26 0.00 0.00 34.13 31.59 1srh s GLU 44 CO 0.04 -0.36 0.81 0.45 -0.54 0.00 0.00 175.26 175.66 1srh s SER 45 N 1.27 6.31 0.00 -1.70 0.15 -1.26 -0.13 113.70 118.34 1srh s SER 45 Ca -0.00 1.02 0.07 0.00 0.70 0.00 0.00 55.95 57.73 1srh s SER 45 Cb -0.16 -2.29 -0.07 0.00 -1.71 0.00 0.00 66.02 61.80 1srh s SER 45 CO -0.10 -0.57 0.30 0.00 1.20 0.00 0.00 173.24 174.07 1srh n ALA 46 N -2.11 2.84 -2.35 5.45 0.00 -1.26 -4.87 120.51 118.22 1srh n ALA 46 Ca 0.01 -0.20 -0.18 0.00 0.00 0.00 0.00 53.44 53.08 1srh n ALA 46 Cb 0.55 -0.24 -0.10 0.00 0.00 0.00 0.00 19.45 19.65 1srh n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1srh s VAL 47 N -1.58 0.89 0.08 0.00 -7.23 -1.26 -5.03 120.40 106.27 1srh s VAL 47 Ca 0.03 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 1srh s VAL 47 Cb 0.05 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.46 1srh s VAL 47 CO 0.26 -0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 1srh n GLY 48 N -0.48 -2.10 2.68 2.32 0.00 -1.26 -4.46 105.19 101.88 1srh n GLY 48 Ca -0.03 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.26 1srh n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1srh n ASN 49 N -1.58 4.94 -3.90 1.61 4.05 -1.26 -4.82 115.26 114.31 1srh n ASN 49 Ca 0.00 -2.49 -0.10 0.00 0.45 0.00 0.00 54.58 52.44 1srh n ASN 49 Cb 0.15 -1.23 -0.09 0.00 1.23 0.00 0.00 39.78 39.84 1srh n ASN 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1srh s ALA 50 N 3.54 -0.19 -0.30 5.20 0.00 -1.26 -4.46 121.76 124.29 1srh s ALA 50 Ca 0.49 -0.42 -0.13 0.00 0.00 0.00 0.00 51.96 51.90 1srh s ALA 50 Cb 0.13 0.25 0.13 0.00 0.00 0.00 0.00 23.12 23.62 1srh s ALA 50 CO -0.01 -0.32 0.77 -1.83 0.00 0.00 0.00 175.76 174.37 1srh s GLU 51 N -2.47 0.52 0.29 0.00 -1.05 -1.26 -4.97 118.70 109.75 1srh s GLU 51 Ca -0.06 1.16 0.00 0.00 -0.15 0.00 0.00 54.97 55.92 1srh s GLU 51 Cb -0.02 0.55 0.00 0.00 -0.44 0.00 0.00 34.13 34.22 1srh s GLU 51 CO -0.04 -0.15 0.00 0.45 0.95 0.00 0.00 175.26 176.47 1srh n SER 52 N 4.94 0.00 -4.92 0.83 2.88 -1.26 -4.71 113.62 111.38 1srh n SER 52 Ca -0.14 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.11 1srh n SER 52 Cb 0.53 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.95 1srh n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1srh s ARG 53 N 0.00 3.51 0.04 -1.46 0.52 -1.26 -4.23 118.95 116.08 1srh s ARG 53 Ca 0.00 -0.34 0.05 0.00 -0.52 0.00 0.00 55.73 54.93 1srh s ARG 53 Cb 0.00 -2.92 -0.02 0.00 0.52 0.00 0.00 34.95 32.53 1srh s ARG 53 CO 0.00 0.50 -0.15 0.71 0.02 0.00 0.00 175.30 176.37 1srh s TYR 54 N -1.69 1.35 0.24 -0.53 1.51 0.13 -4.86 117.35 113.51 1srh s TYR 54 Ca 0.38 -0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 55.77 1srh s TYR 54 Cb -0.12 -0.80 -0.09 0.00 -0.11 0.00 0.00 41.96 40.85 1srh s TYR 54 CO 0.27 0.05 1.22 0.08 -1.11 0.00 0.00 175.55 176.07 1srh s VAL 55 N -0.88 3.29 0.12 0.71 1.01 -1.26 0.32 120.40 123.70 1srh s VAL 55 Ca 0.02 1.17 0.09 0.00 0.00 0.00 0.00 61.98 63.26 1srh s VAL 55 Cb -0.08 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1srh s VAL 55 CO 0.02 0.23 -0.21 -1.48 0.00 0.00 0.00 175.10 173.65 1srh s LEU 56 N -0.84 2.34 -0.06 3.92 0.05 -0.56 -4.32 118.68 119.21 1srh s LEU 56 Ca 0.51 -0.74 -0.07 0.00 0.05 0.00 0.00 54.13 53.88 1srh s LEU 56 Cb -0.35 -0.93 0.02 0.00 -2.05 0.00 0.00 46.19 42.88 1srh s LEU 56 CO 0.41 0.06 0.18 0.28 -0.55 0.00 0.00 176.35 176.73 1srh s THR 57 N -1.37 0.01 0.14 5.48 -1.32 -0.96 -2.65 115.64 114.97 1srh s THR 57 Ca 0.10 -0.07 -0.05 0.00 -1.21 0.00 0.00 61.69 60.47 1srh s THR 57 Cb -0.09 -0.28 0.02 0.00 -1.51 0.00 0.00 72.50 70.64 1srh s THR 57 CO 0.05 -0.04 0.27 0.61 -2.21 0.00 0.00 174.62 173.31 1srh n GLY 58 N 2.83 1.74 3.10 6.08 0.00 -0.23 -0.77 105.19 117.94 1srh n GLY 58 Ca -0.14 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.64 1srh n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1srh s ARG 59 N -2.06 0.64 0.08 1.61 1.81 -0.75 -1.25 118.95 119.03 1srh s ARG 59 Ca 0.06 -1.00 -0.10 0.00 -1.72 0.00 0.00 55.73 52.96 1srh s ARG 59 Cb -0.02 -0.20 0.01 0.00 -0.45 0.00 0.00 34.95 34.29 1srh s ARG 59 CO 0.05 0.01 0.23 1.52 -0.68 0.00 0.00 175.30 176.43 1srh s TYR 60 N -2.43 0.05 -0.43 -0.53 1.13 0.18 -1.50 117.35 113.82 1srh s TYR 60 Ca -0.01 -0.39 -0.29 0.00 -1.41 0.00 0.00 57.07 54.97 1srh s TYR 60 Cb -0.03 0.01 0.02 0.00 -1.10 0.00 0.00 41.96 40.86 1srh s TYR 60 CO -0.02 -0.54 1.29 0.34 -2.51 0.00 0.00 175.55 174.11 1srh s ASP 61 N -2.61 6.48 0.00 -0.18 2.15 -0.11 -4.55 116.67 117.85 1srh s ASP 61 Ca 0.02 0.72 0.26 0.00 0.43 0.00 0.00 52.55 53.98 1srh s ASP 61 Cb 0.03 -2.54 1.12 0.00 -0.30 0.00 0.00 42.92 41.23 1srh s ASP 61 CO -0.09 -1.33 1.78 -1.54 -0.17 0.00 0.00 175.17 173.81 1srh n SER 62 N 8.33 1.21 -3.14 -0.34 3.41 -1.26 -4.16 113.62 117.67 1srh n SER 62 Ca 0.15 -1.46 -0.21 0.00 -0.26 0.00 0.00 58.87 57.08 1srh n SER 62 Cb 0.48 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.36 1srh n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1srh n ALA 63 N -0.03 1.94 -1.14 7.33 0.00 -1.26 -5.00 120.51 122.34 1srh n ALA 63 Ca 0.19 -3.19 -0.30 0.00 0.00 0.00 0.00 53.44 50.13 1srh n ALA 63 Cb 0.29 -0.89 0.13 0.00 0.00 0.00 0.00 19.45 18.98 1srh n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1srh s PRO 64 N -1.28 1.57 0.00 0.00 0.04 -1.26 -5.17 135.00 128.90 1srh s PRO 64 Ca 0.36 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1srh s PRO 64 Cb 0.22 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.93 1srh s PRO 64 CO -0.11 -2.09 0.18 0.00 0.04 0.00 0.00 177.00 175.01 1srh n ALA 65 N -3.81 0.00 -0.09 8.56 0.00 -1.26 -5.16 120.51 118.75 1srh n ALA 65 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.40 1srh n ALA 65 Cb 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.90 1srh n ALA 65 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1srh n SER 69 N -0.35 2.48 -4.79 0.00 2.88 -1.26 -5.08 113.62 107.50 1srh n SER 69 Ca 0.00 -0.09 -0.29 0.00 -1.33 0.00 0.00 58.87 57.16 1srh n SER 69 Cb 0.00 -0.19 0.11 0.00 -0.75 0.00 0.00 64.21 63.38 1srh n SER 69 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1srh s GLY 70 N -5.69 1.60 -0.30 0.46 0.00 -1.26 -4.99 107.32 97.14 1srh s GLY 70 Ca -0.23 -0.34 -0.08 0.00 0.00 0.00 0.00 44.72 44.06 1srh s GLY 70 CO 0.44 0.15 0.12 -1.59 0.00 0.00 0.00 173.10 172.21 1srh s THR 71 N -3.20 4.35 0.32 0.90 2.01 -0.05 -4.91 115.64 115.06 1srh s THR 71 Ca 0.62 -0.50 -0.28 0.00 0.31 0.00 0.00 61.69 61.84 1srh s THR 71 Cb -0.15 -3.21 -0.10 0.00 0.01 0.00 0.00 72.50 69.05 1srh s THR 71 CO 0.54 0.09 1.21 0.00 -0.69 0.00 0.00 174.62 175.77 1srh s ALA 72 N 1.57 3.41 0.30 7.40 0.00 -1.26 -0.30 121.76 132.88 1srh s ALA 72 Ca 0.04 1.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.90 1srh s ALA 72 Cb -0.17 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.57 1srh s ALA 72 CO 0.05 -0.44 0.68 -0.48 0.00 0.00 0.00 175.76 175.57 1srh s LEU 73 N -1.76 -0.04 -0.09 0.00 2.34 -0.53 -0.94 118.68 117.66 1srh s LEU 73 Ca 0.48 -0.82 -0.32 0.00 0.06 0.00 0.00 54.13 53.53 1srh s LEU 73 Cb -0.35 2.52 0.12 0.00 -0.56 0.00 0.00 46.19 47.92 1srh s LEU 73 CO 0.46 -1.38 1.04 -0.83 -1.06 0.00 0.00 176.35 174.58 1srh s GLY 74 N -2.98 -0.38 0.16 -3.48 0.00 -0.56 -1.89 107.32 98.18 1srh s GLY 74 Ca 0.15 1.29 -0.23 0.00 0.00 0.00 0.00 44.72 45.92 1srh s GLY 74 CO 0.09 0.43 0.63 0.66 0.00 0.00 0.00 173.10 174.91 1srh s TRP 75 N -2.79 -0.49 0.05 1.90 -2.14 -0.55 -1.81 118.94 113.11 1srh s TRP 75 Ca 0.07 0.25 0.06 0.00 2.66 0.00 0.00 56.10 59.14 1srh s TRP 75 Cb -0.01 0.58 -0.02 0.00 -3.10 0.00 0.00 33.47 30.91 1srh s TRP 75 CO -0.07 -0.88 -0.16 0.99 -2.66 0.00 0.00 176.95 174.17 1srh s THR 76 N -3.73 1.28 -0.09 0.66 2.01 0.05 -0.70 115.64 115.12 1srh s THR 76 Ca 0.02 -1.13 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 1srh s THR 76 Cb -0.02 -1.16 0.02 0.00 0.01 0.00 0.00 72.50 71.36 1srh s THR 76 CO -0.10 0.01 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.09 1srh s VAL 77 N -0.92 0.80 -0.15 3.82 1.01 -0.35 -2.26 120.40 122.35 1srh s VAL 77 Ca 0.03 -0.18 -0.15 0.00 0.00 0.00 0.00 61.98 61.67 1srh s VAL 77 Cb -0.08 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1srh s VAL 77 CO 0.02 0.32 0.36 0.00 0.00 0.00 0.00 175.10 175.80 1srh s ALA 78 N 1.55 3.55 -0.44 5.51 0.00 -1.26 -0.88 121.76 129.79 1srh s ALA 78 Ca 0.01 -0.39 -0.07 0.00 0.00 0.00 0.00 51.96 51.51 1srh s ALA 78 Cb -0.13 -2.50 -0.22 0.00 0.00 0.00 0.00 23.12 20.27 1srh s ALA 78 CO -0.05 0.01 3.45 0.91 0.00 0.00 0.00 175.76 180.07 1srh n TRP 79 N 3.74 0.66 -4.38 0.00 7.02 0.58 -4.77 117.44 120.29 1srh n TRP 79 Ca -0.10 -1.93 -0.22 0.00 -1.02 0.00 0.00 57.50 54.23 1srh n TRP 79 Cb 0.52 -1.84 -0.16 0.00 -2.42 0.00 0.00 31.31 27.40 1srh n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1srh s LYS 80 N 1.29 1.22 0.00 -0.99 2.20 -1.26 -1.04 119.74 121.16 1srh s LYS 80 Ca 0.68 -0.27 0.00 0.00 -0.36 0.00 0.00 55.97 56.02 1srh s LYS 80 Cb 0.28 -1.08 0.00 0.00 -1.51 0.00 0.00 37.83 35.52 1srh s LYS 80 CO -0.02 -0.00 0.00 0.27 -0.36 0.00 0.00 175.35 175.24 1srh n ASN 81 N 3.82 0.00 0.24 1.43 0.23 -0.31 -4.78 115.26 115.88 1srh n ASN 81 Ca -0.23 -0.52 0.16 0.00 -0.53 0.00 0.00 54.58 53.45 1srh n ASN 81 Cb 0.52 0.00 0.58 0.00 -2.08 0.00 0.00 39.78 38.80 1srh n ASN 81 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1srh h ASN 82 N 0.00 0.00 0.00 0.53 2.35 -1.93 -3.33 115.58 113.20 1srh h ASN 82 Ca 0.00 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.39 1srh h ASN 82 Cb 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 1srh h ASN 82 CO 0.00 0.00 -2.32 -1.22 -1.65 0.00 0.00 177.43 172.24 1srh n TYR 83 N -2.89 0.00 -4.11 1.19 4.01 -1.26 -5.07 117.16 109.03 1srh n TYR 83 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 1srh n TYR 83 Cb 0.32 -0.88 -0.09 0.00 -0.31 0.00 0.00 39.34 38.38 1srh n TYR 83 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1srh s ARG 84 N -2.46 1.11 -0.23 -0.72 1.70 -1.25 -5.08 118.95 112.03 1srh s ARG 84 Ca -0.32 -1.42 -0.03 0.00 -0.47 0.00 0.00 55.73 53.49 1srh s ARG 84 Cb 0.09 0.30 0.11 0.00 -0.57 0.00 0.00 34.95 34.88 1srh s ARG 84 CO 0.51 -0.37 0.25 1.21 -1.08 0.00 0.00 175.30 175.82 1srh s ASN 85 N -3.06 1.40 0.00 -2.89 3.84 -1.26 -1.17 114.94 111.81 1srh s ASN 85 Ca 0.27 -0.32 0.23 0.00 0.21 0.00 0.00 52.86 53.25 1srh s ASN 85 Cb 0.06 0.45 0.70 0.00 -0.55 0.00 0.00 41.25 41.90 1srh s ASN 85 CO 0.05 -0.34 1.53 0.00 -2.79 0.00 0.00 177.10 175.55 1srh n ALA 86 N 5.32 2.51 -3.88 1.71 0.00 -0.21 -4.95 120.51 121.01 1srh n ALA 86 Ca -0.05 -0.61 -0.28 0.00 0.00 0.00 0.00 53.44 52.51 1srh n ALA 86 Cb 0.49 -1.04 -0.00 0.00 0.00 0.00 0.00 19.45 18.90 1srh n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1srh n HIS 87 N 0.61 -1.71 -3.80 0.00 8.25 -1.26 -4.83 115.22 112.47 1srh n HIS 87 Ca 0.17 0.64 -0.08 0.00 -0.26 0.00 0.00 57.72 58.19 1srh n HIS 87 Cb 0.41 -3.64 -0.03 0.00 1.12 0.00 0.00 29.99 27.85 1srh n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1srh s SER 88 N -4.10 -0.27 -0.12 0.41 1.04 -1.26 -0.58 113.70 108.82 1srh s SER 88 Ca 0.15 -0.56 -0.13 0.00 0.48 0.00 0.00 55.95 55.89 1srh s SER 88 Cb -0.06 0.66 0.03 0.00 0.10 0.00 0.00 66.02 66.76 1srh s SER 88 CO 0.88 -1.21 0.35 0.00 0.98 0.00 0.00 173.24 174.24 1srh s ALA 89 N -3.91 -0.87 -0.02 5.32 0.00 -0.62 -0.30 121.76 121.36 1srh s ALA 89 Ca 0.11 0.91 0.07 0.00 0.00 0.00 0.00 51.96 53.05 1srh s ALA 89 Cb -0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 1srh s ALA 89 CO 0.03 -0.18 -0.24 0.99 0.00 0.00 0.00 175.76 176.36 1srh s THR 90 N -0.04 2.24 -0.09 0.00 2.01 -0.06 -1.30 115.64 118.40 1srh s THR 90 Ca -0.02 -1.06 0.03 0.00 0.31 0.00 0.00 61.69 60.95 1srh s THR 90 Cb -0.03 -1.80 0.01 0.00 0.01 0.00 0.00 72.50 70.69 1srh s THR 90 CO 0.01 0.57 -0.19 0.42 -0.69 0.00 0.00 174.62 174.74 1srh s THR 91 N -0.65 1.65 -0.13 -0.82 -4.23 -0.42 -1.22 115.64 109.83 1srh s THR 91 Ca 0.10 -0.78 -0.02 0.00 -1.18 0.00 0.00 61.69 59.81 1srh s THR 91 Cb -0.10 -1.45 -0.03 0.00 1.34 0.00 0.00 72.50 72.26 1srh s THR 91 CO -0.00 0.47 -0.06 0.26 -0.54 0.00 0.00 174.62 174.75 1srh s TRP 92 N 0.50 2.98 -0.08 3.99 0.51 0.12 -1.71 118.94 125.25 1srh s TRP 92 Ca -0.17 -0.27 0.02 0.00 -2.12 0.00 0.00 56.10 53.56 1srh s TRP 92 Cb -0.17 -1.89 0.01 0.00 -0.81 0.00 0.00 33.47 30.61 1srh s TRP 92 CO 0.06 0.02 -0.13 0.45 -0.51 0.00 0.00 176.95 176.85 1srh s SER 93 N 0.11 1.98 0.00 2.95 0.15 0.09 -1.49 113.70 117.49 1srh s SER 93 Ca -0.02 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1srh s SER 93 Cb -0.14 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.28 1srh s SER 93 CO 0.03 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1srh n GLY 94 N 3.99 1.43 3.14 9.45 0.00 -0.79 -0.98 105.19 121.42 1srh n GLY 94 Ca -0.21 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 1srh n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1srh s GLN 95 N 1.75 0.34 -0.10 1.61 -2.07 -0.75 -1.45 119.66 118.99 1srh s GLN 95 Ca 0.00 0.24 -0.21 0.00 -1.82 0.00 0.00 55.36 53.57 1srh s GLN 95 Cb 0.00 0.16 -0.04 0.00 -1.09 0.00 0.00 33.01 32.04 1srh s GLN 95 CO 0.00 -0.05 0.58 -0.47 -1.32 0.00 0.00 175.29 174.03 1srh s TYR 96 N -0.13 3.53 -0.25 9.60 5.04 0.59 -1.42 117.35 134.31 1srh s TYR 96 Ca -0.02 1.05 0.01 0.00 -2.44 0.00 0.00 57.07 55.67 1srh s TYR 96 Cb -0.03 -2.68 0.05 0.00 0.35 0.00 0.00 41.96 39.65 1srh s TYR 96 CO 0.01 0.11 -0.10 0.08 -1.34 0.00 0.00 175.55 174.31 1srh s VAL 97 N 0.77 2.37 0.70 3.14 1.01 0.16 -0.87 120.40 127.68 1srh s VAL 97 Ca 0.31 -1.38 -0.12 0.00 0.00 0.00 0.00 61.98 60.79 1srh s VAL 97 Cb -0.16 -2.29 0.16 0.00 0.00 0.00 0.00 36.38 34.09 1srh s VAL 97 CO 0.14 0.10 0.93 0.61 0.00 0.00 0.00 175.10 176.87 1srh n GLY 98 N 4.53 -1.47 0.00 4.51 0.00 -1.26 -1.04 105.19 110.46 1srh n GLY 98 Ca -0.16 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1srh n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1srh n GLY 99 N -1.21 0.30 0.30 -0.02 0.00 -1.26 -4.58 105.19 98.72 1srh n GLY 99 Ca 0.12 -2.28 0.02 0.00 0.00 0.00 0.00 46.02 43.87 1srh n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1srh h ALA 100 N 0.00 1.11 -2.43 4.61 0.00 -2.06 -3.14 119.26 117.35 1srh h ALA 100 Ca 0.00 0.03 -0.61 0.00 0.00 0.00 0.00 54.91 54.33 1srh h ALA 100 Cb 0.00 -0.14 -0.42 0.00 0.00 0.00 0.00 17.79 17.23 1srh h ALA 100 CO 0.00 0.10 -0.59 -0.85 0.00 0.00 0.00 179.25 177.91 1srh n GLU 101 N -4.74 2.34 -1.77 0.00 0.28 -1.26 -5.08 120.64 110.40 1srh n GLU 101 Ca 0.12 -4.62 -0.41 0.00 -0.16 0.00 0.00 57.16 52.09 1srh n GLU 101 Cb 0.25 -2.26 -0.00 0.00 1.43 0.00 0.00 31.44 30.85 1srh n GLU 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1srh n ALA 102 N 1.14 2.38 -2.66 -1.84 0.00 -1.19 -4.93 120.51 113.41 1srh n ALA 102 Ca 0.27 0.34 -0.09 0.00 0.00 0.00 0.00 53.44 53.97 1srh n ALA 102 Cb 0.39 -2.42 -0.10 0.00 0.00 0.00 0.00 19.45 17.32 1srh n ALA 102 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1srh s ARG 103 N -1.96 0.49 -0.25 0.00 0.52 -0.20 -4.30 118.95 113.25 1srh s ARG 103 Ca 0.54 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.95 1srh s ARG 103 Cb -0.48 0.18 0.06 0.00 0.52 0.00 0.00 34.95 35.23 1srh s ARG 103 CO 0.63 -0.10 -0.07 0.42 0.02 0.00 0.00 175.30 176.20 1srh s ILE 104 N -2.49 1.75 -0.29 1.52 1.01 -0.42 0.37 121.20 122.65 1srh s ILE 104 Ca -0.06 -1.39 -0.15 0.00 0.00 0.00 0.00 60.65 59.05 1srh s ILE 104 Cb -0.02 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1srh s ILE 104 CO -0.04 -0.10 0.35 0.20 0.00 0.00 0.00 174.94 175.35 1srh s ASN 105 N 1.29 6.21 0.22 3.58 0.01 -0.51 -0.31 114.94 125.43 1srh s ASN 105 Ca -0.06 0.14 0.05 0.00 -0.71 0.00 0.00 52.86 52.28 1srh s ASN 105 Cb -0.19 -2.20 -0.05 0.00 0.41 0.00 0.00 41.25 39.22 1srh s ASN 105 CO -0.06 -0.21 -0.04 0.42 -1.51 0.00 0.00 177.10 175.70 1srh s THR 106 N 2.04 1.24 0.00 1.60 -4.23 0.53 -1.82 115.64 114.99 1srh s THR 106 Ca 0.14 -2.07 0.05 0.00 -1.18 0.00 0.00 61.69 58.63 1srh s THR 106 Cb -0.16 -2.25 -0.02 0.00 1.34 0.00 0.00 72.50 71.42 1srh s THR 106 CO 0.11 -0.42 -0.17 -1.10 -0.54 0.00 0.00 174.62 172.49 1srh s GLN 107 N -3.80 1.32 0.09 3.99 -0.21 -0.15 -1.35 119.66 119.55 1srh s GLN 107 Ca 0.26 -0.67 0.03 0.00 0.02 0.00 0.00 55.36 55.01 1srh s GLN 107 Cb 0.04 -1.30 -0.03 0.00 1.00 0.00 0.00 33.01 32.71 1srh s GLN 107 CO 0.08 0.35 -0.10 1.67 -2.12 0.00 0.00 175.29 175.17 1srh s TRP 108 N -0.50 1.02 -0.11 0.91 1.48 0.34 -0.73 118.94 121.35 1srh s TRP 108 Ca 0.06 -0.65 0.02 0.00 -1.06 0.00 0.00 56.10 54.48 1srh s TRP 108 Cb -0.07 -0.56 0.01 0.00 -1.16 0.00 0.00 33.47 31.69 1srh s TRP 108 CO -0.00 -0.02 -0.18 -0.51 -4.06 0.00 0.00 176.95 172.18 1srh s LEU 109 N -2.36 1.89 -0.28 -4.66 1.43 -0.69 -1.71 118.68 112.29 1srh s LEU 109 Ca 0.04 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 1srh s LEU 109 Cb -0.03 -1.22 0.06 0.00 0.03 0.00 0.00 46.19 45.03 1srh s LEU 109 CO -0.00 0.06 -0.05 -0.22 0.23 0.00 0.00 176.35 176.37 1srh s LEU 110 N 0.79 3.74 -0.18 1.79 1.98 0.11 -1.30 118.68 125.62 1srh s LEU 110 Ca -0.10 -1.43 -0.07 0.00 -2.89 0.00 0.00 54.13 49.64 1srh s LEU 110 Cb -0.16 -1.62 -0.04 0.00 0.66 0.00 0.00 46.19 45.04 1srh s LEU 110 CO 0.01 -0.24 0.05 -0.89 -1.89 0.00 0.00 176.35 173.39 1srh s THR 111 N 1.14 4.70 0.07 3.68 2.01 -0.42 -0.08 115.64 126.74 1srh s THR 111 Ca -0.06 -0.07 -0.01 0.00 0.31 0.00 0.00 61.69 61.87 1srh s THR 111 Cb -0.20 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 1srh s THR 111 CO -0.04 0.47 0.22 -0.44 -0.69 0.00 0.00 174.62 174.14 1srh s SER 112 N 0.34 6.37 -0.02 3.53 0.01 0.37 -1.59 113.70 122.71 1srh s SER 112 Ca 0.02 0.30 -0.30 0.00 1.31 0.00 0.00 55.95 57.29 1srh s SER 112 Cb -0.12 -1.97 -0.04 0.00 0.21 0.00 0.00 66.02 64.09 1srh s SER 112 CO 0.00 0.16 1.16 -0.83 0.41 0.00 0.00 173.24 174.15 1srh s GLY 113 N -2.48 2.28 0.15 3.44 0.00 0.25 -4.85 107.32 106.12 1srh s GLY 113 Ca 0.35 0.65 0.00 0.00 0.00 0.00 0.00 44.72 45.73 1srh s GLY 113 CO 0.27 2.09 0.03 -0.51 0.00 0.00 0.00 173.10 174.99 1srh s THR 114 N 1.78 0.40 0.92 0.90 -4.23 -1.26 -4.98 115.64 109.16 1srh s THR 114 Ca 0.56 -1.95 -0.12 0.00 -1.18 0.00 0.00 61.69 59.00 1srh s THR 114 Cb -0.25 -2.10 0.14 0.00 1.34 0.00 0.00 72.50 71.63 1srh s THR 114 CO 0.24 -0.46 1.11 0.42 -0.54 0.00 0.00 174.62 175.40 1srh s THR 115 N -3.85 2.24 0.37 3.99 -4.23 -1.26 -4.86 115.64 108.04 1srh s THR 115 Ca 0.24 0.08 0.24 0.00 -1.18 0.00 0.00 61.69 61.07 1srh s THR 115 Cb 0.07 -2.73 0.25 0.00 1.34 0.00 0.00 72.50 71.43 1srh s THR 115 CO 0.03 -0.10 2.00 -0.33 -0.54 0.00 0.00 174.62 175.68 1srh h GLU 116 N -1.56 0.00 0.00 3.99 5.08 -2.01 -2.52 114.58 117.56 1srh h GLU 116 Ca -0.51 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.78 1srh h GLU 116 Cb 1.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 1srh h GLU 116 CO 0.60 0.17 -0.35 0.00 -1.00 0.00 0.00 179.01 178.43 1srh h ALA 117 N 1.83 0.99 -0.39 3.43 0.00 -2.07 -3.09 119.26 119.96 1srh h ALA 117 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1srh h ALA 117 Cb 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1srh h ALA 117 CO 0.02 0.43 0.00 0.09 0.00 0.00 0.00 179.25 179.79 1srh n ASN 118 N -3.49 3.05 -0.18 0.00 3.02 -0.97 -4.65 115.26 112.04 1srh n ASN 118 Ca -0.00 -1.99 0.02 0.00 -0.03 0.00 0.00 54.58 52.58 1srh n ASN 118 Cb 0.50 -0.26 0.29 0.00 -0.61 0.00 0.00 39.78 39.70 1srh n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1srh h ALA 119 N 2.34 1.54 -0.45 5.41 0.00 -1.41 -2.50 119.26 124.19 1srh h ALA 119 Ca 0.00 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1srh h ALA 119 Cb 0.76 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1srh h ALA 119 CO 0.00 0.42 0.31 0.11 0.00 0.00 0.00 179.25 180.09 1srh h TRP 120 N 0.91 0.27 -0.77 0.00 5.08 -1.82 -2.67 115.95 116.94 1srh h TRP 120 Ca 0.26 0.01 -0.55 0.00 1.08 0.00 0.00 58.89 59.69 1srh h TRP 120 Cb -0.06 -0.09 -0.37 0.00 -3.00 0.00 0.00 29.16 25.64 1srh h TRP 120 CO -0.00 0.14 -0.38 0.36 -1.28 0.00 0.00 178.44 177.27 1srh n LYS 121 N -4.46 3.27 0.13 0.12 -0.00 -0.94 -4.70 118.16 111.57 1srh n LYS 121 Ca 0.07 -3.90 0.11 0.00 -0.00 0.00 0.00 58.31 54.59 1srh n LYS 121 Cb 0.33 -2.24 0.04 0.00 -0.00 0.00 0.00 35.03 33.16 1srh n LYS 121 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1srh h SER 122 N 2.05 0.00 -3.27 -5.58 4.64 -1.47 -3.47 113.55 106.45 1srh h SER 122 Ca 0.41 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 61.05 1srh h SER 122 Cb 1.37 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 63.13 1srh h SER 122 CO 0.92 0.04 -0.86 -0.89 -0.87 0.00 0.00 176.83 175.17 1srh s THR 123 N -3.29 2.17 0.08 2.95 2.01 -1.26 -0.48 115.64 117.82 1srh s THR 123 Ca 0.02 -0.96 0.02 0.00 0.31 0.00 0.00 61.69 61.08 1srh s THR 123 Cb 0.08 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 1srh s THR 123 CO 0.76 0.55 0.12 -0.76 -0.69 0.00 0.00 174.62 174.60 1srh s LEU 124 N 0.60 3.99 -0.01 4.42 1.43 0.89 -4.91 118.68 125.08 1srh s LEU 124 Ca -0.12 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.09 1srh s LEU 124 Cb -0.17 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.41 1srh s LEU 124 CO 0.03 0.17 -0.11 0.54 0.23 0.00 0.00 176.35 177.20 1srh s VAL 125 N -1.44 0.91 0.05 -1.59 0.11 -1.26 -0.71 120.40 116.47 1srh s VAL 125 Ca 0.31 -0.48 -0.01 0.00 -2.93 0.00 0.00 61.98 58.87 1srh s VAL 125 Cb -0.12 -0.77 0.01 0.00 -1.53 0.00 0.00 36.38 33.96 1srh s VAL 125 CO 0.24 0.26 0.08 0.61 -3.33 0.00 0.00 175.10 172.96 1srh n GLY 126 N 2.88 2.25 3.01 6.54 0.00 -0.70 -4.99 105.19 114.18 1srh n GLY 126 Ca -0.15 -1.16 -0.12 0.00 0.00 0.00 0.00 46.02 44.59 1srh n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1srh s HIS 127 N -7.07 -0.13 -0.01 1.61 -3.43 -1.26 -0.50 115.29 104.50 1srh s HIS 127 Ca 0.02 0.32 0.03 0.00 -0.80 0.00 0.00 55.06 54.64 1srh s HIS 127 Cb -0.00 0.04 -0.01 0.00 -1.43 0.00 0.00 32.58 31.18 1srh s HIS 127 CO 0.02 -0.07 -0.10 -0.51 -2.00 0.00 0.00 174.74 172.07 1srh s ASP 128 N 0.02 1.18 -0.19 7.38 1.01 -0.45 -4.96 116.67 120.65 1srh s ASP 128 Ca -0.00 -0.19 -0.02 0.00 0.71 0.00 0.00 52.55 53.04 1srh s ASP 128 Cb -0.01 -0.13 -0.00 0.00 1.01 0.00 0.00 42.92 43.79 1srh s ASP 128 CO 0.00 0.12 -0.10 -0.89 0.21 0.00 0.00 175.17 174.51 1srh s THR 129 N -0.27 2.95 -0.15 -1.27 2.01 -1.26 -0.35 115.64 117.31 1srh s THR 129 Ca 0.04 -0.65 -0.06 0.00 0.31 0.00 0.00 61.69 61.33 1srh s THR 129 Cb -0.04 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1srh s THR 129 CO -0.00 0.47 0.07 -0.36 -0.69 0.00 0.00 174.62 174.11 1srh s PHE 130 N 1.24 3.31 0.22 4.92 0.40 0.58 -3.27 117.98 125.37 1srh s PHE 130 Ca 0.03 0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.59 1srh s PHE 130 Cb -0.14 -1.99 -0.05 0.00 0.51 0.00 0.00 43.02 41.35 1srh s PHE 130 CO -0.04 0.36 0.02 0.95 0.70 0.00 0.00 175.22 177.20 1srh s THR 131 N -0.21 0.81 -2.23 0.64 -4.23 0.64 -1.30 115.64 109.75 1srh s THR 131 Ca 0.08 -2.01 0.22 0.00 -1.18 0.00 0.00 61.69 58.81 1srh s THR 131 Cb -0.12 -2.34 0.52 0.00 1.34 0.00 0.00 72.50 71.90 1srh s THR 131 CO 0.01 -0.30 1.67 0.29 -0.54 0.00 0.00 174.62 175.76 1srh n LYS 132 N -0.37 1.49 0.00 3.99 5.02 -1.26 0.13 118.16 127.16 1srh n LYS 132 Ca -0.04 -0.74 0.13 0.00 -2.02 0.00 0.00 58.31 55.64 1srh n LYS 132 Cb 0.64 -1.39 0.41 0.00 -0.02 0.00 0.00 35.03 34.67 1srh n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16