#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1slg h GLU 14 N 0.00 0.33 -0.89 0.00 -0.00 -1.90 -2.66 114.58 109.47 1slg h GLU 14 Ca 0.00 -0.02 0.14 0.00 -0.00 0.00 0.00 59.36 59.48 1slg h GLU 14 Cb 0.00 -0.07 -0.09 0.00 -0.00 0.00 0.00 28.75 28.58 1slg h GLU 14 CO 0.00 0.22 0.49 0.00 -0.00 0.00 0.00 179.01 179.72 1slg h ALA 15 N 1.71 1.34 -0.78 1.06 0.00 -1.93 -1.47 119.26 119.19 1slg h ALA 15 Ca 0.54 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.51 1slg h ALA 15 Cb 1.02 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1slg h ALA 15 CO -0.55 -0.01 0.48 0.78 0.00 0.00 0.00 179.25 179.94 1slg h GLY 16 N 0.72 1.14 1.68 0.00 0.00 -1.92 -2.89 103.07 101.80 1slg h GLY 16 Ca 0.47 -0.47 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1slg h GLY 16 CO -0.33 0.46 -1.08 -2.22 0.00 0.00 0.00 176.54 173.36 1slg h ILE 17 N 1.07 1.50 -2.83 2.60 2.04 -1.51 -3.45 117.51 116.93 1slg h ILE 17 Ca 0.28 -2.87 -0.53 0.00 1.00 0.00 0.00 64.86 62.74 1slg h ILE 17 Cb -0.04 2.73 0.04 0.00 -0.74 0.00 0.00 36.82 38.80 1slg h ILE 17 CO -0.05 0.84 0.88 -0.89 0.00 0.00 0.00 178.15 178.92 1slg s THR 18 N -2.90 2.72 -5.00 -0.27 2.01 -0.61 -4.82 115.64 106.77 1slg s THR 18 Ca -0.04 0.50 0.00 0.00 0.31 0.00 0.00 61.69 62.46 1slg s THR 18 Cb 0.08 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.27 1slg s THR 18 CO 0.86 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.44 1slg n GLY 19 N 3.75 -0.79 3.75 4.40 0.00 -0.99 -4.53 105.19 110.77 1slg n GLY 19 Ca 0.14 -1.37 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1slg n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1slg s THR 20 N -2.80 5.29 0.13 2.61 2.01 -0.31 -1.44 115.64 121.13 1slg s THR 20 Ca 0.00 0.14 0.04 0.00 0.31 0.00 0.00 61.69 62.18 1slg s THR 20 Cb 0.00 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1slg s THR 20 CO 0.00 0.49 -0.10 0.26 -0.69 0.00 0.00 174.62 174.58 1slg s TRP 21 N -0.00 1.18 0.00 4.92 0.52 0.10 -0.88 118.94 124.78 1slg s TRP 21 Ca 0.09 -0.73 -0.01 0.00 0.02 0.00 0.00 56.10 55.47 1slg s TRP 21 Cb -0.11 -0.62 -0.01 0.00 -1.15 0.00 0.00 33.47 31.58 1slg s TRP 21 CO -0.00 0.04 0.01 1.52 0.02 0.00 0.00 176.95 178.54 1slg s TYR 22 N -3.01 0.08 0.56 -1.98 -0.85 -0.32 -1.69 117.35 110.14 1slg s TYR 22 Ca 0.12 -0.16 0.09 0.00 -0.52 0.00 0.00 57.07 56.60 1slg s TYR 22 Cb 0.01 -0.07 0.08 0.00 0.38 0.00 0.00 41.96 42.36 1slg s TYR 22 CO 0.00 -0.09 0.77 0.54 -1.52 0.00 0.00 175.55 175.25 1slg s ASN 23 N -0.59 5.14 0.63 -0.18 2.20 -0.69 -1.13 114.94 120.31 1slg s ASN 23 Ca -0.07 -0.77 0.38 0.00 -0.94 0.00 0.00 52.86 51.46 1slg s ASN 23 Cb -0.04 0.16 2.11 0.00 -2.00 0.00 0.00 41.25 41.48 1slg s ASN 23 CO -0.00 -1.29 2.30 0.06 -2.94 0.00 0.00 177.10 175.22 1slg h GLN 24 N 0.20 0.00 -0.18 3.55 -0.00 -1.90 -1.51 115.11 115.26 1slg h GLN 24 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.34 1slg h GLN 24 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.77 1slg h GLN 24 CO 0.41 0.01 0.00 1.28 -0.00 0.00 0.00 178.83 180.53 1slg n LEU 25 N -3.39 2.13 0.00 0.06 4.77 -1.26 -4.94 117.00 114.36 1slg n LEU 25 Ca -0.03 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.09 1slg n LEU 25 Cb 0.10 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1slg n LEU 25 CO 0.24 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1slg n GLY 26 N 1.23 0.76 3.81 -0.72 0.00 -0.57 -4.69 105.19 105.01 1slg n GLY 26 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1slg n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1slg s SER 27 N -2.03 6.29 -0.14 1.61 0.01 -1.26 -3.09 113.70 115.09 1slg s SER 27 Ca 0.00 1.80 -0.04 0.00 1.31 0.00 0.00 55.95 59.02 1slg s SER 27 Cb 0.00 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 1slg s SER 27 CO 0.00 -0.81 -0.01 -0.89 0.41 0.00 0.00 173.24 171.94 1slg s THR 28 N -2.28 4.19 -0.12 1.44 2.01 0.11 -1.71 115.64 119.27 1slg s THR 28 Ca 0.64 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.38 1slg s THR 28 Cb -0.14 -2.83 0.02 0.00 0.01 0.00 0.00 72.50 69.57 1slg s THR 28 CO 0.27 0.52 -0.11 0.12 -0.69 0.00 0.00 174.62 174.72 1slg s PHE 29 N 0.03 1.78 -0.20 4.92 5.36 -0.68 -0.80 117.98 128.40 1slg s PHE 29 Ca 0.02 -0.92 -0.05 0.00 -0.96 0.00 0.00 56.93 55.01 1slg s PHE 29 Cb -0.13 -1.38 -0.03 0.00 -0.34 0.00 0.00 43.02 41.15 1slg s PHE 29 CO 0.02 -0.56 0.01 0.42 -1.46 0.00 0.00 175.22 173.65 1slg s ILE 30 N 1.52 4.10 0.02 3.12 -1.09 -0.37 -0.73 121.20 127.78 1slg s ILE 30 Ca 0.03 -0.27 0.00 0.00 -2.23 0.00 0.00 60.65 58.19 1slg s ILE 30 Cb -0.13 -2.85 -0.02 0.00 -1.58 0.00 0.00 42.46 37.88 1slg s ILE 30 CO -0.08 0.43 -0.03 0.54 -1.23 0.00 0.00 174.94 174.57 1slg s VAL 31 N 0.87 0.11 -0.11 2.92 0.11 -0.52 -2.14 120.40 121.64 1slg s VAL 31 Ca 0.01 -0.91 0.03 0.00 -2.93 0.00 0.00 61.98 58.18 1slg s VAL 31 Cb -0.14 -0.26 0.01 0.00 -1.53 0.00 0.00 36.38 34.45 1slg s VAL 31 CO 0.02 -0.50 -0.22 -0.89 -3.33 0.00 0.00 175.10 170.18 1slg s THR 32 N -1.46 1.94 -0.28 5.04 2.01 -0.37 -2.36 115.64 120.16 1slg s THR 32 Ca -0.16 -0.93 -0.16 0.00 0.31 0.00 0.00 61.69 60.75 1slg s THR 32 Cb -0.10 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 1slg s THR 32 CO -0.01 0.53 0.44 0.00 -0.69 0.00 0.00 174.62 174.89 1slg s ALA 33 N 0.61 3.56 0.45 7.40 0.00 -1.26 -2.57 121.76 129.95 1slg s ALA 33 Ca -0.13 -0.78 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 1slg s ALA 33 Cb -0.17 -2.81 -0.03 0.00 0.00 0.00 0.00 23.12 20.11 1slg s ALA 33 CO 0.03 -0.76 0.72 0.20 0.00 0.00 0.00 175.76 175.96 1slg s GLY 34 N 1.62 1.46 0.25 0.00 0.00 -0.05 -4.83 107.32 105.77 1slg s GLY 34 Ca 0.17 -0.62 0.24 0.00 0.00 0.00 0.00 44.72 44.51 1slg s GLY 34 CO 0.10 -0.48 1.71 0.00 0.00 0.00 0.00 173.10 174.43 1slg n ALA 35 N -2.14 1.69 1.71 3.20 0.00 -1.26 -2.20 120.51 121.51 1slg n ALA 35 Ca -0.01 0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.57 1slg n ALA 35 Cb 0.55 -1.39 0.29 0.00 0.00 0.00 0.00 19.45 18.91 1slg n ALA 35 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1slg n ASP 36 N -2.23 0.55 0.00 0.00 5.75 -1.26 -4.90 116.55 114.46 1slg n ASP 36 Ca 0.02 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.07 1slg n ASP 36 Cb 0.24 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1slg n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1slg n GLY 37 N 0.80 0.74 3.83 6.12 0.00 -0.93 -5.00 105.19 110.75 1slg n GLY 37 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1slg n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1slg s ALA 38 N -2.36 3.36 -0.05 4.61 0.00 -1.24 -1.16 121.76 124.92 1slg s ALA 38 Ca 0.00 0.12 0.06 0.00 0.00 0.00 0.00 51.96 52.14 1slg s ALA 38 Cb 0.00 -2.81 -0.01 0.00 0.00 0.00 0.00 23.12 20.30 1slg s ALA 38 CO 0.00 0.32 -0.22 -0.51 0.00 0.00 0.00 175.76 175.35 1slg s LEU 39 N -2.43 2.02 0.03 0.00 1.02 -0.30 -0.87 118.68 118.14 1slg s LEU 39 Ca 0.48 -0.45 -0.01 0.00 0.02 0.00 0.00 54.13 54.18 1slg s LEU 39 Cb -0.14 -1.22 -0.03 0.00 0.02 0.00 0.00 46.19 44.83 1slg s LEU 39 CO 0.19 0.22 -0.02 0.42 0.02 0.00 0.00 176.35 177.18 1slg s THR 40 N -0.15 0.15 -3.87 5.49 -4.23 -1.06 -2.07 115.64 109.90 1slg s THR 40 Ca -0.02 -1.28 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 1slg s THR 40 Cb -0.12 -0.79 0.00 0.00 1.34 0.00 0.00 72.50 72.93 1slg s THR 40 CO 0.03 -0.70 0.00 0.61 -0.54 0.00 0.00 174.62 174.01 1slg n GLY 41 N 0.97 -0.51 3.09 3.99 0.00 -1.12 -1.24 105.19 110.36 1slg n GLY 41 Ca -0.20 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 1slg n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1slg s THR 42 N -3.07 0.59 -0.06 2.61 -4.23 -0.91 -1.44 115.64 109.12 1slg s THR 42 Ca 0.00 -1.25 0.05 0.00 -1.18 0.00 0.00 61.69 59.31 1slg s THR 42 Cb 0.00 -0.82 -0.01 0.00 1.34 0.00 0.00 72.50 73.01 1slg s THR 42 CO 0.00 -0.47 -0.22 -0.47 -0.54 0.00 0.00 174.62 172.92 1slg s TYR 43 N -1.79 2.25 -0.00 3.99 6.14 0.06 -1.23 117.35 126.77 1slg s TYR 43 Ca -0.06 -0.74 0.05 0.00 0.64 0.00 0.00 57.07 56.96 1slg s TYR 43 Cb -0.07 -1.50 -0.01 0.00 0.42 0.00 0.00 41.96 40.80 1slg s TYR 43 CO -0.00 -0.26 -0.15 -1.21 0.64 0.00 0.00 175.55 174.57 1slg s GLU 44 N 0.04 1.14 0.91 4.97 2.02 0.02 -0.77 118.70 127.04 1slg s GLU 44 Ca -0.08 -0.57 -0.11 0.00 0.02 0.00 0.00 54.97 54.23 1slg s GLU 44 Cb -0.14 -1.12 0.14 0.00 0.10 0.00 0.00 34.13 33.11 1slg s GLU 44 CO 0.05 0.30 1.09 -1.12 0.02 0.00 0.00 175.26 175.60 1slg s SER 45 N -0.50 3.28 0.00 -0.19 0.01 -1.25 -0.72 113.70 114.34 1slg s SER 45 Ca 0.05 1.54 0.04 0.00 1.31 0.00 0.00 55.95 58.89 1slg s SER 45 Cb -0.06 -2.21 0.19 0.00 0.21 0.00 0.00 66.02 64.15 1slg s SER 45 CO -0.00 -2.77 1.12 0.00 0.41 0.00 0.00 173.24 172.00 1slg n ALA 46 N -3.97 1.22 0.27 1.44 0.00 -1.18 -2.50 120.51 115.79 1slg n ALA 46 Ca 0.07 -0.02 0.15 0.00 0.00 0.00 0.00 53.44 53.64 1slg n ALA 46 Cb 0.55 -1.07 0.73 0.00 0.00 0.00 0.00 19.45 19.66 1slg n ALA 46 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1slg h VAL 47 N 0.00 0.37 -0.62 0.00 -1.51 -1.92 -3.48 116.25 109.07 1slg h VAL 47 Ca 0.00 -0.57 0.08 0.00 -1.23 0.00 0.00 66.70 64.98 1slg h VAL 47 Cb 0.07 1.41 -0.02 0.00 -2.13 0.00 0.00 31.29 30.62 1slg h VAL 47 CO 0.00 0.10 -0.10 0.61 -1.23 0.00 0.00 177.57 176.94 1slg n GLY 48 N -0.43 -1.41 1.12 5.19 0.00 -1.04 -5.06 105.19 103.56 1slg n GLY 48 Ca -0.01 -1.46 0.15 0.00 0.00 0.00 0.00 46.02 44.69 1slg n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1slg n ASN 49 N -1.66 -6.69 -0.04 1.61 2.85 -1.26 -4.54 115.26 105.53 1slg n ASN 49 Ca 0.00 0.68 -0.01 0.00 -0.11 0.00 0.00 54.58 55.14 1slg n ASN 49 Cb 0.13 -3.53 -0.01 0.00 1.24 0.00 0.00 39.78 37.60 1slg n ASN 49 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1slg n ALA 50 N -2.75 -0.07 -2.97 5.20 0.00 -1.26 -3.84 120.51 114.82 1slg n ALA 50 Ca -0.02 0.09 -0.30 0.00 0.00 0.00 0.00 53.44 53.21 1slg n ALA 50 Cb 0.52 0.23 -0.03 0.00 0.00 0.00 0.00 19.45 20.16 1slg n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1slg n GLU 51 N -2.98 3.59 0.00 0.00 4.07 -1.26 0.13 120.64 124.19 1slg n GLU 51 Ca 0.00 -4.79 0.00 0.00 -0.06 0.00 0.00 57.16 52.31 1slg n GLU 51 Cb 0.03 -2.30 0.00 0.00 -0.06 0.00 0.00 31.44 29.11 1slg n GLU 51 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 1slg n SER 52 N 0.04 1.14 -4.65 4.31 7.64 -1.25 -4.88 113.62 115.97 1slg n SER 52 Ca 0.33 -1.51 -0.40 0.00 1.01 0.00 0.00 58.87 58.31 1slg n SER 52 Cb 0.37 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.50 1slg n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1slg s ARG 53 N -0.51 4.18 0.15 1.43 0.52 0.12 -3.77 118.95 121.07 1slg s ARG 53 Ca 0.00 0.48 0.09 0.00 -0.52 0.00 0.00 55.73 55.79 1slg s ARG 53 Cb 0.00 -3.58 -0.04 0.00 0.52 0.00 0.00 34.95 31.85 1slg s ARG 53 CO 0.00 -0.22 -0.21 0.71 0.02 0.00 0.00 175.30 175.60 1slg s TYR 54 N 1.86 1.95 0.14 -0.53 1.51 0.05 -4.85 117.35 117.47 1slg s TYR 54 Ca 0.25 -0.43 -0.30 0.00 -1.01 0.00 0.00 57.07 55.59 1slg s TYR 54 Cb -0.16 -1.00 -0.07 0.00 -0.11 0.00 0.00 41.96 40.63 1slg s TYR 54 CO 0.10 0.34 1.04 0.08 -1.11 0.00 0.00 175.55 176.00 1slg s VAL 55 N -1.68 4.16 0.09 0.71 1.01 -1.26 -0.76 120.40 122.66 1slg s VAL 55 Ca 0.14 1.81 0.09 0.00 0.00 0.00 0.00 61.98 64.03 1slg s VAL 55 Cb -0.08 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1slg s VAL 55 CO 0.07 0.29 -0.23 -1.48 0.00 0.00 0.00 175.10 173.75 1slg s LEU 56 N -0.14 2.43 0.04 3.92 0.05 -0.52 -4.38 118.68 120.07 1slg s LEU 56 Ca 0.49 -0.61 0.03 0.00 0.05 0.00 0.00 54.13 54.09 1slg s LEU 56 Cb -0.27 -1.37 -0.02 0.00 -2.05 0.00 0.00 46.19 42.48 1slg s LEU 56 CO 0.32 0.21 -0.10 0.28 -0.55 0.00 0.00 176.35 176.52 1slg s THR 57 N -0.99 0.75 0.13 5.48 -1.32 -1.15 -2.81 115.64 115.73 1slg s THR 57 Ca 0.15 -0.95 -0.09 0.00 -1.21 0.00 0.00 61.69 59.59 1slg s THR 57 Cb -0.10 -0.73 0.03 0.00 -1.51 0.00 0.00 72.50 70.19 1slg s THR 57 CO 0.06 -0.18 0.45 0.61 -2.21 0.00 0.00 174.62 173.36 1slg n GLY 58 N 1.80 1.18 3.06 6.08 0.00 -0.88 -0.96 105.19 115.47 1slg n GLY 58 Ca -0.20 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.65 1slg n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1slg s ARG 59 N -2.03 0.41 0.13 1.61 1.81 -0.94 -1.15 118.95 118.79 1slg s ARG 59 Ca 0.10 -0.44 -0.02 0.00 -1.72 0.00 0.00 55.73 53.65 1slg s ARG 59 Cb -0.02 0.17 -0.04 0.00 -0.45 0.00 0.00 34.95 34.61 1slg s ARG 59 CO 0.04 -0.09 0.08 1.52 -0.68 0.00 0.00 175.30 176.17 1slg s TYR 60 N -1.34 0.82 -0.53 -0.53 1.13 -0.31 -2.19 117.35 114.41 1slg s TYR 60 Ca -0.14 -1.19 -0.28 0.00 -1.41 0.00 0.00 57.07 54.04 1slg s TYR 60 Cb -0.08 -0.44 0.02 0.00 -1.10 0.00 0.00 41.96 40.35 1slg s TYR 60 CO 0.01 -0.54 1.38 0.34 -2.51 0.00 0.00 175.55 174.23 1slg s ASP 61 N -3.04 6.23 0.00 -0.18 2.15 -0.59 -4.65 116.67 116.59 1slg s ASP 61 Ca 0.24 0.40 0.30 0.00 0.43 0.00 0.00 52.55 53.92 1slg s ASP 61 Cb 0.07 -2.55 1.45 0.00 -0.30 0.00 0.00 42.92 41.59 1slg s ASP 61 CO 0.02 -1.60 2.02 -1.54 -0.17 0.00 0.00 175.17 173.89 1slg n SER 62 N 9.22 0.03 -3.35 -0.34 3.41 -1.26 -4.13 113.62 117.20 1slg n SER 62 Ca 0.13 -0.04 -0.26 0.00 -0.26 0.00 0.00 58.87 58.44 1slg n SER 62 Cb 0.49 -0.31 -0.08 0.00 -0.26 0.00 0.00 64.21 64.05 1slg n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1slg n ALA 63 N -1.31 3.15 -1.05 7.33 0.00 -1.26 -4.69 120.51 122.68 1slg n ALA 63 Ca 0.13 -3.96 -0.32 0.00 0.00 0.00 0.00 53.44 49.29 1slg n ALA 63 Cb 0.26 -0.85 0.12 0.00 0.00 0.00 0.00 19.45 18.98 1slg n ALA 63 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1slg s PRO 64 N -1.55 1.75 0.51 0.00 0.02 -1.26 -5.01 135.00 129.46 1slg s PRO 64 Ca 0.36 1.43 -0.21 0.00 0.02 0.00 0.00 61.00 62.60 1slg s PRO 64 Cb 0.13 -1.82 -0.06 0.00 0.02 0.00 0.00 34.50 32.77 1slg s PRO 64 CO -0.09 -2.07 1.16 0.00 -0.33 0.00 0.00 177.00 175.67 1slg s ALA 65 N -2.63 2.80 0.00 -1.55 0.00 -1.26 -5.03 121.76 114.09 1slg s ALA 65 Ca 0.66 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1slg s ALA 65 Cb -0.21 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1slg s ALA 65 CO 0.54 -0.78 0.00 2.41 0.00 0.00 0.00 175.76 177.93 1slg n THR 66 N -0.97 0.00 -3.91 0.00 -1.04 -1.26 -4.66 114.28 102.44 1slg n THR 66 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1slg n THR 66 Cb 0.49 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.83 1slg n THR 66 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1slg n ASP 67 N 0.00 -0.41 -1.87 8.00 8.00 -1.26 -3.15 116.55 125.86 1slg n ASP 67 Ca 0.00 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 1slg n ASP 67 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.14 1slg n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1slg n GLY 68 N 0.00 6.25 3.79 0.44 0.00 -1.26 -5.04 105.19 109.36 1slg n GLY 68 Ca 0.00 -2.50 -0.35 0.00 0.00 0.00 0.00 46.02 43.17 1slg n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1slg s SER 69 N -3.51 6.67 0.82 1.61 0.01 -1.19 -5.07 113.70 113.05 1slg s SER 69 Ca 0.50 1.94 -0.11 0.00 1.31 0.00 0.00 55.95 59.58 1slg s SER 69 Cb 0.41 -2.57 0.11 0.00 0.21 0.00 0.00 66.02 64.18 1slg s SER 69 CO 0.03 -0.55 1.17 -0.83 0.41 0.00 0.00 173.24 173.47 1slg s GLY 70 N -1.80 1.67 -0.29 3.44 0.00 -1.26 -4.92 107.32 104.16 1slg s GLY 70 Ca 0.61 -0.92 -0.11 0.00 0.00 0.00 0.00 44.72 44.31 1slg s GLY 70 CO 0.23 -0.37 0.18 -1.59 0.00 0.00 0.00 173.10 171.55 1slg s THR 71 N -3.57 5.08 0.36 0.90 2.01 -0.01 -4.79 115.64 115.62 1slg s THR 71 Ca 0.65 -0.02 -0.26 0.00 0.31 0.00 0.00 61.69 62.37 1slg s THR 71 Cb -0.09 -3.47 -0.09 0.00 0.01 0.00 0.00 72.50 68.87 1slg s THR 71 CO 0.49 0.19 1.10 0.00 -0.69 0.00 0.00 174.62 175.71 1slg s ALA 72 N 1.71 3.20 0.25 7.40 0.00 -1.26 -0.42 121.76 132.65 1slg s ALA 72 Ca 0.06 0.83 -0.19 0.00 0.00 0.00 0.00 51.96 52.67 1slg s ALA 72 Cb -0.16 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.66 1slg s ALA 72 CO 0.09 -0.28 0.62 -0.48 0.00 0.00 0.00 175.76 175.72 1slg s LEU 73 N -2.23 -0.11 0.03 0.00 -0.00 -0.70 -1.54 118.68 114.13 1slg s LEU 73 Ca 0.53 -0.59 -0.27 0.00 -0.00 0.00 0.00 54.13 53.81 1slg s LEU 73 Cb -0.27 2.42 0.07 0.00 -0.00 0.00 0.00 46.19 48.40 1slg s LEU 73 CO 0.35 -1.22 0.62 -0.83 -0.00 0.00 0.00 176.35 175.27 1slg s GLY 74 N -2.91 -0.55 0.17 -3.48 0.00 -0.93 -2.22 107.32 97.39 1slg s GLY 74 Ca 0.12 0.91 -0.13 0.00 0.00 0.00 0.00 44.72 45.62 1slg s GLY 74 CO 0.04 0.58 0.39 0.66 0.00 0.00 0.00 173.10 174.76 1slg s TRP 75 N -2.20 0.10 -0.02 1.90 -2.14 -0.88 -2.22 118.94 113.47 1slg s TRP 75 Ca -0.06 -0.45 0.06 0.00 2.66 0.00 0.00 56.10 58.30 1slg s TRP 75 Cb -0.01 0.16 -0.01 0.00 -3.10 0.00 0.00 33.47 30.51 1slg s TRP 75 CO 0.01 -0.78 -0.20 0.99 -2.66 0.00 0.00 176.95 174.31 1slg s THR 76 N -3.90 1.56 -0.08 0.66 2.01 -0.14 -0.88 115.64 114.87 1slg s THR 76 Ca 0.11 -0.84 0.04 0.00 0.31 0.00 0.00 61.69 61.32 1slg s THR 76 Cb 0.02 -1.31 -0.01 0.00 0.01 0.00 0.00 72.50 71.21 1slg s THR 76 CO -0.04 0.44 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.42 1slg s VAL 77 N -0.37 2.18 -0.19 3.82 1.01 -0.13 -2.91 120.40 123.81 1slg s VAL 77 Ca 0.05 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.96 1slg s VAL 77 Cb -0.09 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1slg s VAL 77 CO -0.00 0.56 0.06 0.00 0.00 0.00 0.00 175.10 175.72 1slg s ALA 78 N 0.10 3.34 -1.53 5.51 0.00 -1.26 -1.21 121.76 126.71 1slg s ALA 78 Ca -0.11 -0.82 -0.10 0.00 0.00 0.00 0.00 51.96 50.93 1slg s ALA 78 Cb -0.16 -1.94 -0.08 0.00 0.00 0.00 0.00 23.12 20.95 1slg s ALA 78 CO 0.06 0.05 2.80 0.91 0.00 0.00 0.00 175.76 179.59 1slg n TRP 79 N 3.81 2.37 -3.72 0.00 7.02 -0.19 -4.77 117.44 121.96 1slg n TRP 79 Ca -0.16 -2.94 -0.21 0.00 -1.02 0.00 0.00 57.50 53.16 1slg n TRP 79 Cb 0.52 -2.40 -0.18 0.00 -2.42 0.00 0.00 31.31 26.83 1slg n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1slg s LYS 80 N 2.42 0.19 0.00 -0.99 2.20 -1.26 -0.07 119.74 122.23 1slg s LYS 80 Ca 0.65 0.26 0.00 0.00 -0.36 0.00 0.00 55.97 56.52 1slg s LYS 80 Cb 0.17 -0.67 0.00 0.00 -1.51 0.00 0.00 37.83 35.81 1slg s LYS 80 CO -0.06 -0.31 0.00 0.27 -0.36 0.00 0.00 175.35 174.89 1slg n ASN 81 N 5.18 1.23 -0.01 1.43 0.23 0.35 -4.83 115.26 118.84 1slg n ASN 81 Ca -0.06 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 54.08 1slg n ASN 81 Cb 0.50 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.74 1slg n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1slg n ASN 82 N 0.00 0.02 0.00 0.53 5.03 -1.26 -3.89 115.26 115.69 1slg n ASN 82 Ca 0.00 -1.44 0.00 0.00 0.87 0.00 0.00 54.58 54.01 1slg n ASN 82 Cb 0.00 -0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1slg n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1slg n TYR 83 N -0.77 0.00 -3.85 3.10 4.01 -1.26 -5.09 117.16 113.30 1slg n TYR 83 Ca 0.14 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.78 1slg n TYR 83 Cb 0.06 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.02 1slg n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1slg s ARG 84 N -1.80 0.76 -0.23 -0.72 1.81 -1.25 -5.13 118.95 112.40 1slg s ARG 84 Ca 0.00 -0.80 -0.03 0.00 -1.72 0.00 0.00 55.73 53.18 1slg s ARG 84 Cb 0.00 0.31 0.10 0.00 -0.45 0.00 0.00 34.95 34.91 1slg s ARG 84 CO 0.00 -0.23 0.21 1.21 -0.68 0.00 0.00 175.30 175.81 1slg s ASN 85 N -2.47 1.78 0.00 0.23 3.84 -1.26 -0.50 114.94 116.56 1slg s ASN 85 Ca -0.00 -0.49 0.20 0.00 0.21 0.00 0.00 52.86 52.78 1slg s ASN 85 Cb 0.02 0.26 0.80 0.00 -0.55 0.00 0.00 41.25 41.78 1slg s ASN 85 CO -0.07 -0.35 1.57 0.00 -2.79 0.00 0.00 177.10 175.45 1slg n ALA 86 N 5.31 2.54 -3.91 1.71 0.00 0.90 -4.98 120.51 122.07 1slg n ALA 86 Ca -0.05 -0.43 -0.26 0.00 0.00 0.00 0.00 53.44 52.70 1slg n ALA 86 Cb 0.48 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.79 1slg n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1slg n HIS 87 N 0.08 -1.68 -3.53 0.00 8.25 -1.26 -4.88 115.22 112.20 1slg n HIS 87 Ca 0.15 0.71 -0.13 0.00 -0.26 0.00 0.00 57.72 58.20 1slg n HIS 87 Cb 0.27 -3.75 -0.04 0.00 1.12 0.00 0.00 29.99 27.59 1slg n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1slg s SER 88 N -4.28 -0.46 -0.01 0.41 1.04 -1.26 -0.86 113.70 108.29 1slg s SER 88 Ca 0.05 0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1slg s SER 88 Cb -0.02 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.64 1slg s SER 88 CO 0.88 -0.83 -0.01 0.00 0.98 0.00 0.00 173.24 174.26 1slg s ALA 89 N -3.13 0.17 -0.05 5.32 0.00 -0.64 -1.03 121.76 122.41 1slg s ALA 89 Ca -0.02 0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.98 1slg s ALA 89 Cb -0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 1slg s ALA 89 CO -0.07 0.00 -0.11 0.99 0.00 0.00 0.00 175.76 176.57 1slg s THR 90 N 0.26 3.32 -0.09 0.00 2.01 -0.35 -1.04 115.64 119.75 1slg s THR 90 Ca -0.02 -0.63 0.04 0.00 0.31 0.00 0.00 61.69 61.38 1slg s THR 90 Cb -0.04 -2.33 -0.01 0.00 0.01 0.00 0.00 72.50 70.13 1slg s THR 90 CO -0.01 0.59 -0.20 0.42 -0.69 0.00 0.00 174.62 174.73 1slg s THR 91 N -0.77 2.45 -0.09 -0.82 -4.23 -0.80 -0.96 115.64 110.43 1slg s THR 91 Ca 0.12 -0.90 -0.00 0.00 -1.18 0.00 0.00 61.69 59.72 1slg s THR 91 Cb -0.11 -1.95 -0.03 0.00 1.34 0.00 0.00 72.50 71.75 1slg s THR 91 CO 0.01 0.56 -0.05 0.26 -0.54 0.00 0.00 174.62 174.85 1slg s TRP 92 N 0.01 2.98 -0.07 3.99 0.51 -0.06 -1.55 118.94 124.76 1slg s TRP 92 Ca -0.07 -0.03 0.01 0.00 -2.12 0.00 0.00 56.10 53.90 1slg s TRP 92 Cb -0.15 -1.77 0.02 0.00 -0.81 0.00 0.00 33.47 30.76 1slg s TRP 92 CO 0.05 0.27 -0.09 0.45 -0.51 0.00 0.00 176.95 177.13 1slg s SER 93 N -0.58 1.65 0.00 2.95 0.15 -0.27 -2.08 113.70 115.53 1slg s SER 93 Ca 0.09 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.49 1slg s SER 93 Cb -0.12 -0.72 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 1slg s SER 93 CO 0.02 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.04 1slg n GLY 94 N 4.16 1.57 3.13 9.45 0.00 -0.94 -1.52 105.19 121.04 1slg n GLY 94 Ca -0.21 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 1slg n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1slg s GLN 95 N 1.61 0.32 -0.09 1.61 -2.07 -0.51 -1.72 119.66 118.81 1slg s GLN 95 Ca 0.00 0.24 -0.25 0.00 -1.82 0.00 0.00 55.36 53.53 1slg s GLN 95 Cb 0.00 0.15 -0.03 0.00 -1.09 0.00 0.00 33.01 32.04 1slg s GLN 95 CO 0.00 -0.05 0.81 -0.47 -1.32 0.00 0.00 175.29 174.26 1slg s TYR 96 N -0.08 3.53 -0.19 9.60 5.04 0.44 -1.31 117.35 134.37 1slg s TYR 96 Ca -0.02 1.34 0.01 0.00 -2.44 0.00 0.00 57.07 55.96 1slg s TYR 96 Cb -0.02 -2.95 0.03 0.00 0.35 0.00 0.00 41.96 39.37 1slg s TYR 96 CO 0.01 -0.06 -0.15 0.08 -1.34 0.00 0.00 175.55 174.08 1slg s VAL 97 N 1.39 1.91 0.54 3.14 1.01 -0.52 -0.83 120.40 127.04 1slg s VAL 97 Ca 0.41 -1.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 1slg s VAL 97 Cb -0.18 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1slg s VAL 97 CO 0.18 0.33 0.82 -0.83 0.00 0.00 0.00 175.10 175.60 1slg s GLY 98 N 1.31 1.59 0.00 4.51 0.00 -1.26 -1.56 107.32 111.90 1slg s GLY 98 Ca 0.01 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 43.94 1slg s GLY 98 CO -0.10 -0.55 0.00 0.61 0.00 0.00 0.00 173.10 173.06 1slg n GLY 99 N -2.40 -0.36 0.07 0.20 0.00 -1.26 -4.87 105.19 96.56 1slg n GLY 99 Ca 0.03 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 1slg n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1slg h ALA 100 N 0.00 -0.05 -2.60 4.61 0.00 -2.06 -3.33 119.26 115.82 1slg h ALA 100 Ca 0.00 -0.13 -0.78 0.00 0.00 0.00 0.00 54.91 54.00 1slg h ALA 100 Cb 0.00 0.02 -0.25 0.00 0.00 0.00 0.00 17.79 17.56 1slg h ALA 100 CO 0.00 -0.40 0.06 -1.21 0.00 0.00 0.00 179.25 177.70 1slg s GLU 101 N -5.16 3.46 0.38 0.00 2.02 -1.26 -5.05 118.70 113.09 1slg s GLU 101 Ca -0.15 -2.24 -0.25 0.00 0.02 0.00 0.00 54.97 52.35 1slg s GLU 101 Cb 0.04 -4.42 -0.09 0.00 0.10 0.00 0.00 34.13 29.76 1slg s GLU 101 CO 0.66 -1.33 1.07 0.00 0.02 0.00 0.00 175.26 175.68 1slg s ALA 102 N 0.64 3.15 0.01 5.21 0.00 -1.25 -4.85 121.76 124.68 1slg s ALA 102 Ca 0.15 0.77 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 1slg s ALA 102 Cb -0.15 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 1slg s ALA 102 CO -0.06 -0.25 -0.00 1.03 0.00 0.00 0.00 175.76 176.48 1slg s ARG 103 N -2.27 0.30 -0.20 0.00 1.81 -0.60 -3.55 118.95 114.44 1slg s ARG 103 Ca 0.55 -0.50 -0.02 0.00 -1.72 0.00 0.00 55.73 54.04 1slg s ARG 103 Cb -0.25 0.11 -0.00 0.00 -0.45 0.00 0.00 34.95 34.36 1slg s ARG 103 CO 0.32 -0.05 -0.10 0.42 -0.68 0.00 0.00 175.30 175.21 1slg s ILE 104 N -1.27 2.97 -0.20 1.52 1.01 -0.31 -1.43 121.20 123.49 1slg s ILE 104 Ca -0.14 -0.64 -0.08 0.00 0.00 0.00 0.00 60.65 59.79 1slg s ILE 104 Cb -0.08 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.02 1slg s ILE 104 CO -0.01 0.47 0.09 0.20 0.00 0.00 0.00 174.94 175.69 1slg s ASN 105 N 1.31 5.78 0.17 3.58 0.01 -0.43 -1.05 114.94 124.31 1slg s ASN 105 Ca 0.04 0.09 0.03 0.00 -0.71 0.00 0.00 52.86 52.30 1slg s ASN 105 Cb -0.14 -2.01 -0.05 0.00 0.41 0.00 0.00 41.25 39.46 1slg s ASN 105 CO -0.05 0.14 -0.04 0.42 -1.51 0.00 0.00 177.10 176.06 1slg s THR 106 N 0.61 0.89 0.07 1.60 -4.23 -0.41 -1.42 115.64 112.75 1slg s THR 106 Ca 0.05 -2.01 0.09 0.00 -1.18 0.00 0.00 61.69 58.64 1slg s THR 106 Cb -0.13 -2.04 -0.03 0.00 1.34 0.00 0.00 72.50 71.65 1slg s THR 106 CO 0.01 -0.57 -0.24 -1.10 -0.54 0.00 0.00 174.62 172.19 1slg s GLN 107 N -3.85 1.45 0.09 3.99 -0.21 -0.57 -2.09 119.66 118.47 1slg s GLN 107 Ca 0.21 -1.12 0.04 0.00 0.02 0.00 0.00 55.36 54.51 1slg s GLN 107 Cb 0.05 -1.69 -0.04 0.00 1.00 0.00 0.00 33.01 32.33 1slg s GLN 107 CO 0.03 0.42 -0.10 1.67 -2.12 0.00 0.00 175.29 175.19 1slg s TRP 108 N -0.93 1.04 -0.10 0.91 1.48 -0.37 -1.11 118.94 119.86 1slg s TRP 108 Ca 0.10 -0.65 0.03 0.00 -1.06 0.00 0.00 56.10 54.52 1slg s TRP 108 Cb -0.10 -0.57 0.01 0.00 -1.16 0.00 0.00 33.47 31.65 1slg s TRP 108 CO 0.03 -0.01 -0.19 -0.51 -4.06 0.00 0.00 176.95 172.21 1slg s LEU 109 N -2.41 1.92 -0.34 -4.66 1.43 -0.59 -1.94 118.68 112.09 1slg s LEU 109 Ca 0.05 -0.49 -0.05 0.00 -1.03 0.00 0.00 54.13 52.61 1slg s LEU 109 Cb -0.03 -1.23 0.05 0.00 0.03 0.00 0.00 46.19 45.01 1slg s LEU 109 CO -0.00 0.09 0.10 -0.22 0.23 0.00 0.00 176.35 176.55 1slg s LEU 110 N 0.63 4.34 -0.16 1.79 0.20 -0.04 -1.90 118.68 123.53 1slg s LEU 110 Ca -0.13 -1.26 -0.07 0.00 0.69 0.00 0.00 54.13 53.36 1slg s LEU 110 Cb -0.16 -1.84 -0.04 0.00 -0.43 0.00 0.00 46.19 43.72 1slg s LEU 110 CO 0.04 -0.34 0.07 -0.89 -0.29 0.00 0.00 176.35 174.93 1slg s THR 111 N 1.35 4.83 0.01 3.68 2.01 -0.21 -1.51 115.64 125.81 1slg s THR 111 Ca -0.02 -0.02 -0.05 0.00 0.31 0.00 0.00 61.69 61.91 1slg s THR 111 Cb -0.20 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 1slg s THR 111 CO 0.01 0.50 0.24 -0.44 -0.69 0.00 0.00 174.62 174.24 1slg s SER 112 N 0.06 6.44 0.04 3.53 0.01 -0.80 -1.61 113.70 121.37 1slg s SER 112 Ca 0.06 0.46 -0.30 0.00 1.31 0.00 0.00 55.95 57.48 1slg s SER 112 Cb -0.12 -2.05 -0.07 0.00 0.21 0.00 0.00 66.02 63.99 1slg s SER 112 CO 0.01 0.24 1.48 -0.83 0.41 0.00 0.00 173.24 174.55 1slg s GLY 113 N -1.86 1.77 0.32 3.44 0.00 -0.04 -4.88 107.32 106.08 1slg s GLY 113 Ca 0.28 1.02 0.03 0.00 0.00 0.00 0.00 44.72 46.05 1slg s GLY 113 CO 0.18 2.61 0.08 -0.51 0.00 0.00 0.00 173.10 175.45 1slg s THR 114 N 2.28 0.95 0.74 0.90 -4.23 -1.26 -5.02 115.64 109.99 1slg s THR 114 Ca 0.67 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 1slg s THR 114 Cb -0.35 -2.69 0.03 0.00 1.34 0.00 0.00 72.50 70.83 1slg s THR 114 CO 0.29 0.00 1.10 0.42 -0.54 0.00 0.00 174.62 175.89 1slg s THR 115 N -3.39 3.26 0.20 3.99 -4.23 -1.26 -4.90 115.64 109.31 1slg s THR 115 Ca 0.35 0.41 -0.13 0.00 -1.18 0.00 0.00 61.69 61.14 1slg s THR 115 Cb 0.08 -3.35 0.17 0.00 1.34 0.00 0.00 72.50 70.73 1slg s THR 115 CO 0.15 -0.54 1.66 -0.08 -0.54 0.00 0.00 174.62 175.28 1slg h GLU 116 N -0.79 0.07 -0.37 3.99 4.81 -2.01 -1.75 114.58 118.54 1slg h GLU 116 Ca -0.45 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 58.84 1slg h GLU 116 Cb 1.26 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1slg h GLU 116 CO 0.63 0.05 0.25 0.00 -0.73 0.00 0.00 179.01 179.21 1slg h ALA 117 N 1.52 2.11 -0.64 2.92 0.00 -2.07 -2.80 119.26 120.29 1slg h ALA 117 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1slg h ALA 117 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1slg h ALA 117 CO -0.50 -0.19 0.00 0.09 0.00 0.00 0.00 179.25 178.65 1slg n ASN 118 N -4.47 4.04 0.15 0.00 3.02 -0.69 -4.52 115.26 112.79 1slg n ASN 118 Ca 0.05 -2.15 0.06 0.00 -0.03 0.00 0.00 54.58 52.50 1slg n ASN 118 Cb 0.31 -0.48 0.53 0.00 -0.61 0.00 0.00 39.78 39.53 1slg n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1slg h ALA 119 N 3.83 1.82 0.00 5.41 0.00 -1.20 -2.17 119.26 126.95 1slg h ALA 119 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1slg h ALA 119 Cb 1.10 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1slg h ALA 119 CO 0.07 0.15 -0.02 0.11 0.00 0.00 0.00 179.25 179.56 1slg h TRP 120 N 0.21 0.00 -0.54 0.00 5.08 -1.81 -1.91 115.95 116.97 1slg h TRP 120 Ca 0.06 0.00 -0.36 0.00 1.08 0.00 0.00 58.89 59.66 1slg h TRP 120 Cb 0.04 0.00 -0.24 0.00 -3.00 0.00 0.00 29.16 25.96 1slg h TRP 120 CO 0.00 0.02 -0.29 0.36 -1.28 0.00 0.00 178.44 177.25 1slg n LYS 121 N -3.38 2.59 0.20 0.12 2.85 -0.82 -4.75 118.16 114.97 1slg n LYS 121 Ca -0.02 -3.59 0.12 0.00 -1.05 0.00 0.00 58.31 53.76 1slg n LYS 121 Cb 0.12 -2.03 0.15 0.00 -0.65 0.00 0.00 35.03 32.63 1slg n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1slg h SER 122 N 1.58 0.00 -3.18 -5.58 4.64 -1.42 -3.47 113.55 106.12 1slg h SER 122 Ca 0.30 -0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.99 1slg h SER 122 Cb 1.42 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 63.16 1slg h SER 122 CO 0.64 0.00 -0.85 -0.89 -0.87 0.00 0.00 176.83 174.87 1slg s THR 123 N -3.23 1.75 0.17 2.95 2.01 -1.26 -1.90 115.64 116.13 1slg s THR 123 Ca 0.06 -0.78 -0.11 0.00 0.31 0.00 0.00 61.69 61.17 1slg s THR 123 Cb 0.06 -1.59 -0.07 0.00 0.01 0.00 0.00 72.50 70.91 1slg s THR 123 CO 0.68 0.49 0.52 -0.76 -0.69 0.00 0.00 174.62 174.86 1slg s LEU 124 N 1.11 4.27 0.04 4.42 1.43 -0.57 -4.92 118.68 124.46 1slg s LEU 124 Ca -0.02 0.95 0.05 0.00 -1.03 0.00 0.00 54.13 54.07 1slg s LEU 124 Cb -0.14 -3.39 -0.02 0.00 0.03 0.00 0.00 46.19 42.67 1slg s LEU 124 CO -0.06 0.04 -0.14 0.54 0.23 0.00 0.00 176.35 176.97 1slg s VAL 125 N -1.60 1.08 0.00 -1.59 0.11 -1.26 -0.87 120.40 116.27 1slg s VAL 125 Ca 0.41 -1.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 1slg s VAL 125 Cb -0.13 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.73 1slg s VAL 125 CO 0.20 -0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.57 1slg n GLY 126 N 1.88 1.73 3.26 6.54 0.00 -0.82 -4.99 105.19 112.81 1slg n GLY 126 Ca -0.18 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 1slg n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1slg s HIS 127 N -5.20 -0.30 0.02 1.61 -3.43 -1.26 -1.24 115.29 105.49 1slg s HIS 127 Ca 0.00 0.62 0.03 0.00 -0.80 0.00 0.00 55.06 54.90 1slg s HIS 127 Cb 0.00 0.13 -0.02 0.00 -1.43 0.00 0.00 32.58 31.27 1slg s HIS 127 CO 0.00 -0.32 -0.09 -0.51 -2.00 0.00 0.00 174.74 171.82 1slg s ASP 128 N -0.69 1.05 -0.13 7.38 1.01 -0.89 -4.97 116.67 119.42 1slg s ASP 128 Ca -0.08 -0.34 0.02 0.00 0.71 0.00 0.00 52.55 52.86 1slg s ASP 128 Cb -0.04 -0.05 0.00 0.00 1.01 0.00 0.00 42.92 43.84 1slg s ASP 128 CO 0.03 -0.02 -0.20 -0.89 0.21 0.00 0.00 175.17 174.30 1slg s THR 129 N -0.72 2.28 -0.14 -1.27 2.01 -1.26 -1.28 115.64 115.26 1slg s THR 129 Ca -0.02 -0.92 -0.04 0.00 0.31 0.00 0.00 61.69 61.03 1slg s THR 129 Cb -0.06 -1.92 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 1slg s THR 129 CO 0.00 0.54 -0.00 -0.36 -0.69 0.00 0.00 174.62 174.12 1slg s PHE 130 N 0.63 3.13 -0.07 4.92 0.08 -0.22 -3.31 117.98 123.14 1slg s PHE 130 Ca -0.11 -0.03 0.01 0.00 0.12 0.00 0.00 56.93 56.92 1slg s PHE 130 Cb -0.16 -1.92 -0.03 0.00 -0.57 0.00 0.00 43.02 40.34 1slg s PHE 130 CO 0.02 0.19 -0.07 0.99 -0.10 0.00 0.00 175.22 176.25 1slg s THR 131 N -0.09 3.66 0.18 0.64 2.01 -0.28 -1.16 115.64 120.60 1slg s THR 131 Ca 0.04 -0.49 -0.14 0.00 0.31 0.00 0.00 61.69 61.40 1slg s THR 131 Cb -0.13 -2.50 -0.07 0.00 0.01 0.00 0.00 72.50 69.81 1slg s THR 131 CO 0.02 0.60 0.59 -0.75 -0.69 0.00 0.00 174.62 174.38 1slg s LYS 132 N -0.77 3.99 0.00 4.92 2.20 -1.23 -1.18 119.74 127.67 1slg s LYS 132 Ca 0.12 0.52 0.00 0.00 -0.36 0.00 0.00 55.97 56.25 1slg s LYS 132 Cb -0.11 -2.84 0.00 0.00 -1.51 0.00 0.00 37.83 33.37 1slg s LYS 132 CO 0.01 0.42 0.00 1.55 -0.36 0.00 0.00 175.35 176.97 1slg n VAL 133 N 0.56 0.00 -3.49 4.02 3.14 -0.06 -4.96 118.33 117.54 1slg n VAL 133 Ca -0.03 0.00 -0.16 0.00 -2.96 0.00 0.00 64.34 61.18 1slg n VAL 133 Cb 0.52 0.26 -0.05 0.00 -1.06 0.00 0.00 33.84 33.51 1slg n VAL 133 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1slg s LYS 134 N -1.45 1.12 0.00 1.45 1.02 -1.23 -4.99 119.74 115.65 1slg s LYS 134 Ca 0.00 0.05 0.23 0.00 0.02 0.00 0.00 55.97 56.28 1slg s LYS 134 Cb 0.00 0.52 1.39 0.00 -0.52 0.00 0.00 37.83 39.22 1slg s LYS 134 CO 0.00 -0.39 1.75 -0.35 -0.92 0.00 0.00 175.35 175.44