#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rtg h GLU 14 N 0.00 0.71 -0.16 0.00 -0.00 -1.90 4.25 114.58 117.48 2rtg h GLU 14 Ca 0.00 -0.06 -0.17 0.00 -0.00 0.00 0.00 59.36 59.13 2rtg h GLU 14 Cb 0.00 -0.15 0.01 0.00 -0.00 0.00 0.00 28.75 28.60 2rtg h GLU 14 CO 0.00 0.50 -0.58 0.00 -0.00 0.00 0.00 179.01 178.94 2rtg h ALA 15 N 1.17 0.28 -0.47 1.06 0.00 -1.92 -2.61 119.26 116.77 2rtg h ALA 15 Ca 0.19 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 2rtg h ALA 15 Cb -0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2rtg h ALA 15 CO -0.04 0.52 0.00 0.78 0.00 0.00 0.00 179.25 180.52 2rtg h GLY 16 N 0.35 0.82 1.18 0.00 0.00 -1.69 -3.16 103.07 100.58 2rtg h GLY 16 Ca -0.03 -0.54 -0.30 0.00 0.00 0.00 0.00 47.33 46.46 2rtg h GLY 16 CO 0.12 0.50 -1.29 -2.22 0.00 0.00 0.00 176.54 173.65 2rtg h ILE 17 N 0.72 1.30 -2.55 2.60 2.04 0.81 -3.45 117.51 118.98 2rtg h ILE 17 Ca 0.14 -2.55 -0.59 0.00 1.00 0.00 0.00 64.86 62.86 2rtg h ILE 17 Cb 0.43 2.88 0.08 0.00 -0.74 0.00 0.00 36.82 39.47 2rtg h ILE 17 CO 0.02 0.77 0.55 0.41 0.00 0.00 0.00 178.15 179.89 2rtg n THR 18 N -3.80 0.96 -1.78 -0.27 -1.04 -0.98 -4.80 114.28 102.56 2rtg n THR 18 Ca -0.15 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 2rtg n THR 18 Cb 1.02 -1.36 0.00 0.00 -1.82 0.00 0.00 70.33 68.16 2rtg n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2rtg n GLY 19 N 2.11 -0.05 3.53 3.41 0.00 -0.71 -4.95 105.19 108.54 2rtg n GLY 19 Ca 0.12 -1.60 -0.34 0.00 0.00 0.00 0.00 46.02 44.20 2rtg n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rtg s THR 20 N -2.47 3.85 0.08 2.61 2.01 -1.26 -1.44 115.64 119.01 2rtg s THR 20 Ca 0.00 -0.39 0.05 0.00 0.31 0.00 0.00 61.69 61.66 2rtg s THR 20 Cb 0.00 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 2rtg s THR 20 CO 0.00 0.53 -0.14 0.26 -0.69 0.00 0.00 174.62 174.58 2rtg s TRP 21 N -0.04 1.27 0.12 4.92 0.52 0.25 -1.23 118.94 124.74 2rtg s TRP 21 Ca 0.01 -0.47 0.05 0.00 0.02 0.00 0.00 56.10 55.71 2rtg s TRP 21 Cb -0.13 -0.70 -0.04 0.00 -1.15 0.00 0.00 33.47 31.45 2rtg s TRP 21 CO 0.03 0.07 -0.13 0.71 0.02 0.00 0.00 176.95 177.65 2rtg s TYR 22 N -1.39 1.30 0.46 -1.98 2.02 -0.39 -1.38 117.35 116.00 2rtg s TYR 22 Ca -0.00 -0.59 0.04 0.00 -0.37 0.00 0.00 57.07 56.14 2rtg s TYR 22 Cb -0.09 -0.68 -0.04 0.00 -0.40 0.00 0.00 41.96 40.74 2rtg s TYR 22 CO 0.02 0.10 0.01 0.54 -1.57 0.00 0.00 175.55 174.66 2rtg s ASN 23 N -2.48 3.96 0.42 2.29 2.20 -1.01 -0.36 114.94 119.95 2rtg s ASN 23 Ca 0.08 -1.54 0.23 0.00 -0.94 0.00 0.00 52.86 50.69 2rtg s ASN 23 Cb -0.04 0.14 1.23 0.00 -2.00 0.00 0.00 41.25 40.58 2rtg s ASN 23 CO 0.02 -0.69 1.66 0.06 -2.94 0.00 0.00 177.10 175.21 2rtg h GLN 24 N 1.55 0.00 0.00 3.55 -0.00 -1.91 -0.10 115.11 118.19 2rtg h GLN 24 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.21 2rtg h GLN 24 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 2rtg h GLN 24 CO 0.76 0.00 -0.78 1.28 -0.00 0.00 0.00 178.83 180.09 2rtg n LEU 25 N -2.38 0.70 0.00 0.06 4.77 -1.26 -4.94 117.00 113.95 2rtg n LEU 25 Ca -0.02 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 2rtg n LEU 25 Cb 0.19 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2rtg n LEU 25 CO 0.10 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.72 2rtg n GLY 26 N 1.32 0.93 3.85 -0.72 0.00 -0.05 -4.75 105.19 105.77 2rtg n GLY 26 Ca 0.02 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2rtg n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rtg s SER 27 N -2.08 6.67 -0.07 1.61 0.01 -1.26 -4.55 113.70 114.03 2rtg s SER 27 Ca 0.00 1.41 0.02 0.00 1.31 0.00 0.00 55.95 58.68 2rtg s SER 27 Cb 0.00 -2.44 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 2rtg s SER 27 CO 0.00 -0.43 -0.10 -0.89 0.41 0.00 0.00 173.24 172.23 2rtg s THR 28 N -2.38 3.46 -0.15 1.44 2.01 0.55 -2.40 115.64 118.17 2rtg s THR 28 Ca 0.56 -0.57 -0.01 0.00 0.31 0.00 0.00 61.69 61.98 2rtg s THR 28 Cb -0.10 -2.40 0.04 0.00 0.01 0.00 0.00 72.50 70.06 2rtg s THR 28 CO 0.26 0.59 -0.01 0.12 -0.69 0.00 0.00 174.62 174.89 2rtg s PHE 29 N -0.71 1.24 -0.20 4.92 5.36 -0.48 -0.66 117.98 127.46 2rtg s PHE 29 Ca 0.11 -0.78 -0.02 0.00 -0.96 0.00 0.00 56.93 55.28 2rtg s PHE 29 Cb -0.11 -1.10 -0.00 0.00 -0.34 0.00 0.00 43.02 41.47 2rtg s PHE 29 CO 0.01 -0.54 -0.09 0.42 -1.46 0.00 0.00 175.22 173.56 2rtg s ILE 30 N 1.79 3.01 0.04 3.12 1.01 -0.56 -0.58 121.20 129.03 2rtg s ILE 30 Ca 0.01 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.03 2rtg s ILE 30 Cb -0.15 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 2rtg s ILE 30 CO -0.07 0.47 -0.02 0.54 0.00 0.00 0.00 174.94 175.86 2rtg s VAL 31 N 1.25 0.19 -0.05 2.92 0.11 -0.52 -1.81 120.40 122.48 2rtg s VAL 31 Ca 0.03 -1.55 0.03 0.00 -2.93 0.00 0.00 61.98 57.55 2rtg s VAL 31 Cb -0.14 -1.20 0.01 0.00 -1.53 0.00 0.00 36.38 33.51 2rtg s VAL 31 CO -0.04 -0.86 -0.13 -0.89 -3.33 0.00 0.00 175.10 169.85 2rtg s THR 32 N -3.30 1.17 -0.19 5.04 2.01 -0.20 -1.74 115.64 118.44 2rtg s THR 32 Ca 0.01 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 2rtg s THR 32 Cb 0.03 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 2rtg s THR 32 CO -0.08 0.35 0.05 0.00 -0.69 0.00 0.00 174.62 174.26 2rtg s ALA 33 N 0.38 3.30 0.18 7.40 0.00 -1.26 -1.62 121.76 130.14 2rtg s ALA 33 Ca -0.09 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.07 2rtg s ALA 33 Cb -0.13 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.06 2rtg s ALA 33 CO 0.03 0.07 0.32 0.20 0.00 0.00 0.00 175.76 176.38 2rtg s GLY 34 N 0.58 1.59 0.54 0.00 0.00 0.11 -4.80 107.32 105.34 2rtg s GLY 34 Ca 0.02 -1.05 0.30 0.00 0.00 0.00 0.00 44.72 43.99 2rtg s GLY 34 CO 0.01 -1.05 1.92 0.00 0.00 0.00 0.00 173.10 173.98 2rtg h ALA 35 N 1.85 2.65 -0.02 3.20 0.00 -1.98 0.19 119.26 125.15 2rtg h ALA 35 Ca -0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2rtg h ALA 35 Cb 1.20 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2rtg h ALA 35 CO 0.66 -0.93 0.00 -0.40 0.00 0.00 0.00 179.25 178.58 2rtg n ASP 36 N -4.20 0.22 0.00 0.00 5.68 -1.26 -4.86 116.55 112.13 2rtg n ASP 36 Ca 0.15 -1.47 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 2rtg n ASP 36 Cb 0.83 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.79 2rtg n ASP 36 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rtg n GLY 37 N 0.83 0.79 3.89 6.12 0.00 0.05 -4.96 105.19 111.91 2rtg n GLY 37 Ca 0.14 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2rtg n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rtg s ALA 38 N -2.00 3.66 -0.05 4.61 0.00 -1.21 -1.38 121.76 125.39 2rtg s ALA 38 Ca 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2rtg s ALA 38 Cb 0.00 -2.29 0.01 0.00 0.00 0.00 0.00 23.12 20.85 2rtg s ALA 38 CO 0.00 0.45 -0.08 -0.51 0.00 0.00 0.00 175.76 175.62 2rtg s LEU 39 N -3.06 1.55 0.02 0.00 1.43 -0.51 0.03 118.68 118.15 2rtg s LEU 39 Ca 0.44 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 2rtg s LEU 39 Cb -0.11 -0.60 -0.02 0.00 0.03 0.00 0.00 46.19 45.49 2rtg s LEU 39 CO 0.25 0.01 -0.03 0.28 0.23 0.00 0.00 176.35 177.09 2rtg s THR 40 N 0.65 0.13 -2.01 5.49 -1.32 -0.64 -1.10 115.64 116.84 2rtg s THR 40 Ca -0.11 -0.97 0.00 0.00 -1.21 0.00 0.00 61.69 59.40 2rtg s THR 40 Cb -0.14 -0.35 0.00 0.00 -1.51 0.00 0.00 72.50 70.51 2rtg s THR 40 CO 0.01 -0.53 0.00 0.61 -2.21 0.00 0.00 174.62 172.51 2rtg n GLY 41 N 1.50 -0.53 3.13 6.08 0.00 -0.80 -1.03 105.19 113.54 2rtg n GLY 41 Ca -0.23 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 2rtg n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rtg s THR 42 N -3.01 0.75 0.01 2.61 -4.23 -0.75 -1.13 115.64 109.88 2rtg s THR 42 Ca 0.00 -1.44 0.04 0.00 -1.18 0.00 0.00 61.69 59.11 2rtg s THR 42 Cb 0.00 -1.09 -0.01 0.00 1.34 0.00 0.00 72.50 72.74 2rtg s THR 42 CO 0.00 -0.51 -0.11 -0.47 -0.54 0.00 0.00 174.62 172.98 2rtg s TYR 43 N -2.12 1.00 -0.13 3.99 6.14 0.04 -1.50 117.35 124.77 2rtg s TYR 43 Ca -0.00 -0.23 -0.01 0.00 0.64 0.00 0.00 57.07 57.47 2rtg s TYR 43 Cb -0.05 -0.63 0.03 0.00 0.42 0.00 0.00 41.96 41.73 2rtg s TYR 43 CO -0.01 -0.01 -0.06 -2.00 0.64 0.00 0.00 175.55 174.11 2rtg s GLU 44 N -0.52 1.44 -0.08 4.97 2.12 0.17 -1.32 118.70 125.47 2rtg s GLU 44 Ca 0.03 -0.30 -0.11 0.00 0.36 0.00 0.00 54.97 54.95 2rtg s GLU 44 Cb -0.05 -1.67 -0.05 0.00 0.26 0.00 0.00 34.13 32.62 2rtg s GLU 44 CO 0.00 -0.32 0.26 0.45 -0.54 0.00 0.00 175.26 175.11 2rtg s SER 45 N 1.71 6.54 0.19 -1.70 0.15 -1.26 -0.33 113.70 119.00 2rtg s SER 45 Ca 0.04 0.65 0.26 0.00 0.70 0.00 0.00 55.95 57.59 2rtg s SER 45 Cb -0.13 -2.15 0.68 0.00 -1.71 0.00 0.00 66.02 62.70 2rtg s SER 45 CO -0.08 0.34 1.65 0.00 1.20 0.00 0.00 173.24 176.35 2rtg n ALA 46 N 2.15 2.46 -2.36 5.45 0.00 -1.26 -4.86 120.51 122.09 2rtg n ALA 46 Ca -0.17 -0.08 -0.18 0.00 0.00 0.00 0.00 53.44 53.01 2rtg n ALA 46 Cb 0.54 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.49 2rtg n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2rtg s VAL 47 N -3.12 0.95 0.00 0.00 -7.23 -1.26 -5.02 120.40 104.72 2rtg s VAL 47 Ca 0.09 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 2rtg s VAL 47 Cb 0.12 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.50 2rtg s VAL 47 CO 0.63 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.89 2rtg n GLY 48 N -0.51 -2.75 3.23 2.32 0.00 -1.26 -4.55 105.19 101.66 2rtg n GLY 48 Ca -0.03 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 2rtg n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rtg n ASN 49 N -0.13 5.20 -3.74 1.61 5.15 -1.26 -4.87 115.26 117.22 2rtg n ASN 49 Ca 0.00 -3.04 -0.14 0.00 -0.60 0.00 0.00 54.58 50.81 2rtg n ASN 49 Cb 0.00 -1.53 -0.09 0.00 -0.53 0.00 0.00 39.78 37.64 2rtg n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2rtg s ALA 50 N 1.00 -0.88 -0.21 5.20 0.00 -1.26 -4.57 121.76 121.03 2rtg s ALA 50 Ca 0.41 0.47 -0.16 0.00 0.00 0.00 0.00 51.96 52.68 2rtg s ALA 50 Cb 0.02 0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.22 2rtg s ALA 50 CO 0.00 -0.26 0.54 -1.83 0.00 0.00 0.00 175.76 174.21 2rtg s GLU 51 N -1.20 0.59 1.85 0.00 -1.05 -1.26 -4.98 118.70 112.64 2rtg s GLU 51 Ca -0.12 0.86 0.00 0.00 -0.15 0.00 0.00 54.97 55.56 2rtg s GLU 51 Cb -0.05 0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.83 2rtg s GLU 51 CO 0.04 -0.11 0.00 0.45 0.95 0.00 0.00 175.26 176.59 2rtg n SER 52 N 3.49 -1.40 -4.91 0.83 2.88 -1.26 -4.77 113.62 108.48 2rtg n SER 52 Ca -0.17 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.08 2rtg n SER 52 Cb 0.57 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.00 2rtg n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2rtg s ARG 53 N 0.00 3.62 0.05 -1.46 0.52 -1.26 -4.57 118.95 115.84 2rtg s ARG 53 Ca 0.00 -0.00 0.04 0.00 -0.52 0.00 0.00 55.73 55.25 2rtg s ARG 53 Cb 0.00 -2.63 -0.02 0.00 0.52 0.00 0.00 34.95 32.82 2rtg s ARG 53 CO 0.00 0.18 -0.12 0.71 0.02 0.00 0.00 175.30 176.09 2rtg s TYR 54 N -2.14 1.08 0.36 -0.53 1.51 -0.43 -4.87 117.35 112.32 2rtg s TYR 54 Ca 0.44 -0.39 -0.25 0.00 -1.01 0.00 0.00 57.07 55.85 2rtg s TYR 54 Cb -0.11 -0.63 -0.09 0.00 -0.11 0.00 0.00 41.96 41.02 2rtg s TYR 54 CO 0.31 0.02 1.03 0.08 -1.11 0.00 0.00 175.55 175.88 2rtg s VAL 55 N -1.02 3.83 0.05 0.71 1.01 -1.26 -0.78 120.40 122.94 2rtg s VAL 55 Ca -0.01 1.50 0.04 0.00 0.00 0.00 0.00 61.98 63.50 2rtg s VAL 55 Cb -0.08 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 2rtg s VAL 55 CO 0.01 0.10 -0.11 -1.48 0.00 0.00 0.00 175.10 173.63 2rtg s LEU 56 N -2.28 2.25 -0.00 3.92 0.05 -0.28 -4.43 118.68 117.90 2rtg s LEU 56 Ca 0.53 -0.56 -0.05 0.00 0.05 0.00 0.00 54.13 54.11 2rtg s LEU 56 Cb -0.22 -0.33 -0.00 0.00 -2.05 0.00 0.00 46.19 43.58 2rtg s LEU 56 CO 0.28 -0.13 0.09 0.28 -0.55 0.00 0.00 176.35 176.32 2rtg s THR 57 N -1.28 0.07 0.00 5.48 -1.32 -1.09 -1.91 115.64 115.59 2rtg s THR 57 Ca -0.06 -0.58 0.00 0.00 -1.21 0.00 0.00 61.69 59.84 2rtg s THR 57 Cb -0.10 -0.32 0.00 0.00 -1.51 0.00 0.00 72.50 70.57 2rtg s THR 57 CO 0.01 -0.32 0.00 0.61 -2.21 0.00 0.00 174.62 172.71 2rtg n GLY 58 N 1.87 1.44 3.16 6.08 0.00 -0.26 -1.13 105.19 116.35 2rtg n GLY 58 Ca -0.21 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 44.81 2rtg n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rtg s ARG 59 N -1.86 0.76 0.25 1.61 1.81 -0.86 -1.42 118.95 119.23 2rtg s ARG 59 Ca 0.00 -1.09 -0.08 0.00 -1.72 0.00 0.00 55.73 52.84 2rtg s ARG 59 Cb 0.00 0.29 -0.01 0.00 -0.45 0.00 0.00 34.95 34.77 2rtg s ARG 59 CO 0.00 -0.21 0.38 1.52 -0.68 0.00 0.00 175.30 176.31 2rtg s TYR 60 N -3.90 0.68 -0.60 -0.53 1.13 -0.48 -2.09 117.35 111.56 2rtg s TYR 60 Ca 0.07 -0.98 -0.22 0.00 -1.41 0.00 0.00 57.07 54.53 2rtg s TYR 60 Cb 0.06 -0.06 0.06 0.00 -1.10 0.00 0.00 41.96 40.93 2rtg s TYR 60 CO -0.10 -0.91 0.88 0.34 -2.51 0.00 0.00 175.55 173.25 2rtg s ASP 61 N -3.09 6.22 0.36 -0.18 3.68 -0.75 -4.68 116.67 118.24 2rtg s ASP 61 Ca 0.28 -0.86 0.04 0.00 2.13 0.00 0.00 52.55 54.13 2rtg s ASP 61 Cb 0.02 -2.39 0.68 0.00 -1.45 0.00 0.00 42.92 39.77 2rtg s ASP 61 CO 0.11 -1.27 2.00 0.77 0.13 0.00 0.00 175.17 176.92 2rtg h SER 62 N 9.38 0.64 -3.34 -0.34 4.64 -1.91 -3.26 113.55 119.36 2rtg h SER 62 Ca -0.28 -0.03 -0.69 0.00 -0.47 0.00 0.00 61.79 60.32 2rtg h SER 62 Cb 1.08 -0.16 -0.36 0.00 -0.31 0.00 0.00 62.40 62.64 2rtg h SER 62 CO 1.12 0.49 -0.17 0.00 -0.87 0.00 0.00 176.83 177.40 2rtg s ALA 63 N -5.57 4.16 0.89 5.18 0.00 -1.26 -4.58 121.76 120.58 2rtg s ALA 63 Ca -0.09 -3.82 0.00 0.00 0.00 0.00 0.00 51.96 48.05 2rtg s ALA 63 Cb 0.17 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.57 2rtg s ALA 63 CO 0.76 -2.14 0.00 -0.35 0.00 0.00 0.00 175.76 174.03 2rtg n PRO 64 N 2.33 1.30 -4.13 0.00 -0.04 -1.23 -5.03 135.00 128.19 2rtg n PRO 64 Ca 0.21 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.37 2rtg n PRO 64 Cb 0.37 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.75 2rtg n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rtg s ALA 65 N -2.11 3.34 -1.29 0.55 0.00 -1.26 -5.02 121.76 115.97 2rtg s ALA 65 Ca 0.00 -1.15 -0.14 0.00 0.00 0.00 0.00 51.96 50.66 2rtg s ALA 65 Cb 0.00 -1.21 0.12 0.00 0.00 0.00 0.00 23.12 22.03 2rtg s ALA 65 CO 0.00 0.65 1.73 0.25 0.00 0.00 0.00 175.76 178.39 2rtg n THR 66 N 0.35 4.06 -3.21 0.00 -2.24 -1.26 -4.72 114.28 107.25 2rtg n THR 66 Ca -0.10 -4.22 -0.02 0.00 -2.27 0.00 0.00 64.05 57.44 2rtg n THR 66 Cb 0.53 -2.43 0.01 0.00 -2.10 0.00 0.00 70.33 66.33 2rtg n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2rtg n ASP 67 N 6.26 -0.51 -3.23 3.42 5.68 -1.26 -5.01 116.55 121.89 2rtg n ASP 67 Ca 0.43 -1.35 -0.37 0.00 -0.50 0.00 0.00 54.79 53.01 2rtg n ASP 67 Cb 0.42 0.85 -0.02 0.00 -1.14 0.00 0.00 41.12 41.24 2rtg n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rtg n GLY 68 N -0.13 5.05 3.77 6.12 0.00 -1.26 -4.90 105.19 113.85 2rtg n GLY 68 Ca -0.02 -2.05 -0.22 0.00 0.00 0.00 0.00 46.02 43.73 2rtg n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rtg s SER 69 N 0.25 5.22 0.59 1.61 0.01 -1.26 -5.12 113.70 115.01 2rtg s SER 69 Ca 0.54 -0.37 -0.03 0.00 1.31 0.00 0.00 55.95 57.40 2rtg s SER 69 Cb 0.24 -1.23 0.03 0.00 0.21 0.00 0.00 66.02 65.27 2rtg s SER 69 CO -0.13 -0.03 0.86 -0.83 0.41 0.00 0.00 173.24 173.52 2rtg s GLY 70 N -3.79 1.70 -0.29 3.44 0.00 -1.26 -4.92 107.32 102.19 2rtg s GLY 70 Ca 0.32 -1.03 -0.10 0.00 0.00 0.00 0.00 44.72 43.91 2rtg s GLY 70 CO 0.23 -0.72 0.17 -1.59 0.00 0.00 0.00 173.10 171.19 2rtg s THR 71 N -2.93 5.01 0.41 0.90 2.01 0.21 -4.82 115.64 116.44 2rtg s THR 71 Ca 0.56 -0.06 -0.23 0.00 0.31 0.00 0.00 61.69 62.27 2rtg s THR 71 Cb -0.10 -3.44 -0.09 0.00 0.01 0.00 0.00 72.50 68.87 2rtg s THR 71 CO 0.42 0.19 1.03 0.00 -0.69 0.00 0.00 174.62 175.56 2rtg s ALA 72 N 1.70 3.05 0.30 7.40 0.00 -1.26 -0.78 121.76 132.17 2rtg s ALA 72 Ca 0.06 0.63 -0.20 0.00 0.00 0.00 0.00 51.96 52.46 2rtg s ALA 72 Cb -0.16 -3.25 0.04 0.00 0.00 0.00 0.00 23.12 19.75 2rtg s ALA 72 CO 0.09 -0.15 0.77 -0.48 0.00 0.00 0.00 175.76 175.98 2rtg s LEU 73 N -2.81 -0.17 -0.02 0.00 2.34 -0.85 -1.81 118.68 115.36 2rtg s LEU 73 Ca 0.59 -0.76 -0.29 0.00 0.06 0.00 0.00 54.13 53.74 2rtg s LEU 73 Cb -0.19 2.71 0.10 0.00 -0.56 0.00 0.00 46.19 48.25 2rtg s LEU 73 CO 0.24 -1.41 0.88 -0.83 -1.06 0.00 0.00 176.35 174.17 2rtg s GLY 74 N -2.98 -0.45 0.18 -3.48 0.00 -0.89 -2.09 107.32 97.61 2rtg s GLY 74 Ca 0.13 1.13 -0.18 0.00 0.00 0.00 0.00 44.72 45.80 2rtg s GLY 74 CO 0.08 0.43 0.51 0.66 0.00 0.00 0.00 173.10 174.78 2rtg s TRP 75 N -2.84 -0.19 0.06 1.90 -2.14 -0.84 -2.03 118.94 112.86 2rtg s TRP 75 Ca 0.04 -0.13 0.06 0.00 2.66 0.00 0.00 56.10 58.72 2rtg s TRP 75 Cb -0.01 0.38 -0.03 0.00 -3.10 0.00 0.00 33.47 30.72 2rtg s TRP 75 CO -0.07 -0.86 -0.17 0.99 -2.66 0.00 0.00 176.95 174.18 2rtg s THR 76 N -3.84 1.36 -0.05 0.66 2.01 -0.29 -1.34 115.64 114.15 2rtg s THR 76 Ca 0.07 -1.22 -0.00 0.00 0.31 0.00 0.00 61.69 60.85 2rtg s THR 76 Cb -0.00 -1.23 0.03 0.00 0.01 0.00 0.00 72.50 71.30 2rtg s THR 76 CO -0.06 -0.01 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.16 2rtg s VAL 77 N -0.99 0.31 -0.21 3.82 1.01 -0.77 -2.68 120.40 120.90 2rtg s VAL 77 Ca 0.03 0.08 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 2rtg s VAL 77 Cb -0.09 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 2rtg s VAL 77 CO 0.02 0.21 0.11 0.00 0.00 0.00 0.00 175.10 175.44 2rtg s ALA 78 N 1.46 3.52 -1.50 5.51 0.00 -1.26 -0.79 121.76 128.71 2rtg s ALA 78 Ca -0.03 -0.79 -0.09 0.00 0.00 0.00 0.00 51.96 51.05 2rtg s ALA 78 Cb -0.13 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 20.89 2rtg s ALA 78 CO -0.03 0.04 2.64 0.91 0.00 0.00 0.00 175.76 179.33 2rtg n TRP 79 N 3.79 2.64 -4.06 0.00 7.02 -0.16 -4.80 117.44 121.87 2rtg n TRP 79 Ca -0.16 -2.99 -0.18 0.00 -1.02 0.00 0.00 57.50 53.15 2rtg n TRP 79 Cb 0.52 -2.28 -0.16 0.00 -2.42 0.00 0.00 31.31 26.97 2rtg n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2rtg s LYS 80 N 1.22 0.57 0.00 -0.99 2.20 -1.26 -0.66 119.74 120.82 2rtg s LYS 80 Ca 0.61 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.18 2rtg s LYS 80 Cb 0.17 -0.64 0.00 0.00 -1.51 0.00 0.00 37.83 35.85 2rtg s LYS 80 CO -0.07 -0.09 0.00 0.27 -0.36 0.00 0.00 175.35 175.10 2rtg n ASN 81 N 4.00 0.00 0.04 1.43 0.23 0.02 -4.81 115.26 116.17 2rtg n ASN 81 Ca -0.26 -0.94 0.09 0.00 -0.53 0.00 0.00 54.58 52.94 2rtg n ASN 81 Cb 0.51 0.00 0.39 0.00 -2.08 0.00 0.00 39.78 38.60 2rtg n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2rtg n ASN 82 N -2.05 0.24 -0.07 0.53 5.03 -1.26 -3.51 115.26 114.17 2rtg n ASN 82 Ca 0.00 0.55 -0.07 0.00 0.87 0.00 0.00 54.58 55.93 2rtg n ASN 82 Cb 0.00 -0.60 -0.09 0.00 -1.02 0.00 0.00 39.78 38.06 2rtg n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2rtg n TYR 83 N -1.75 0.00 -3.93 3.10 4.01 -1.26 -5.05 117.16 112.28 2rtg n TYR 83 Ca 0.03 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.68 2rtg n TYR 83 Cb 0.21 -0.62 -0.10 0.00 -0.31 0.00 0.00 39.34 38.52 2rtg n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2rtg s ARG 84 N -2.31 0.51 -0.27 -0.72 0.52 -1.23 -5.06 118.95 110.39 2rtg s ARG 84 Ca -0.09 -0.65 -0.02 0.00 -0.52 0.00 0.00 55.73 54.44 2rtg s ARG 84 Cb 0.04 0.20 0.09 0.00 0.52 0.00 0.00 34.95 35.80 2rtg s ARG 84 CO 0.49 -0.12 0.09 1.21 0.02 0.00 0.00 175.30 176.99 2rtg s ASN 85 N -1.84 3.57 0.00 0.23 3.84 -1.26 -0.80 114.94 118.68 2rtg s ASN 85 Ca -0.09 -1.31 0.25 0.00 0.21 0.00 0.00 52.86 51.92 2rtg s ASN 85 Cb -0.04 -0.65 0.53 0.00 -0.55 0.00 0.00 41.25 40.54 2rtg s ASN 85 CO -0.02 -0.39 1.43 0.00 -2.79 0.00 0.00 177.10 175.33 2rtg n ALA 86 N 5.01 3.02 -3.68 1.71 0.00 0.16 -4.96 120.51 121.77 2rtg n ALA 86 Ca -0.05 -0.52 -0.23 0.00 0.00 0.00 0.00 53.44 52.64 2rtg n ALA 86 Cb 0.44 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.92 2rtg n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rtg n HIS 87 N -0.03 -1.93 -3.87 0.00 -0.00 -1.26 -4.85 115.22 103.28 2rtg n HIS 87 Ca 0.13 0.75 -0.09 0.00 -0.00 0.00 0.00 57.72 58.51 2rtg n HIS 87 Cb 0.42 -4.10 -0.05 0.00 -0.00 0.00 0.00 29.99 26.26 2rtg n HIS 87 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2rtg s SER 88 N -4.09 -0.14 -0.05 0.41 1.04 -1.26 -1.20 113.70 108.41 2rtg s SER 88 Ca 0.14 -0.71 -0.13 0.00 0.48 0.00 0.00 55.95 55.74 2rtg s SER 88 Cb -0.04 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.66 2rtg s SER 88 CO 0.82 -1.05 0.29 0.00 0.98 0.00 0.00 173.24 174.28 2rtg s ALA 89 N -3.94 -0.74 0.00 5.32 0.00 -0.30 -0.99 121.76 121.12 2rtg s ALA 89 Ca 0.15 0.49 0.07 0.00 0.00 0.00 0.00 51.96 52.67 2rtg s ALA 89 Cb -0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 2rtg s ALA 89 CO 0.02 -0.21 -0.22 0.99 0.00 0.00 0.00 175.76 176.34 2rtg s THR 90 N -0.78 1.71 -0.02 0.00 2.01 0.03 -1.05 115.64 117.55 2rtg s THR 90 Ca -0.09 -1.01 0.06 0.00 0.31 0.00 0.00 61.69 60.96 2rtg s THR 90 Cb -0.04 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 71.01 2rtg s THR 90 CO 0.03 0.41 -0.19 0.42 -0.69 0.00 0.00 174.62 174.59 2rtg s THR 91 N -0.59 1.54 -0.11 -0.82 -4.23 -0.05 -1.85 115.64 109.54 2rtg s THR 91 Ca 0.08 -0.83 0.01 0.00 -1.18 0.00 0.00 61.69 59.77 2rtg s THR 91 Cb -0.08 -1.29 -0.01 0.00 1.34 0.00 0.00 72.50 72.46 2rtg s THR 91 CO -0.00 0.44 -0.15 0.26 -0.54 0.00 0.00 174.62 174.62 2rtg s TRP 92 N -0.41 2.74 -0.08 3.99 0.51 -0.45 -1.40 118.94 123.84 2rtg s TRP 92 Ca 0.06 -0.65 0.03 0.00 -2.12 0.00 0.00 56.10 53.42 2rtg s TRP 92 Cb -0.08 -1.78 0.01 0.00 -0.81 0.00 0.00 33.47 30.81 2rtg s TRP 92 CO -0.00 -0.19 -0.15 0.45 -0.51 0.00 0.00 176.95 176.54 2rtg s SER 93 N 0.19 2.15 0.00 2.95 0.15 -0.14 -1.98 113.70 117.02 2rtg s SER 93 Ca -0.09 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.19 2rtg s SER 93 Cb -0.15 -0.99 0.00 0.00 -1.71 0.00 0.00 66.02 63.17 2rtg s SER 93 CO 0.05 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2rtg n GLY 94 N 3.80 1.75 2.99 9.45 0.00 -0.89 -1.26 105.19 121.02 2rtg n GLY 94 Ca -0.21 -0.64 -0.11 0.00 0.00 0.00 0.00 46.02 45.06 2rtg n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rtg s GLN 95 N 1.09 0.33 -0.15 1.61 -0.21 -0.57 -2.01 119.66 119.74 2rtg s GLN 95 Ca 0.00 -0.56 -0.07 0.00 0.02 0.00 0.00 55.36 54.75 2rtg s GLN 95 Cb 0.00 -0.02 -0.04 0.00 1.00 0.00 0.00 33.01 33.95 2rtg s GLN 95 CO 0.00 -0.01 0.11 -0.47 -2.12 0.00 0.00 175.29 172.79 2rtg s TYR 96 N -1.22 3.42 -0.14 0.91 5.04 0.04 -1.59 117.35 123.81 2rtg s TYR 96 Ca -0.12 0.33 -0.00 0.00 -2.44 0.00 0.00 57.07 54.84 2rtg s TYR 96 Cb -0.09 -2.02 0.03 0.00 0.35 0.00 0.00 41.96 40.23 2rtg s TYR 96 CO -0.01 0.45 -0.07 0.08 -1.34 0.00 0.00 175.55 174.66 2rtg s VAL 97 N -0.28 1.12 0.00 3.14 1.01 -0.31 -0.62 120.40 124.46 2rtg s VAL 97 Ca 0.10 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.63 2rtg s VAL 97 Cb -0.12 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 35.08 2rtg s VAL 97 CO 0.01 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.01 2rtg n GLY 98 N 4.90 1.03 0.00 4.51 0.00 -1.26 -0.59 105.19 113.77 2rtg n GLY 98 Ca -0.13 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 43.95 2rtg n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rtg n GLY 99 N 5.00 0.59 0.16 -0.02 0.00 -1.26 -4.52 105.19 105.14 2rtg n GLY 99 Ca 0.00 -2.15 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 2rtg n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rtg h ALA 100 N 0.00 0.42 -3.09 4.61 0.00 -2.06 -3.31 119.26 115.83 2rtg h ALA 100 Ca 0.00 -0.12 -0.70 0.00 0.00 0.00 0.00 54.91 54.09 2rtg h ALA 100 Cb 0.00 -0.13 -0.34 0.00 0.00 0.00 0.00 17.79 17.32 2rtg h ALA 100 CO 0.00 0.01 -0.41 -1.21 0.00 0.00 0.00 179.25 177.64 2rtg s GLU 101 N -5.62 2.42 0.18 0.00 2.02 -1.26 -5.06 118.70 111.37 2rtg s GLU 101 Ca -0.13 -2.22 -0.16 0.00 0.02 0.00 0.00 54.97 52.48 2rtg s GLU 101 Cb 0.09 -3.74 -0.07 0.00 0.10 0.00 0.00 34.13 30.51 2rtg s GLU 101 CO 0.73 -1.15 0.61 0.00 0.02 0.00 0.00 175.26 175.48 2rtg s ALA 102 N 0.48 3.52 0.05 5.21 0.00 -1.25 -4.83 121.76 124.94 2rtg s ALA 102 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.05 2rtg s ALA 102 Cb -0.21 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 2rtg s ALA 102 CO -0.04 0.41 -0.03 1.03 0.00 0.00 0.00 175.76 177.13 2rtg s ARG 103 N -1.98 0.59 -0.13 0.00 1.81 0.24 -3.52 118.95 115.97 2rtg s ARG 103 Ca 0.40 -1.18 -0.01 0.00 -1.72 0.00 0.00 55.73 53.22 2rtg s ARG 103 Cb -0.15 0.20 0.03 0.00 -0.45 0.00 0.00 34.95 34.58 2rtg s ARG 103 CO 0.20 -0.11 -0.05 0.42 -0.68 0.00 0.00 175.30 175.08 2rtg s ILE 104 N -3.77 0.94 -0.22 1.52 1.01 -0.96 -1.16 121.20 118.56 2rtg s ILE 104 Ca 0.06 -0.34 -0.06 0.00 0.00 0.00 0.00 60.65 60.30 2rtg s ILE 104 Cb 0.07 -1.04 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 2rtg s ILE 104 CO -0.09 0.26 0.04 0.20 0.00 0.00 0.00 174.94 175.35 2rtg s ASN 105 N 1.73 5.13 0.17 3.58 0.01 -0.62 -0.68 114.94 124.26 2rtg s ASN 105 Ca 0.03 -0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.05 2rtg s ASN 105 Cb -0.13 -1.90 -0.04 0.00 0.41 0.00 0.00 41.25 39.59 2rtg s ASN 105 CO -0.08 0.05 0.05 0.42 -1.51 0.00 0.00 177.10 176.04 2rtg s THR 106 N 1.11 0.33 0.06 1.60 -4.23 -0.18 -1.52 115.64 112.80 2rtg s THR 106 Ca 0.04 -1.96 0.05 0.00 -1.18 0.00 0.00 61.69 58.64 2rtg s THR 106 Cb -0.14 -2.21 -0.03 0.00 1.34 0.00 0.00 72.50 71.46 2rtg s THR 106 CO 0.03 -0.34 -0.15 -1.10 -0.54 0.00 0.00 174.62 172.51 2rtg s GLN 107 N -4.02 0.94 0.10 3.99 -0.21 -0.39 -1.80 119.66 118.27 2rtg s GLN 107 Ca 0.28 -0.87 0.01 0.00 0.02 0.00 0.00 55.36 54.79 2rtg s GLN 107 Cb 0.07 -0.98 -0.04 0.00 1.00 0.00 0.00 33.01 33.06 2rtg s GLN 107 CO 0.05 0.23 -0.04 1.67 -2.12 0.00 0.00 175.29 175.09 2rtg s TRP 108 N -1.02 0.82 -0.09 0.91 1.48 0.19 -0.97 118.94 120.26 2rtg s TRP 108 Ca 0.01 -0.99 0.01 0.00 -1.06 0.00 0.00 56.10 54.07 2rtg s TRP 108 Cb -0.09 -0.50 0.02 0.00 -1.16 0.00 0.00 33.47 31.74 2rtg s TRP 108 CO 0.02 -0.25 -0.10 -0.51 -4.06 0.00 0.00 176.95 172.04 2rtg s LEU 109 N -3.02 1.47 -0.31 -4.66 1.43 -0.49 -2.15 118.68 110.94 2rtg s LEU 109 Ca 0.13 -0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 2rtg s LEU 109 Cb 0.06 -0.85 0.07 0.00 0.03 0.00 0.00 46.19 45.50 2rtg s LEU 109 CO -0.05 -0.03 0.01 -0.22 0.23 0.00 0.00 176.35 176.30 2rtg s LEU 110 N 1.11 4.12 -0.14 1.79 0.20 -0.47 -0.87 118.68 124.42 2rtg s LEU 110 Ca -0.06 -1.52 -0.05 0.00 0.69 0.00 0.00 54.13 53.19 2rtg s LEU 110 Cb -0.14 -1.69 -0.03 0.00 -0.43 0.00 0.00 46.19 43.90 2rtg s LEU 110 CO -0.02 -0.30 0.02 -0.89 -0.29 0.00 0.00 176.35 174.87 2rtg s THR 111 N 1.16 4.45 0.05 3.68 2.01 -0.21 -1.13 115.64 125.65 2rtg s THR 111 Ca -0.02 -0.17 0.02 0.00 0.31 0.00 0.00 61.69 61.83 2rtg s THR 111 Cb -0.20 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 2rtg s THR 111 CO -0.03 0.52 0.08 -0.44 -0.69 0.00 0.00 174.62 174.06 2rtg s SER 112 N -0.11 5.58 0.18 3.53 0.01 -0.53 -1.15 113.70 121.20 2rtg s SER 112 Ca 0.05 0.05 -0.30 0.00 1.31 0.00 0.00 55.95 57.06 2rtg s SER 112 Cb -0.12 -1.54 -0.08 0.00 0.21 0.00 0.00 66.02 64.49 2rtg s SER 112 CO 0.02 0.21 1.09 -0.83 0.41 0.00 0.00 173.24 174.14 2rtg s GLY 113 N -2.13 2.87 0.35 3.44 0.00 -0.34 -4.83 107.32 106.68 2rtg s GLY 113 Ca 0.27 0.80 0.07 0.00 0.00 0.00 0.00 44.72 45.85 2rtg s GLY 113 CO 0.19 1.63 0.24 -1.30 0.00 0.00 0.00 173.10 173.85 2rtg n THR 114 N 2.33 0.00 -2.37 0.90 -2.24 -1.26 -5.04 114.28 106.60 2rtg n THR 114 Ca 0.02 -2.39 -0.26 0.00 -2.27 0.00 0.00 64.05 59.15 2rtg n THR 114 Cb 0.46 1.09 0.04 0.00 -2.10 0.00 0.00 70.33 69.82 2rtg n THR 114 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2rtg s THR 115 N -3.26 3.43 0.34 4.28 -4.23 -1.26 -4.90 115.64 110.04 2rtg s THR 115 Ca 0.34 -0.05 0.03 0.00 -1.18 0.00 0.00 61.69 60.83 2rtg s THR 115 Cb 0.02 -3.38 0.19 0.00 1.34 0.00 0.00 72.50 70.67 2rtg s THR 115 CO 0.24 -0.39 1.91 -0.08 -0.54 0.00 0.00 174.62 175.76 2rtg h GLU 116 N -0.23 0.63 -0.89 3.99 4.81 -2.01 -2.30 114.58 118.58 2rtg h GLU 116 Ca -0.45 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 58.67 2rtg h GLU 116 Cb 1.27 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 2rtg h GLU 116 CO 0.60 0.56 0.51 0.00 -0.73 0.00 0.00 179.01 179.96 2rtg h ALA 117 N 1.52 1.24 -0.62 2.92 0.00 -2.06 -2.81 119.26 119.45 2rtg h ALA 117 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2rtg h ALA 117 Cb 0.21 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2rtg h ALA 117 CO -0.01 0.64 0.00 0.09 0.00 0.00 0.00 179.25 179.97 2rtg n ASN 118 N -4.35 3.99 0.28 0.00 3.02 -0.91 -4.44 115.26 112.85 2rtg n ASN 118 Ca 0.10 -2.22 0.12 0.00 -0.03 0.00 0.00 54.58 52.55 2rtg n ASN 118 Cb 0.08 -0.50 0.78 0.00 -0.61 0.00 0.00 39.78 39.52 2rtg n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rtg h ALA 119 N 4.10 1.61 0.00 5.41 0.00 -1.17 -1.73 119.26 127.48 2rtg h ALA 119 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2rtg h ALA 119 Cb 1.14 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 2rtg h ALA 119 CO 0.12 0.05 -0.03 0.11 0.00 0.00 0.00 179.25 179.50 2rtg h TRP 120 N 0.00 0.00 -0.60 0.00 5.08 -1.81 -2.62 115.95 116.00 2rtg h TRP 120 Ca -0.00 0.00 -0.37 0.00 1.08 0.00 0.00 58.89 59.60 2rtg h TRP 120 Cb 0.09 0.00 -0.22 0.00 -3.00 0.00 0.00 29.16 26.03 2rtg h TRP 120 CO 0.00 0.03 0.01 0.36 -1.28 0.00 0.00 178.44 177.56 2rtg n LYS 121 N -4.00 2.34 0.10 0.12 2.85 -0.65 -4.69 118.16 114.23 2rtg n LYS 121 Ca -0.03 -3.37 0.08 0.00 -1.05 0.00 0.00 58.31 53.94 2rtg n LYS 121 Cb 0.11 -2.02 -0.00 0.00 -0.65 0.00 0.00 35.03 32.47 2rtg n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2rtg h SER 122 N 1.38 0.00 -3.33 -5.58 4.64 -1.53 -3.47 113.55 105.65 2rtg h SER 122 Ca 0.36 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 61.03 2rtg h SER 122 Cb 1.64 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.47 2rtg h SER 122 CO 0.73 0.16 -0.74 -0.89 -0.87 0.00 0.00 176.83 175.22 2rtg s THR 123 N -3.23 3.26 0.09 2.95 2.01 -1.26 -1.45 115.64 118.01 2rtg s THR 123 Ca -0.00 -0.57 0.02 0.00 0.31 0.00 0.00 61.69 61.45 2rtg s THR 123 Cb 0.09 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 2rtg s THR 123 CO 0.78 0.49 0.13 -0.76 -0.69 0.00 0.00 174.62 174.57 2rtg s LEU 124 N 0.65 3.96 0.06 4.42 1.43 -0.28 -4.93 118.68 123.99 2rtg s LEU 124 Ca -0.05 0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.15 2rtg s LEU 124 Cb -0.15 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.43 2rtg s LEU 124 CO 0.02 0.16 -0.15 0.54 0.23 0.00 0.00 176.35 177.15 2rtg s VAL 125 N -1.47 1.15 0.07 -1.59 0.11 -1.26 -1.36 120.40 116.05 2rtg s VAL 125 Ca 0.31 -1.17 -0.05 0.00 -2.93 0.00 0.00 61.98 58.13 2rtg s VAL 125 Cb -0.12 -1.07 0.02 0.00 -1.53 0.00 0.00 36.38 33.68 2rtg s VAL 125 CO 0.24 -0.10 0.26 0.61 -3.33 0.00 0.00 175.10 172.77 2rtg n GLY 126 N 1.56 1.33 3.13 6.54 0.00 -0.92 -4.99 105.19 111.84 2rtg n GLY 126 Ca -0.20 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 2rtg n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2rtg s HIS 127 N -5.73 -0.25 0.04 1.61 -3.43 -1.26 -0.64 115.29 105.63 2rtg s HIS 127 Ca 0.06 0.59 0.04 0.00 -0.80 0.00 0.00 55.06 54.95 2rtg s HIS 127 Cb -0.01 0.08 -0.02 0.00 -1.43 0.00 0.00 32.58 31.20 2rtg s HIS 127 CO 0.02 -0.15 -0.12 -0.51 -2.00 0.00 0.00 174.74 171.98 2rtg s ASP 128 N -0.01 1.44 -0.09 7.38 1.01 -0.74 -4.98 116.67 120.68 2rtg s ASP 128 Ca -0.01 -0.44 0.03 0.00 0.71 0.00 0.00 52.55 52.84 2rtg s ASP 128 Cb -0.02 -0.08 0.00 0.00 1.01 0.00 0.00 42.92 43.84 2rtg s ASP 128 CO 0.01 -0.01 -0.20 -0.89 0.21 0.00 0.00 175.17 174.29 2rtg s THR 129 N -0.88 1.78 -0.01 -1.27 2.01 -1.26 -1.01 115.64 115.00 2rtg s THR 129 Ca -0.00 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.17 2rtg s THR 129 Cb -0.08 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.84 2rtg s THR 129 CO 0.01 0.50 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.02 2rtg s PHE 130 N 0.48 2.91 -0.08 4.92 0.40 0.14 -3.28 117.98 123.48 2rtg s PHE 130 Ca -0.17 -0.02 0.04 0.00 -0.60 0.00 0.00 56.93 56.19 2rtg s PHE 130 Cb -0.17 -1.63 -0.01 0.00 0.51 0.00 0.00 43.02 41.71 2rtg s PHE 130 CO 0.07 0.37 -0.21 0.99 0.70 0.00 0.00 175.22 177.13 2rtg s THR 131 N -0.97 2.35 0.30 0.64 2.01 0.51 -2.27 115.64 118.22 2rtg s THR 131 Ca 0.16 -0.95 -0.21 0.00 0.31 0.00 0.00 61.69 61.01 2rtg s THR 131 Cb -0.11 -1.90 -0.09 0.00 0.01 0.00 0.00 72.50 70.41 2rtg s THR 131 CO 0.06 0.56 0.82 -0.75 -0.69 0.00 0.00 174.62 174.63 2rtg s LYS 132 N -0.06 4.29 0.08 4.92 2.20 -1.23 -1.26 119.74 128.68 2rtg s LYS 132 Ca -0.06 0.99 0.03 0.00 -0.36 0.00 0.00 55.97 56.57 2rtg s LYS 132 Cb -0.14 -2.66 -0.04 0.00 -1.51 0.00 0.00 37.83 33.47 2rtg s LYS 132 CO 0.05 0.25 0.09 0.08 -0.36 0.00 0.00 175.35 175.45 2rtg s VAL 133 N -1.74 4.59 -0.14 4.02 1.01 -0.37 -4.94 120.40 122.83 2rtg s VAL 133 Ca 0.50 -0.73 -0.24 0.00 0.00 0.00 0.00 61.98 61.51 2rtg s VAL 133 Cb -0.15 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2rtg s VAL 133 CO 0.20 0.13 0.76 -0.75 0.00 0.00 0.00 175.10 175.44 2rtg s LYS 134 N -2.38 4.33 0.00 2.72 2.36 -1.26 -4.61 119.74 120.89 2rtg s LYS 134 Ca 0.29 0.92 0.25 0.00 -2.55 0.00 0.00 55.97 54.88 2rtg s LYS 134 Cb -0.12 -3.54 1.51 0.00 -1.05 0.00 0.00 37.83 34.63 2rtg s LYS 134 CO 0.22 -0.20 1.87 -0.35 1.55 0.00 0.00 175.35 178.44