#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rte n GLU 14 N 0.00 -3.48 0.00 0.00 0.28 -1.26 -4.70 120.64 111.48 2rte n GLU 14 Ca 0.00 -1.03 0.00 0.00 -0.16 0.00 0.00 57.16 55.97 2rte n GLU 14 Cb 0.00 -1.21 0.00 0.00 1.43 0.00 0.00 31.44 31.66 2rte n GLU 14 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2rte n ALA 15 N -4.69 0.00 -1.70 -1.84 0.00 -1.26 -4.96 120.51 106.06 2rte n ALA 15 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.99 2rte n ALA 15 Cb 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.82 2rte n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rte n GLY 16 N 0.00 4.78 0.13 0.00 0.00 -1.26 -4.24 105.19 104.60 2rte n GLY 16 Ca 0.00 -2.07 -0.19 0.00 0.00 0.00 0.00 46.02 43.76 2rte n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2rte h ILE 17 N 2.08 1.00 -3.46 -0.61 2.04 -1.96 -3.45 117.51 113.15 2rte h ILE 17 Ca 0.47 -2.63 -0.55 0.00 1.00 0.00 0.00 64.86 63.15 2rte h ILE 17 Cb 0.50 2.72 0.10 0.00 -0.74 0.00 0.00 36.82 39.41 2rte h ILE 17 CO 1.08 0.83 0.67 0.41 0.00 0.00 0.00 178.15 181.13 2rte n THR 18 N -3.50 1.75 -0.58 -0.27 -1.04 -1.26 -4.81 114.28 104.58 2rte n THR 18 Ca -0.21 -0.44 0.00 0.00 -2.04 0.00 0.00 64.05 61.36 2rte n THR 18 Cb 1.06 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 67.80 2rte n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2rte n GLY 19 N 0.99 0.69 3.27 3.41 0.00 -0.46 -5.00 105.19 108.09 2rte n GLY 19 Ca 0.05 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.93 2rte n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rte s THR 20 N -2.44 2.91 0.25 2.61 2.01 -1.26 -1.63 115.64 118.10 2rte s THR 20 Ca 0.00 -0.66 0.12 0.00 0.31 0.00 0.00 61.69 61.45 2rte s THR 20 Cb 0.00 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.18 2rte s THR 20 CO 0.00 0.48 -0.19 0.26 -0.69 0.00 0.00 174.62 174.48 2rte s TRP 21 N 1.18 2.34 0.04 4.92 0.52 0.10 -4.54 118.94 123.50 2rte s TRP 21 Ca 0.02 -0.32 0.03 0.00 0.02 0.00 0.00 56.10 55.84 2rte s TRP 21 Cb -0.14 -1.06 -0.02 0.00 -1.15 0.00 0.00 33.47 31.10 2rte s TRP 21 CO -0.04 0.65 -0.09 0.71 0.02 0.00 0.00 176.95 178.20 2rte s TYR 22 N -2.26 0.81 0.48 -1.98 2.02 0.53 -1.09 117.35 115.86 2rte s TYR 22 Ca 0.28 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.60 2rte s TYR 22 Cb -0.06 -0.48 0.02 0.00 -0.40 0.00 0.00 41.96 41.04 2rte s TYR 22 CO 0.14 -0.03 0.20 0.27 -1.57 0.00 0.00 175.55 174.57 2rte n ASN 23 N 1.77 2.90 0.07 2.29 0.23 -0.94 -1.33 115.26 120.24 2rte n ASN 23 Ca -0.20 -2.85 0.05 0.00 -0.53 0.00 0.00 54.58 51.05 2rte n ASN 23 Cb 0.55 0.13 0.27 0.00 -2.08 0.00 0.00 39.78 38.64 2rte n ASN 23 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2rte n GLN 24 N -1.43 0.06 0.00 -3.83 0.00 -1.22 -1.12 117.38 109.84 2rte n GLN 24 Ca -0.10 0.54 0.11 0.00 0.00 0.00 0.00 57.00 57.55 2rte n GLN 24 Cb 0.57 -1.69 0.01 0.00 0.00 0.00 0.00 30.24 29.13 2rte n GLN 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2rte n LEU 25 N -1.83 0.88 0.00 2.61 4.77 -1.26 -4.95 117.00 117.23 2rte n LEU 25 Ca -0.00 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 2rte n LEU 25 Cb 0.03 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2rte n LEU 25 CO 0.05 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 2rte n GLY 26 N 1.49 0.83 3.85 -0.72 0.00 -0.28 -4.70 105.19 105.67 2rte n GLY 26 Ca 0.05 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 2rte n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rte s SER 27 N -2.15 6.47 -0.14 1.61 0.01 -1.26 -4.55 113.70 113.69 2rte s SER 27 Ca 0.00 1.50 0.00 0.00 1.31 0.00 0.00 55.95 58.76 2rte s SER 27 Cb 0.00 -2.49 -0.01 0.00 0.21 0.00 0.00 66.02 63.73 2rte s SER 27 CO 0.00 -0.69 -0.14 -0.89 0.41 0.00 0.00 173.24 171.93 2rte s THR 28 N -2.83 2.85 -0.26 1.44 2.01 -0.52 -2.22 115.64 116.12 2rte s THR 28 Ca 0.57 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.88 2rte s THR 28 Cb -0.10 -2.20 0.06 0.00 0.01 0.00 0.00 72.50 70.27 2rte s THR 28 CO 0.40 0.52 -0.10 0.12 -0.69 0.00 0.00 174.62 174.86 2rte s PHE 29 N 0.55 3.19 -0.28 4.92 5.36 -0.25 -1.02 117.98 130.45 2rte s PHE 29 Ca -0.09 -2.28 -0.05 0.00 -0.96 0.00 0.00 56.93 53.55 2rte s PHE 29 Cb -0.16 -1.90 0.02 0.00 -0.34 0.00 0.00 43.02 40.64 2rte s PHE 29 CO 0.04 -0.87 0.02 0.42 -1.46 0.00 0.00 175.22 173.37 2rte s ILE 30 N 1.13 3.52 0.10 3.12 1.01 -0.42 -0.72 121.20 128.94 2rte s ILE 30 Ca -0.09 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.77 2rte s ILE 30 Cb -0.20 -2.81 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 2rte s ILE 30 CO -0.05 0.12 -0.11 0.54 0.00 0.00 0.00 174.94 175.44 2rte s VAL 31 N 1.43 1.03 -0.09 2.92 0.11 -0.64 -1.30 120.40 123.85 2rte s VAL 31 Ca 0.01 -1.60 0.02 0.00 -2.93 0.00 0.00 61.98 57.49 2rte s VAL 31 Cb -0.17 -1.34 0.01 0.00 -1.53 0.00 0.00 36.38 33.35 2rte s VAL 31 CO -0.00 -0.49 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.23 2rte s THR 32 N -2.22 1.45 -0.22 5.04 2.01 -0.09 -1.35 115.64 120.26 2rte s THR 32 Ca 0.05 -0.65 -0.08 0.00 0.31 0.00 0.00 61.69 61.32 2rte s THR 32 Cb -0.04 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.12 2rte s THR 32 CO 0.01 0.43 0.08 0.00 -0.69 0.00 0.00 174.62 174.45 2rte s ALA 33 N 0.72 3.32 0.49 7.40 0.00 -1.26 -1.84 121.76 130.59 2rte s ALA 33 Ca -0.13 -0.95 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 2rte s ALA 33 Cb -0.16 -2.06 -0.03 0.00 0.00 0.00 0.00 23.12 20.87 2rte s ALA 33 CO 0.03 -0.19 0.79 0.20 0.00 0.00 0.00 175.76 176.59 2rte s GLY 34 N 1.06 1.51 0.54 0.00 0.00 0.06 -4.94 107.32 105.54 2rte s GLY 34 Ca 0.05 -0.55 0.35 0.00 0.00 0.00 0.00 44.72 44.57 2rte s GLY 34 CO 0.03 -0.37 2.07 0.00 0.00 0.00 0.00 173.10 174.83 2rte h ALA 35 N 0.19 1.00 -0.93 3.20 0.00 -1.99 -3.15 119.26 117.59 2rte h ALA 35 Ca -0.47 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 53.83 2rte h ALA 35 Cb 1.21 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.69 2rte h ALA 35 CO 0.61 0.00 0.52 -3.47 0.00 0.00 0.00 179.25 176.92 2rte n ASP 36 N -2.89 6.55 0.00 0.00 2.03 -1.26 -4.92 116.55 116.06 2rte n ASP 36 Ca -0.01 -3.76 0.00 0.00 0.52 0.00 0.00 54.79 51.54 2rte n ASP 36 Cb 0.17 -0.84 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 2rte n ASP 36 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2rte n GLY 37 N -0.92 0.82 3.90 0.27 0.00 -1.19 -4.97 105.19 103.10 2rte n GLY 37 Ca 0.58 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.30 2rte n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rte s ALA 38 N -3.18 3.69 -0.06 4.61 0.00 -1.26 -1.52 121.76 124.04 2rte s ALA 38 Ca 0.00 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 51.43 2rte s ALA 38 Cb 0.00 -2.24 0.01 0.00 0.00 0.00 0.00 23.12 20.90 2rte s ALA 38 CO 0.00 0.43 -0.11 -0.51 0.00 0.00 0.00 175.76 175.57 2rte s LEU 39 N -3.16 1.60 0.06 0.00 1.43 -0.85 -0.76 118.68 117.01 2rte s LEU 39 Ca 0.43 -0.26 -0.00 0.00 -1.03 0.00 0.00 54.13 53.27 2rte s LEU 39 Cb -0.11 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.33 2rte s LEU 39 CO 0.27 0.02 -0.04 0.42 0.23 0.00 0.00 176.35 177.25 2rte s THR 40 N 0.66 0.35 -5.00 5.49 -4.23 -0.77 -1.72 115.64 110.42 2rte s THR 40 Ca -0.13 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 2rte s THR 40 Cb -0.15 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.27 2rte s THR 40 CO 0.03 -0.90 0.00 0.61 -0.54 0.00 0.00 174.62 173.82 2rte n GLY 41 N 0.24 -0.32 3.10 3.99 0.00 -1.20 -0.91 105.19 110.09 2rte n GLY 41 Ca -0.15 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 2rte n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rte s THR 42 N -3.11 0.63 0.00 2.61 -4.23 -0.42 -2.37 115.64 108.74 2rte s THR 42 Ca 0.00 -1.36 0.04 0.00 -1.18 0.00 0.00 61.69 59.19 2rte s THR 42 Cb 0.00 -0.97 -0.01 0.00 1.34 0.00 0.00 72.50 72.86 2rte s THR 42 CO 0.00 -0.52 -0.12 -0.47 -0.54 0.00 0.00 174.62 172.97 2rte s TYR 43 N -2.06 1.04 -0.09 3.99 6.14 0.09 -1.30 117.35 125.17 2rte s TYR 43 Ca -0.03 -0.23 0.00 0.00 0.64 0.00 0.00 57.07 57.45 2rte s TYR 43 Cb -0.05 -0.66 0.02 0.00 0.42 0.00 0.00 41.96 41.69 2rte s TYR 43 CO -0.01 -0.01 -0.07 -2.00 0.64 0.00 0.00 175.55 174.11 2rte s GLU 44 N -0.48 1.31 -0.06 4.97 2.12 -0.19 -1.41 118.70 124.96 2rte s GLU 44 Ca 0.03 -0.20 -0.12 0.00 0.36 0.00 0.00 54.97 55.05 2rte s GLU 44 Cb -0.05 -1.36 -0.05 0.00 0.26 0.00 0.00 34.13 32.93 2rte s GLU 44 CO -0.00 -0.20 0.30 0.45 -0.54 0.00 0.00 175.26 175.26 2rte s SER 45 N 1.49 6.62 0.00 -1.70 0.15 -1.26 -1.44 113.70 117.55 2rte s SER 45 Ca -0.00 0.74 0.27 0.00 0.70 0.00 0.00 55.95 57.66 2rte s SER 45 Cb -0.13 -2.18 0.91 0.00 -1.71 0.00 0.00 66.02 62.91 2rte s SER 45 CO -0.05 0.34 1.69 0.00 1.20 0.00 0.00 173.24 176.43 2rte n ALA 46 N 2.03 2.90 -2.21 5.45 0.00 -1.26 -4.82 120.51 122.60 2rte n ALA 46 Ca -0.16 -0.22 -0.12 0.00 0.00 0.00 0.00 53.44 52.94 2rte n ALA 46 Cb 0.53 -1.30 -0.10 0.00 0.00 0.00 0.00 19.45 18.58 2rte n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2rte s VAL 47 N -2.97 0.52 0.00 0.00 -7.23 -1.26 -5.03 120.40 104.43 2rte s VAL 47 Ca 0.13 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2rte s VAL 47 Cb 0.18 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 35.06 2rte s VAL 47 CO 0.60 -0.51 0.00 0.61 -0.31 0.00 0.00 175.10 175.50 2rte n GLY 48 N -0.18 -2.50 2.71 2.32 0.00 -1.26 -4.55 105.19 101.72 2rte n GLY 48 Ca -0.07 -1.70 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2rte n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rte n ASN 49 N -0.01 4.07 -3.69 1.61 5.15 -1.26 -4.85 115.26 116.27 2rte n ASN 49 Ca 0.00 -2.83 -0.13 0.00 -0.60 0.00 0.00 54.58 51.02 2rte n ASN 49 Cb 0.00 -1.66 -0.07 0.00 -0.53 0.00 0.00 39.78 37.52 2rte n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2rte s ALA 50 N 3.16 -0.95 -0.24 5.20 0.00 -1.26 -4.64 121.76 123.02 2rte s ALA 50 Ca 0.48 0.34 -0.24 0.00 0.00 0.00 0.00 51.96 52.54 2rte s ALA 50 Cb 0.14 0.25 0.07 0.00 0.00 0.00 0.00 23.12 23.58 2rte s ALA 50 CO -0.09 -0.39 0.67 -1.83 0.00 0.00 0.00 175.76 174.12 2rte s GLU 51 N -2.11 0.80 2.80 0.00 -1.05 -1.26 -4.95 118.70 112.94 2rte s GLU 51 Ca -0.08 0.89 0.00 0.00 -0.15 0.00 0.00 54.97 55.63 2rte s GLU 51 Cb -0.02 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.06 2rte s GLU 51 CO 0.00 -0.11 0.00 0.45 0.95 0.00 0.00 175.26 176.55 2rte n SER 52 N 2.59 -0.84 -4.91 0.83 2.88 -1.26 -4.81 113.62 108.09 2rte n SER 52 Ca -0.14 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.10 2rte n SER 52 Cb 0.55 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.97 2rte n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2rte s ARG 53 N 0.00 3.53 0.06 -1.46 0.52 -1.26 -4.45 118.95 115.88 2rte s ARG 53 Ca 0.00 -0.29 0.04 0.00 -0.52 0.00 0.00 55.73 54.97 2rte s ARG 53 Cb 0.00 -2.91 -0.03 0.00 0.52 0.00 0.00 34.95 32.53 2rte s ARG 53 CO 0.00 0.50 -0.12 0.71 0.02 0.00 0.00 175.30 176.40 2rte s TYR 54 N -1.67 1.07 0.29 -0.53 1.51 -0.50 -4.90 117.35 112.61 2rte s TYR 54 Ca 0.38 -0.44 -0.29 0.00 -1.01 0.00 0.00 57.07 55.71 2rte s TYR 54 Cb -0.12 -0.61 -0.09 0.00 -0.11 0.00 0.00 41.96 41.02 2rte s TYR 54 CO 0.27 0.02 1.02 0.08 -1.11 0.00 0.00 175.55 175.83 2rte s VAL 55 N -1.21 3.81 0.08 0.71 1.01 -1.26 -0.73 120.40 122.80 2rte s VAL 55 Ca -0.03 1.72 0.04 0.00 0.00 0.00 0.00 61.98 63.71 2rte s VAL 55 Cb -0.09 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 2rte s VAL 55 CO 0.02 0.34 -0.11 -1.48 0.00 0.00 0.00 175.10 173.86 2rte s LEU 56 N -1.58 2.34 -0.05 3.92 0.05 -1.00 -4.37 118.68 117.99 2rte s LEU 56 Ca 0.46 -0.70 -0.11 0.00 0.05 0.00 0.00 54.13 53.83 2rte s LEU 56 Cb -0.27 -0.34 0.02 0.00 -2.05 0.00 0.00 46.19 43.55 2rte s LEU 56 CO 0.34 -0.19 0.25 0.28 -0.55 0.00 0.00 176.35 176.48 2rte s THR 57 N -1.87 0.04 0.00 5.48 -1.32 -1.08 -3.24 115.64 113.65 2rte s THR 57 Ca 0.00 -0.33 0.00 0.00 -1.21 0.00 0.00 61.69 60.15 2rte s THR 57 Cb -0.06 -0.47 0.00 0.00 -1.51 0.00 0.00 72.50 70.45 2rte s THR 57 CO 0.01 -0.18 0.00 0.61 -2.21 0.00 0.00 174.62 172.85 2rte n GLY 58 N 2.01 2.00 3.23 6.08 0.00 -0.70 -0.99 105.19 116.82 2rte n GLY 58 Ca -0.18 -0.91 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 2rte n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rte s ARG 59 N -1.14 0.77 0.16 1.61 1.81 -0.77 -2.00 118.95 119.39 2rte s ARG 59 Ca 0.00 -0.53 -0.02 0.00 -1.72 0.00 0.00 55.73 53.46 2rte s ARG 59 Cb 0.00 0.33 -0.04 0.00 -0.45 0.00 0.00 34.95 34.79 2rte s ARG 59 CO 0.00 -0.24 0.12 1.52 -0.68 0.00 0.00 175.30 176.02 2rte s TYR 60 N -2.50 0.90 -0.32 -0.53 1.13 -0.57 -1.77 117.35 113.68 2rte s TYR 60 Ca -0.05 -1.22 -0.27 0.00 -1.41 0.00 0.00 57.07 54.12 2rte s TYR 60 Cb -0.01 -0.44 0.01 0.00 -1.10 0.00 0.00 41.96 40.42 2rte s TYR 60 CO -0.03 -0.60 0.98 0.34 -2.51 0.00 0.00 175.55 173.73 2rte s ASP 61 N -3.08 6.83 0.27 -0.18 3.68 0.02 -4.60 116.67 119.61 2rte s ASP 61 Ca 0.28 0.89 0.26 0.00 2.13 0.00 0.00 52.55 56.11 2rte s ASP 61 Cb 0.07 -2.50 0.81 0.00 -1.45 0.00 0.00 42.92 39.85 2rte s ASP 61 CO 0.05 -0.81 1.75 0.77 0.13 0.00 0.00 175.17 177.07 2rte h SER 62 N 8.15 0.00 -2.10 -0.34 4.64 -1.91 -3.33 113.55 118.66 2rte h SER 62 Ca -0.22 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.52 2rte h SER 62 Cb 1.07 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.76 2rte h SER 62 CO 0.99 0.00 -0.84 0.00 -0.87 0.00 0.00 176.83 176.11 2rte n ALA 63 N -1.84 3.30 -0.64 5.18 0.00 -1.26 -4.78 120.51 120.47 2rte n ALA 63 Ca 0.04 -4.12 -0.31 0.00 0.00 0.00 0.00 53.44 49.06 2rte n ALA 63 Cb 0.40 -0.86 0.18 0.00 0.00 0.00 0.00 19.45 19.17 2rte n ALA 63 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2rte n PRO 64 N 1.06 -1.80 -2.41 0.00 -0.04 -1.25 -4.96 135.00 125.60 2rte n PRO 64 Ca 0.26 -0.51 -0.32 0.00 -0.04 0.00 0.00 63.50 62.89 2rte n PRO 64 Cb 0.47 -1.68 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 2rte n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rte s ALA 65 N -2.21 3.10 -0.53 0.55 0.00 -1.26 -4.92 121.76 116.48 2rte s ALA 65 Ca 0.55 0.12 -0.05 0.00 0.00 0.00 0.00 51.96 52.57 2rte s ALA 65 Cb -0.11 -3.07 -0.05 0.00 0.00 0.00 0.00 23.12 19.89 2rte s ALA 65 CO 0.63 -0.24 3.02 0.25 0.00 0.00 0.00 175.76 179.41 2rte n THR 66 N -1.63 3.58 -4.39 0.00 -2.24 -1.26 -4.63 114.28 103.70 2rte n THR 66 Ca 0.06 -2.65 -0.22 0.00 -2.27 0.00 0.00 64.05 58.97 2rte n THR 66 Cb 0.54 -1.89 -0.07 0.00 -2.10 0.00 0.00 70.33 66.81 2rte n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2rte n ASP 67 N 1.77 0.38 -3.67 3.42 5.75 -1.26 -5.02 116.55 117.93 2rte n ASP 67 Ca 0.52 -3.10 -0.42 0.00 -0.01 0.00 0.00 54.79 51.78 2rte n ASP 67 Cb 0.60 1.27 -0.01 0.00 -1.03 0.00 0.00 41.12 41.95 2rte n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rte n GLY 68 N -0.67 4.20 3.46 6.12 0.00 -1.26 -4.87 105.19 112.17 2rte n GLY 68 Ca 0.00 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.26 2rte n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rte s SER 69 N 3.28 2.50 0.70 1.61 0.01 -1.26 -5.13 113.70 115.40 2rte s SER 69 Ca 0.50 -1.35 -0.06 0.00 1.31 0.00 0.00 55.95 56.35 2rte s SER 69 Cb 0.14 -0.11 0.07 0.00 0.21 0.00 0.00 66.02 66.33 2rte s SER 69 CO -0.07 -0.56 1.00 -0.83 0.41 0.00 0.00 173.24 173.19 2rte s GLY 70 N -3.49 1.71 -0.25 3.44 0.00 -1.26 -4.11 107.32 103.36 2rte s GLY 70 Ca 0.35 -1.03 -0.09 0.00 0.00 0.00 0.00 44.72 43.96 2rte s GLY 70 CO 0.15 -0.61 0.11 -1.59 0.00 0.00 0.00 173.10 171.16 2rte s THR 71 N -3.22 4.78 0.30 0.90 2.01 -0.48 -4.70 115.64 115.23 2rte s THR 71 Ca 0.61 -0.02 -0.28 0.00 0.31 0.00 0.00 61.69 62.31 2rte s THR 71 Cb -0.10 -3.23 -0.09 0.00 0.01 0.00 0.00 72.50 69.08 2rte s THR 71 CO 0.44 0.34 1.03 0.00 -0.69 0.00 0.00 174.62 175.74 2rte s ALA 72 N 1.39 3.31 0.29 7.40 0.00 -1.26 -0.76 121.76 132.11 2rte s ALA 72 Ca 0.06 0.75 -0.20 0.00 0.00 0.00 0.00 51.96 52.57 2rte s ALA 72 Cb -0.15 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.72 2rte s ALA 72 CO 0.05 -0.04 0.70 -0.48 0.00 0.00 0.00 175.76 175.99 2rte s LEU 73 N -1.68 -0.17 0.03 0.00 2.34 -0.81 -0.80 118.68 117.59 2rte s LEU 73 Ca 0.47 -0.70 -0.28 0.00 0.06 0.00 0.00 54.13 53.69 2rte s LEU 73 Cb -0.27 2.63 0.10 0.00 -0.56 0.00 0.00 46.19 48.08 2rte s LEU 73 CO 0.34 -1.36 0.83 -0.83 -1.06 0.00 0.00 176.35 174.28 2rte s GLY 74 N -2.95 -0.50 0.17 -3.48 0.00 -0.73 -1.79 107.32 98.05 2rte s GLY 74 Ca 0.13 0.92 -0.20 0.00 0.00 0.00 0.00 44.72 45.57 2rte s GLY 74 CO 0.08 0.31 0.53 0.66 0.00 0.00 0.00 173.10 174.68 2rte s TRP 75 N -3.22 -0.32 0.07 1.90 -2.14 -0.77 -1.84 118.94 112.61 2rte s TRP 75 Ca 0.04 0.03 0.07 0.00 2.66 0.00 0.00 56.10 58.90 2rte s TRP 75 Cb -0.01 0.45 -0.03 0.00 -3.10 0.00 0.00 33.47 30.78 2rte s TRP 75 CO -0.10 -0.85 -0.18 0.99 -2.66 0.00 0.00 176.95 174.15 2rte s THR 76 N -3.81 1.48 -0.03 0.66 2.01 -0.16 -1.63 115.64 114.16 2rte s THR 76 Ca 0.04 -1.29 0.01 0.00 0.31 0.00 0.00 61.69 60.76 2rte s THR 76 Cb -0.01 -1.34 0.02 0.00 0.01 0.00 0.00 72.50 71.19 2rte s THR 76 CO -0.09 0.01 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.13 2rte s VAL 77 N -1.01 0.39 -0.19 3.82 1.01 -0.92 -2.62 120.40 120.88 2rte s VAL 77 Ca 0.04 -0.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.91 2rte s VAL 77 Cb -0.09 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 2rte s VAL 77 CO 0.03 0.18 -0.01 0.00 0.00 0.00 0.00 175.10 175.29 2rte s ALA 78 N 0.78 3.00 -1.04 5.51 0.00 -1.26 -1.00 121.76 127.75 2rte s ALA 78 Ca -0.09 -0.97 -0.08 0.00 0.00 0.00 0.00 51.96 50.81 2rte s ALA 78 Cb -0.12 -1.72 -0.14 0.00 0.00 0.00 0.00 23.12 21.13 2rte s ALA 78 CO -0.00 -0.11 3.06 0.91 0.00 0.00 0.00 175.76 179.62 2rte n TRP 79 N 4.16 1.55 -4.17 0.00 7.02 -0.59 -4.78 117.44 120.62 2rte n TRP 79 Ca -0.17 -2.46 -0.18 0.00 -1.02 0.00 0.00 57.50 53.66 2rte n TRP 79 Cb 0.52 -2.12 -0.16 0.00 -2.42 0.00 0.00 31.31 27.13 2rte n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2rte s LYS 80 N 1.93 0.67 0.00 -0.99 2.20 -1.26 -0.80 119.74 121.49 2rte s LYS 80 Ca 0.65 -0.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.12 2rte s LYS 80 Cb 0.21 -0.68 0.00 0.00 -1.51 0.00 0.00 37.83 35.85 2rte s LYS 80 CO -0.04 0.00 0.00 0.27 -0.36 0.00 0.00 175.35 175.22 2rte n ASN 81 N 3.62 0.00 0.00 1.43 0.23 0.06 -4.84 115.26 115.76 2rte n ASN 81 Ca -0.21 -0.99 0.10 0.00 -0.53 0.00 0.00 54.58 52.95 2rte n ASN 81 Cb 0.53 0.00 0.58 0.00 -2.08 0.00 0.00 39.78 38.81 2rte n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2rte n ASN 82 N -1.50 0.00 -0.05 0.53 3.02 -1.26 -3.68 115.26 112.32 2rte n ASN 82 Ca 0.00 -1.01 -0.09 0.00 -0.03 0.00 0.00 54.58 53.45 2rte n ASN 82 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 2rte n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2rte n TYR 83 N -0.88 0.00 -3.97 3.10 4.01 -1.26 -5.08 117.16 113.09 2rte n TYR 83 Ca 0.15 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.80 2rte n TYR 83 Cb 0.07 -0.37 -0.08 0.00 -0.31 0.00 0.00 39.34 38.64 2rte n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2rte s ARG 84 N -2.19 0.82 -0.20 -0.72 0.52 -1.24 -5.07 118.95 110.87 2rte s ARG 84 Ca -0.14 -1.11 -0.04 0.00 -0.52 0.00 0.00 55.73 53.92 2rte s ARG 84 Cb 0.05 0.30 0.07 0.00 0.52 0.00 0.00 34.95 35.88 2rte s ARG 84 CO 0.20 -0.24 0.09 1.21 0.02 0.00 0.00 175.30 176.58 2rte s ASN 85 N -2.91 2.67 0.00 0.23 3.84 -1.25 -0.76 114.94 116.76 2rte s ASN 85 Ca 0.09 -0.78 0.24 0.00 0.21 0.00 0.00 52.86 52.62 2rte s ASN 85 Cb 0.06 -0.33 0.38 0.00 -0.55 0.00 0.00 41.25 40.81 2rte s ASN 85 CO -0.08 -0.36 1.37 0.00 -2.79 0.00 0.00 177.10 175.24 2rte n ALA 86 N 5.22 2.46 -3.77 1.71 0.00 0.02 -4.97 120.51 121.19 2rte n ALA 86 Ca -0.07 -0.75 -0.27 0.00 0.00 0.00 0.00 53.44 52.35 2rte n ALA 86 Cb 0.47 -0.88 0.02 0.00 0.00 0.00 0.00 19.45 19.06 2rte n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rte n HIS 87 N 1.22 -1.83 -3.92 0.00 8.25 -1.26 -4.86 115.22 112.81 2rte n HIS 87 Ca 0.16 0.64 -0.08 0.00 -0.26 0.00 0.00 57.72 58.18 2rte n HIS 87 Cb 0.56 -3.75 -0.04 0.00 1.12 0.00 0.00 29.99 27.89 2rte n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2rte s SER 88 N -3.95 -0.18 -0.04 0.41 1.04 -1.26 -1.39 113.70 108.33 2rte s SER 88 Ca 0.22 -0.76 -0.16 0.00 0.48 0.00 0.00 55.95 55.73 2rte s SER 88 Cb -0.08 0.66 0.03 0.00 0.10 0.00 0.00 66.02 66.73 2rte s SER 88 CO 0.86 -1.24 0.35 0.00 0.98 0.00 0.00 173.24 174.19 2rte s ALA 89 N -3.97 -0.90 0.03 5.32 0.00 -0.78 -1.55 121.76 119.92 2rte s ALA 89 Ca 0.17 0.56 0.07 0.00 0.00 0.00 0.00 51.96 52.76 2rte s ALA 89 Cb -0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 2rte s ALA 89 CO 0.08 -0.25 -0.21 0.99 0.00 0.00 0.00 175.76 176.37 2rte s THR 90 N -1.00 1.68 -0.03 0.00 2.01 -0.17 -1.94 115.64 116.19 2rte s THR 90 Ca -0.11 -1.13 0.05 0.00 0.31 0.00 0.00 61.69 60.81 2rte s THR 90 Cb -0.04 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 71.01 2rte s THR 90 CO 0.04 0.28 -0.18 0.42 -0.69 0.00 0.00 174.62 174.49 2rte s THR 91 N -0.72 1.44 -0.10 -0.82 -4.23 -0.65 -2.15 115.64 108.40 2rte s THR 91 Ca 0.08 -0.75 0.03 0.00 -1.18 0.00 0.00 61.69 59.87 2rte s THR 91 Cb -0.09 -1.22 -0.01 0.00 1.34 0.00 0.00 72.50 72.53 2rte s THR 91 CO 0.01 0.41 -0.18 0.26 -0.54 0.00 0.00 174.62 174.58 2rte s TRP 92 N -0.19 2.66 -0.08 3.99 0.51 -0.65 -1.91 118.94 123.28 2rte s TRP 92 Ca 0.01 -0.73 0.02 0.00 -2.12 0.00 0.00 56.10 53.29 2rte s TRP 92 Cb -0.09 -1.74 0.01 0.00 -0.81 0.00 0.00 33.47 30.84 2rte s TRP 92 CO 0.01 -0.24 -0.15 0.45 -0.51 0.00 0.00 176.95 176.51 2rte s SER 93 N 0.15 2.23 0.00 2.95 0.15 -0.77 -1.85 113.70 116.57 2rte s SER 93 Ca -0.10 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2rte s SER 93 Cb -0.16 -1.02 0.00 0.00 -1.71 0.00 0.00 66.02 63.14 2rte s SER 93 CO 0.06 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2rte n GLY 94 N 3.87 1.67 3.14 9.45 0.00 -0.74 -2.31 105.19 120.27 2rte n GLY 94 Ca -0.21 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 2rte n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rte s GLN 95 N 1.59 0.56 -0.13 1.61 -2.07 -1.02 -1.92 119.66 118.27 2rte s GLN 95 Ca 0.00 -0.44 -0.07 0.00 -1.82 0.00 0.00 55.36 53.03 2rte s GLN 95 Cb 0.00 0.23 -0.04 0.00 -1.09 0.00 0.00 33.01 32.11 2rte s GLN 95 CO 0.00 -0.14 0.11 -0.47 -1.32 0.00 0.00 175.29 173.47 2rte s TYR 96 N -1.70 3.49 -0.12 9.60 5.04 0.06 -2.22 117.35 131.49 2rte s TYR 96 Ca -0.12 0.42 -0.00 0.00 -2.44 0.00 0.00 57.07 54.93 2rte s TYR 96 Cb -0.06 -1.95 0.03 0.00 0.35 0.00 0.00 41.96 40.33 2rte s TYR 96 CO 0.00 0.60 -0.07 0.08 -1.34 0.00 0.00 175.55 174.82 2rte s VAL 97 N -0.74 1.05 0.13 3.14 1.01 0.22 -1.38 120.40 123.83 2rte s VAL 97 Ca 0.13 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.77 2rte s VAL 97 Cb -0.12 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.19 2rte s VAL 97 CO 0.03 0.33 0.17 0.61 0.00 0.00 0.00 175.10 176.24 2rte n GLY 98 N 4.93 1.49 0.00 4.51 0.00 -1.26 -0.90 105.19 113.96 2rte n GLY 98 Ca -0.12 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.81 2rte n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rte n GLY 99 N 3.54 0.67 0.11 -0.02 0.00 -1.26 -4.71 105.19 103.53 2rte n GLY 99 Ca 0.03 -2.02 -0.13 0.00 0.00 0.00 0.00 46.02 43.90 2rte n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rte h ALA 100 N 0.00 -0.17 -3.33 4.61 0.00 -2.07 -3.35 119.26 114.94 2rte h ALA 100 Ca 0.00 -0.08 -0.69 0.00 0.00 0.00 0.00 54.91 54.14 2rte h ALA 100 Cb 0.00 0.07 -0.32 0.00 0.00 0.00 0.00 17.79 17.54 2rte h ALA 100 CO 0.00 -0.55 -0.65 -1.83 0.00 0.00 0.00 179.25 176.22 2rte s GLU 101 N -5.80 2.43 0.05 0.00 4.04 -1.26 -5.07 118.70 113.09 2rte s GLU 101 Ca -0.14 -1.32 -0.13 0.00 0.04 0.00 0.00 54.97 53.42 2rte s GLU 101 Cb 0.05 -3.33 -0.06 0.00 0.02 0.00 0.00 34.13 30.80 2rte s GLU 101 CO 0.65 -0.70 0.43 0.00 -1.84 0.00 0.00 175.26 173.79 2rte s ALA 102 N 1.29 3.69 0.03 -0.84 0.00 -1.26 -4.80 121.76 119.86 2rte s ALA 102 Ca -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 51.96 51.68 2rte s ALA 102 Cb -0.20 -2.37 -0.02 0.00 0.00 0.00 0.00 23.12 20.52 2rte s ALA 102 CO -0.00 0.51 -0.02 1.03 0.00 0.00 0.00 175.76 177.27 2rte s ARG 103 N -1.52 0.38 -0.23 0.00 0.52 -0.07 -4.48 118.95 113.55 2rte s ARG 103 Ca 0.29 -0.73 0.01 0.00 -0.52 0.00 0.00 55.73 54.78 2rte s ARG 103 Cb -0.15 0.13 0.06 0.00 0.52 0.00 0.00 34.95 35.51 2rte s ARG 103 CO 0.16 -0.07 -0.06 0.42 0.02 0.00 0.00 175.30 175.78 2rte s ILE 104 N -1.98 1.52 -0.28 1.52 1.01 -1.05 -0.61 121.20 121.32 2rte s ILE 104 Ca -0.11 -1.16 -0.11 0.00 0.00 0.00 0.00 60.65 59.27 2rte s ILE 104 Cb -0.06 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 2rte s ILE 104 CO -0.03 -0.06 0.18 0.20 0.00 0.00 0.00 174.94 175.23 2rte s ASN 105 N 1.41 5.89 0.32 3.58 0.02 -0.94 -1.20 114.94 124.01 2rte s ASN 105 Ca -0.05 -0.09 0.03 0.00 -1.02 0.00 0.00 52.86 51.73 2rte s ASN 105 Cb -0.18 -2.09 -0.06 0.00 0.02 0.00 0.00 41.25 38.94 2rte s ASN 105 CO -0.06 -0.07 0.07 0.42 0.02 0.00 0.00 177.10 177.48 2rte s THR 106 N 1.73 0.99 -0.00 1.60 -4.23 -0.26 -2.44 115.64 113.02 2rte s THR 106 Ca 0.07 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.60 2rte s THR 106 Cb -0.16 -2.72 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 2rte s THR 106 CO 0.10 0.00 -0.07 -1.10 -0.54 0.00 0.00 174.62 173.01 2rte s GLN 107 N -3.91 0.58 0.17 3.99 -0.21 -0.98 -2.09 119.66 117.22 2rte s GLN 107 Ca 0.36 -0.30 0.04 0.00 0.02 0.00 0.00 55.36 55.48 2rte s GLN 107 Cb 0.08 -0.55 -0.05 0.00 1.00 0.00 0.00 33.01 33.50 2rte s GLN 107 CO 0.15 0.15 -0.06 1.67 -2.12 0.00 0.00 175.29 175.08 2rte s TRP 108 N -0.26 1.31 -0.08 0.91 1.48 -0.36 -1.84 118.94 120.10 2rte s TRP 108 Ca 0.02 -0.85 0.01 0.00 -1.06 0.00 0.00 56.10 54.22 2rte s TRP 108 Cb -0.03 -0.71 0.02 0.00 -1.16 0.00 0.00 33.47 31.58 2rte s TRP 108 CO -0.00 -0.01 -0.10 -0.51 -4.06 0.00 0.00 176.95 172.27 2rte s LEU 109 N -3.20 1.45 -0.27 -4.66 1.43 -0.80 -2.18 118.68 110.44 2rte s LEU 109 Ca 0.20 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.01 2rte s LEU 109 Cb 0.04 -0.82 0.04 0.00 0.03 0.00 0.00 46.19 45.49 2rte s LEU 109 CO 0.03 -0.03 -0.05 -0.22 0.23 0.00 0.00 176.35 176.31 2rte s LEU 110 N 1.10 3.56 -0.12 1.79 0.20 -0.19 -1.63 118.68 123.38 2rte s LEU 110 Ca -0.06 -1.18 -0.02 0.00 0.69 0.00 0.00 54.13 53.56 2rte s LEU 110 Cb -0.14 -1.66 -0.03 0.00 -0.43 0.00 0.00 46.19 43.93 2rte s LEU 110 CO -0.01 -0.20 -0.05 -0.89 -0.29 0.00 0.00 176.35 174.90 2rte s THR 111 N 1.24 3.77 0.15 3.68 2.01 -0.82 -1.19 115.64 124.47 2rte s THR 111 Ca -0.04 -0.42 0.06 0.00 0.31 0.00 0.00 61.69 61.59 2rte s THR 111 Cb -0.19 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 2rte s THR 111 CO -0.03 0.53 0.06 -0.44 -0.69 0.00 0.00 174.62 174.05 2rte s SER 112 N -0.03 5.19 -0.02 3.53 0.01 -0.62 -1.86 113.70 119.91 2rte s SER 112 Ca 0.00 -0.21 -0.28 0.00 1.31 0.00 0.00 55.95 56.77 2rte s SER 112 Cb -0.13 -1.27 -0.03 0.00 0.21 0.00 0.00 66.02 64.80 2rte s SER 112 CO 0.03 0.10 0.88 -0.83 0.41 0.00 0.00 173.24 173.83 2rte s GLY 113 N -2.85 2.81 0.43 3.44 0.00 -0.48 -4.88 107.32 105.79 2rte s GLY 113 Ca 0.29 0.39 0.04 0.00 0.00 0.00 0.00 44.72 45.44 2rte s GLY 113 CO 0.21 1.50 0.15 -0.51 0.00 0.00 0.00 173.10 174.44 2rte s THR 114 N 0.90 0.51 0.54 0.90 -4.23 -1.26 -5.03 115.64 107.97 2rte s THR 114 Ca 0.47 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2rte s THR 114 Cb -0.20 -2.28 0.02 0.00 1.34 0.00 0.00 72.50 71.38 2rte s THR 114 CO 0.24 0.00 0.78 0.42 -0.54 0.00 0.00 174.62 175.52 2rte s THR 115 N -3.17 3.10 0.21 3.99 -4.23 -1.26 -4.90 115.64 109.38 2rte s THR 115 Ca 0.22 -0.52 -0.09 0.00 -1.18 0.00 0.00 61.69 60.12 2rte s THR 115 Cb 0.01 -3.18 0.15 0.00 1.34 0.00 0.00 72.50 70.83 2rte s THR 115 CO 0.15 -0.14 1.75 -0.33 -0.54 0.00 0.00 174.62 175.51 2rte h GLU 116 N 0.08 0.44 -0.77 3.99 4.39 -2.01 -1.61 114.58 119.08 2rte h GLU 116 Ca -0.44 -0.03 0.16 0.00 0.34 0.00 0.00 59.36 59.40 2rte h GLU 116 Cb 1.28 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.78 2rte h GLU 116 CO 0.55 0.29 0.52 0.00 -1.16 0.00 0.00 179.01 179.21 2rte h ALA 117 N 1.42 2.16 -0.54 3.43 0.00 -2.06 -1.91 119.26 121.76 2rte h ALA 117 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2rte h ALA 117 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2rte h ALA 117 CO -0.30 -0.38 0.00 0.09 0.00 0.00 0.00 179.25 178.66 2rte n ASN 118 N -4.47 3.44 0.23 0.00 3.02 -0.67 -4.56 115.26 112.24 2rte n ASN 118 Ca 0.15 -1.99 0.11 0.00 -0.03 0.00 0.00 54.58 52.82 2rte n ASN 118 Cb 0.57 -0.36 0.70 0.00 -0.61 0.00 0.00 39.78 40.08 2rte n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rte h ALA 119 N 3.21 1.99 0.00 5.41 0.00 -0.69 -2.23 119.26 126.95 2rte h ALA 119 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2rte h ALA 119 Cb 0.86 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2rte h ALA 119 CO 0.00 -0.10 -0.05 0.11 0.00 0.00 0.00 179.25 179.21 2rte h TRP 120 N 0.00 0.00 -0.62 0.00 5.08 -1.80 -2.88 115.95 115.72 2rte h TRP 120 Ca 0.04 0.00 -0.44 0.00 1.08 0.00 0.00 58.89 59.57 2rte h TRP 120 Cb 0.16 0.00 -0.31 0.00 -3.00 0.00 0.00 29.16 26.02 2rte h TRP 120 CO 0.00 0.05 -0.44 0.36 -1.28 0.00 0.00 178.44 177.13 2rte n LYS 121 N -3.97 2.95 0.13 0.12 2.85 -0.84 -4.73 118.16 114.68 2rte n LYS 121 Ca -0.03 -3.79 0.12 0.00 -1.05 0.00 0.00 58.31 53.56 2rte n LYS 121 Cb 0.13 -2.12 0.06 0.00 -0.65 0.00 0.00 35.03 32.45 2rte n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2rte h SER 122 N 1.82 0.00 -3.18 -5.58 4.64 -1.55 -3.47 113.55 106.23 2rte h SER 122 Ca 0.33 -0.02 -0.67 0.00 -0.47 0.00 0.00 61.79 60.96 2rte h SER 122 Cb 1.39 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.14 2rte h SER 122 CO 0.72 0.01 -0.85 -0.89 -0.87 0.00 0.00 176.83 174.94 2rte s THR 123 N -3.30 2.18 0.06 2.95 2.01 -1.26 -1.58 115.64 116.69 2rte s THR 123 Ca 0.02 -0.93 -0.03 0.00 0.31 0.00 0.00 61.69 61.07 2rte s THR 123 Cb 0.09 -1.89 -0.05 0.00 0.01 0.00 0.00 72.50 70.66 2rte s THR 123 CO 0.75 0.54 0.26 -0.76 -0.69 0.00 0.00 174.62 174.72 2rte s LEU 124 N 0.96 4.34 0.06 4.42 1.43 -0.33 -4.93 118.68 124.63 2rte s LEU 124 Ca -0.03 0.42 0.07 0.00 -1.03 0.00 0.00 54.13 53.55 2rte s LEU 124 Cb -0.15 -2.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.11 2rte s LEU 124 CO -0.05 0.17 -0.19 0.54 0.23 0.00 0.00 176.35 177.06 2rte s VAL 125 N -1.47 1.52 0.12 -1.59 0.11 -1.26 -1.03 120.40 116.80 2rte s VAL 125 Ca 0.34 -1.25 -0.06 0.00 -2.93 0.00 0.00 61.98 58.07 2rte s VAL 125 Cb -0.13 -1.36 0.02 0.00 -1.53 0.00 0.00 36.38 33.39 2rte s VAL 125 CO 0.23 0.06 0.32 0.61 -3.33 0.00 0.00 175.10 172.99 2rte n GLY 126 N 1.62 1.43 3.03 6.54 0.00 -0.93 -4.99 105.19 111.89 2rte n GLY 126 Ca -0.18 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2rte n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2rte s HIS 127 N -5.87 -0.17 0.04 1.61 -3.43 -1.26 -1.22 115.29 104.98 2rte s HIS 127 Ca 0.07 0.43 0.04 0.00 -0.80 0.00 0.00 55.06 54.80 2rte s HIS 127 Cb -0.02 0.05 -0.02 0.00 -1.43 0.00 0.00 32.58 31.16 2rte s HIS 127 CO 0.04 -0.09 -0.13 -0.51 -2.00 0.00 0.00 174.74 172.05 2rte s ASP 128 N 0.19 1.52 -0.11 7.38 1.01 -0.89 -4.97 116.67 120.79 2rte s ASP 128 Ca -0.01 -0.45 0.03 0.00 0.71 0.00 0.00 52.55 52.84 2rte s ASP 128 Cb -0.02 -0.09 0.01 0.00 1.01 0.00 0.00 42.92 43.83 2rte s ASP 128 CO -0.00 0.01 -0.22 -0.89 0.21 0.00 0.00 175.17 174.28 2rte s THR 129 N -0.86 1.94 0.02 -1.27 2.01 -1.26 -1.11 115.64 115.11 2rte s THR 129 Ca 0.00 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.11 2rte s THR 129 Cb -0.08 -1.71 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 2rte s THR 129 CO 0.01 0.53 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.06 2rte s PHE 130 N 0.62 2.92 0.18 4.92 0.40 -0.34 -3.39 117.98 123.29 2rte s PHE 130 Ca -0.13 -0.02 -0.01 0.00 -0.60 0.00 0.00 56.93 56.17 2rte s PHE 130 Cb -0.17 -1.60 -0.04 0.00 0.51 0.00 0.00 43.02 41.73 2rte s PHE 130 CO 0.03 0.41 0.10 0.95 0.70 0.00 0.00 175.22 177.41 2rte s THR 131 N -1.06 0.06 -2.00 0.64 -4.23 -0.44 -2.53 115.64 106.07 2rte s THR 131 Ca 0.19 -1.97 0.18 0.00 -1.18 0.00 0.00 61.69 58.90 2rte s THR 131 Cb -0.11 -2.36 0.51 0.00 1.34 0.00 0.00 72.50 71.88 2rte s THR 131 CO 0.10 -0.15 1.42 0.29 -0.54 0.00 0.00 174.62 175.74 2rte n LYS 132 N -0.22 2.34 0.00 3.99 5.02 -1.26 -0.35 118.16 127.68 2rte n LYS 132 Ca -0.00 -2.08 0.13 0.00 -2.02 0.00 0.00 58.31 54.33 2rte n LYS 132 Cb 0.65 -1.45 0.26 0.00 -0.02 0.00 0.00 35.03 34.47 2rte n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16