#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1srg h GLY 16 N 0.00 -1.42 1.09 0.00 0.00 -2.03 -3.15 103.07 97.55 1srg h GLY 16 Ca 0.00 0.65 -0.14 0.00 0.00 0.00 0.00 47.33 47.84 1srg h GLY 16 CO 0.00 -0.50 -0.30 -2.22 0.00 0.00 0.00 176.54 173.52 1srg h ILE 17 N -0.13 1.28 -2.93 2.60 2.04 -1.99 -3.45 117.51 114.93 1srg h ILE 17 Ca 0.01 -1.47 -0.55 0.00 1.00 0.00 0.00 64.86 63.85 1srg h ILE 17 Cb 0.15 1.32 0.08 0.00 -0.74 0.00 0.00 36.82 37.63 1srg h ILE 17 CO -0.09 0.49 0.80 0.41 0.00 0.00 0.00 178.15 179.77 1srg n THR 18 N -4.13 0.81 -1.36 -0.27 -1.04 -1.19 -4.82 114.28 102.28 1srg n THR 18 Ca -0.02 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.79 1srg n THR 18 Cb 0.50 -1.77 0.00 0.00 -1.82 0.00 0.00 70.33 67.23 1srg n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1srg n GLY 19 N 2.46 0.40 3.54 3.41 0.00 -0.56 -4.86 105.19 109.57 1srg n GLY 19 Ca 0.11 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 1srg n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1srg s THR 20 N -2.82 3.62 0.05 2.61 2.01 -1.26 -1.34 115.64 118.51 1srg s THR 20 Ca 0.00 -0.49 0.02 0.00 0.31 0.00 0.00 61.69 61.53 1srg s THR 20 Cb 0.00 -2.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.98 1srg s THR 20 CO 0.00 0.57 -0.08 0.26 -0.69 0.00 0.00 174.62 174.68 1srg s TRP 21 N -0.45 0.75 0.10 4.92 0.52 -0.42 -0.76 118.94 123.60 1srg s TRP 21 Ca 0.06 -0.58 0.05 0.00 0.02 0.00 0.00 56.10 55.65 1srg s TRP 21 Cb -0.12 -0.44 -0.03 0.00 -1.15 0.00 0.00 33.47 31.72 1srg s TRP 21 CO 0.02 -0.09 -0.12 0.71 0.02 0.00 0.00 176.95 177.49 1srg s TYR 22 N -1.80 1.19 0.55 -1.98 1.51 -0.06 -1.48 117.35 115.28 1srg s TYR 22 Ca -0.05 -0.58 0.06 0.00 -1.01 0.00 0.00 57.07 55.49 1srg s TYR 22 Cb -0.07 -0.64 0.06 0.00 -0.11 0.00 0.00 41.96 41.20 1srg s TYR 22 CO -0.00 0.06 0.54 0.27 -1.11 0.00 0.00 175.55 175.30 1srg n ASN 23 N 0.70 2.48 0.21 2.29 6.94 -0.93 -0.22 115.26 126.74 1srg n ASN 23 Ca -0.17 -2.72 0.15 0.00 -0.02 0.00 0.00 54.58 51.82 1srg n ASN 23 Cb 0.57 -0.18 0.59 0.00 -2.36 0.00 0.00 39.78 38.41 1srg n ASN 23 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 1srg h GLN 24 N 0.00 0.00 -0.00 -3.83 -0.00 -1.91 -1.31 115.11 108.06 1srg h GLN 24 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.34 1srg h GLN 24 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.71 1srg h GLN 24 CO 0.48 0.00 -0.23 1.28 -0.00 0.00 0.00 178.83 180.36 1srg n LEU 25 N -2.72 0.27 0.00 0.06 4.77 -1.26 -4.94 117.00 113.18 1srg n LEU 25 Ca 0.01 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1srg n LEU 25 Cb 0.28 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1srg n LEU 25 CO 0.24 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1srg n GLY 26 N 1.47 0.84 3.81 -0.72 0.00 -0.49 -4.78 105.19 105.32 1srg n GLY 26 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1srg n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1srg s SER 27 N -2.13 5.55 -0.05 1.61 0.01 -1.26 -4.69 113.70 112.74 1srg s SER 27 Ca 0.00 1.74 0.06 0.00 1.31 0.00 0.00 55.95 59.06 1srg s SER 27 Cb 0.00 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.70 1srg s SER 27 CO 0.00 -1.32 -0.25 -0.89 0.41 0.00 0.00 173.24 171.18 1srg s THR 28 N -2.70 2.05 -0.14 1.44 2.01 0.94 -2.19 115.64 117.05 1srg s THR 28 Ca 0.61 -1.07 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1srg s THR 28 Cb -0.15 -1.73 0.02 0.00 0.01 0.00 0.00 72.50 70.64 1srg s THR 28 CO 0.45 0.57 -0.13 0.12 -0.69 0.00 0.00 174.62 174.94 1srg s PHE 29 N -0.20 2.04 -0.19 4.92 5.36 -0.55 0.42 117.98 129.77 1srg s PHE 29 Ca -0.03 -1.12 -0.02 0.00 -0.96 0.00 0.00 56.93 54.80 1srg s PHE 29 Cb -0.13 -1.52 -0.01 0.00 -0.34 0.00 0.00 43.02 41.01 1srg s PHE 29 CO 0.03 -0.63 -0.08 0.42 -1.46 0.00 0.00 175.22 173.50 1srg s ILE 30 N 1.50 3.12 0.02 3.12 1.01 -0.32 -1.30 121.20 128.35 1srg s ILE 30 Ca 0.04 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.11 1srg s ILE 30 Cb -0.13 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 1srg s ILE 30 CO -0.10 0.46 -0.04 0.54 0.00 0.00 0.00 174.94 175.81 1srg s VAL 31 N 1.20 0.19 -0.08 2.92 0.11 -0.45 -1.64 120.40 122.64 1srg s VAL 31 Ca 0.02 -0.96 0.04 0.00 -2.93 0.00 0.00 61.98 58.15 1srg s VAL 31 Cb -0.14 -0.35 -0.00 0.00 -1.53 0.00 0.00 36.38 34.35 1srg s VAL 31 CO -0.03 -0.49 -0.22 -0.89 -3.33 0.00 0.00 175.10 170.14 1srg s THR 32 N -1.52 1.87 -0.33 5.04 2.01 0.21 -1.50 115.64 121.41 1srg s THR 32 Ca -0.14 -0.93 -0.16 0.00 0.31 0.00 0.00 61.69 60.77 1srg s THR 32 Cb -0.09 -1.61 -0.01 0.00 0.01 0.00 0.00 72.50 70.79 1srg s THR 32 CO -0.01 0.52 0.41 0.00 -0.69 0.00 0.00 174.62 174.85 1srg s ALA 33 N 0.22 3.50 0.53 7.40 0.00 -1.26 -2.50 121.76 129.65 1srg s ALA 33 Ca -0.13 -1.09 -0.15 0.00 0.00 0.00 0.00 51.96 50.60 1srg s ALA 33 Cb -0.16 -2.87 -0.07 0.00 0.00 0.00 0.00 23.12 20.02 1srg s ALA 33 CO 0.06 -1.06 0.97 0.20 0.00 0.00 0.00 175.76 175.93 1srg s GLY 34 N 1.73 1.95 0.34 0.00 0.00 -0.04 -4.88 107.32 106.42 1srg s GLY 34 Ca 0.15 0.07 0.26 0.00 0.00 0.00 0.00 44.72 45.20 1srg s GLY 34 CO 0.12 0.34 1.78 0.00 0.00 0.00 0.00 173.10 175.33 1srg h ALA 35 N 0.64 1.00 -0.28 3.20 0.00 -1.98 -1.51 119.26 120.34 1srg h ALA 35 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1srg h ALA 35 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1srg h ALA 35 CO 0.62 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.47 1srg n ASP 36 N -2.41 1.97 0.00 0.00 5.75 -1.26 -4.92 116.55 115.68 1srg n ASP 36 Ca 0.01 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 1srg n ASP 36 Cb 0.18 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1srg n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1srg n GLY 37 N 1.16 0.57 3.78 6.12 0.00 -0.57 -5.00 105.19 111.25 1srg n GLY 37 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1srg n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1srg s ALA 38 N -2.31 3.19 -0.07 4.61 0.00 -1.25 -1.05 121.76 124.88 1srg s ALA 38 Ca 0.00 0.55 0.05 0.00 0.00 0.00 0.00 51.96 52.56 1srg s ALA 38 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 1srg s ALA 38 CO 0.00 0.12 -0.23 -0.51 0.00 0.00 0.00 175.76 175.14 1srg s LEU 39 N -2.15 2.15 0.01 0.00 1.43 0.09 -0.86 118.68 119.36 1srg s LEU 39 Ca 0.51 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 53.11 1srg s LEU 39 Cb -0.19 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.61 1srg s LEU 39 CO 0.24 0.23 -0.01 0.42 0.23 0.00 0.00 176.35 177.46 1srg s THR 40 N -0.06 0.09 -2.92 5.49 -4.23 -1.04 -1.31 115.64 111.66 1srg s THR 40 Ca -0.06 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1srg s THR 40 Cb -0.15 -0.25 0.00 0.00 1.34 0.00 0.00 72.50 73.44 1srg s THR 40 CO 0.05 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 1srg n GLY 41 N 1.77 -0.56 3.03 3.99 0.00 -1.20 -0.62 105.19 111.60 1srg n GLY 41 Ca -0.22 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 44.90 1srg n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1srg s THR 42 N -3.34 0.35 -0.08 2.61 -4.23 -0.65 -1.72 115.64 108.58 1srg s THR 42 Ca 0.00 -1.04 0.04 0.00 -1.18 0.00 0.00 61.69 59.51 1srg s THR 42 Cb 0.00 -0.49 -0.01 0.00 1.34 0.00 0.00 72.50 73.33 1srg s THR 42 CO 0.00 -0.45 -0.20 -0.47 -0.54 0.00 0.00 174.62 172.96 1srg s TYR 43 N -1.50 2.61 -0.28 3.99 6.14 0.71 -1.18 117.35 127.83 1srg s TYR 43 Ca -0.12 -0.64 0.03 0.00 0.64 0.00 0.00 57.07 56.98 1srg s TYR 43 Cb -0.09 -1.69 0.07 0.00 0.42 0.00 0.00 41.96 40.67 1srg s TYR 43 CO -0.00 -0.17 -0.06 -1.21 0.64 0.00 0.00 175.55 174.74 1srg s GLU 44 N -0.06 2.07 0.14 4.97 2.02 0.17 -0.80 118.70 127.21 1srg s GLU 44 Ca -0.05 -1.47 -0.23 0.00 0.02 0.00 0.00 54.97 53.24 1srg s GLU 44 Cb -0.14 -2.99 -0.08 0.00 0.10 0.00 0.00 34.13 31.02 1srg s GLU 44 CO 0.04 -0.66 0.70 0.45 0.02 0.00 0.00 175.26 175.81 1srg s SER 45 N 1.07 7.24 0.04 -0.19 0.15 -1.26 -0.04 113.70 120.71 1srg s SER 45 Ca -0.04 1.48 0.22 0.00 0.70 0.00 0.00 55.95 58.32 1srg s SER 45 Cb -0.20 -2.44 -0.07 0.00 -1.71 0.00 0.00 66.02 61.60 1srg s SER 45 CO -0.05 0.21 0.90 0.00 1.20 0.00 0.00 173.24 175.50 1srg n ALA 46 N 1.54 3.41 -2.31 5.45 0.00 -1.26 -4.85 120.51 122.48 1srg n ALA 46 Ca -0.07 -0.44 -0.16 0.00 0.00 0.00 0.00 53.44 52.76 1srg n ALA 46 Cb 0.50 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 18.94 1srg n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1srg s VAL 47 N -3.25 0.91 0.00 0.00 -7.23 -1.26 -5.03 120.40 104.54 1srg s VAL 47 Ca 0.02 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1srg s VAL 47 Cb 0.14 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.73 1srg s VAL 47 CO 0.83 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.93 1srg n GLY 48 N -0.40 -1.78 2.41 2.32 0.00 -1.26 -4.37 105.19 102.11 1srg n GLY 48 Ca -0.05 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.98 1srg n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1srg n ASN 49 N 0.23 7.62 -4.93 1.61 4.05 -1.26 -4.95 115.26 117.63 1srg n ASN 49 Ca 0.00 -2.99 -0.27 0.00 0.45 0.00 0.00 54.58 51.77 1srg n ASN 49 Cb 0.00 -1.38 -0.03 0.00 1.23 0.00 0.00 39.78 39.60 1srg n ASN 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1srg s ALA 50 N -0.46 3.86 -0.30 5.20 0.00 -1.26 -4.68 121.76 124.12 1srg s ALA 50 Ca 0.59 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 51.51 1srg s ALA 50 Cb 0.24 -1.94 0.19 0.00 0.00 0.00 0.00 23.12 21.61 1srg s ALA 50 CO -0.11 0.45 1.18 -1.83 0.00 0.00 0.00 175.76 175.45 1srg s GLU 51 N -3.34 0.14 1.78 0.00 -1.05 -1.26 -5.07 118.70 109.90 1srg s GLU 51 Ca 0.37 0.24 0.00 0.00 -0.15 0.00 0.00 54.97 55.44 1srg s GLU 51 Cb -0.11 0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.61 1srg s GLU 51 CO 0.29 -0.03 0.00 0.45 0.95 0.00 0.00 175.26 176.92 1srg n SER 52 N 3.31 -2.66 -4.95 0.83 2.88 -1.26 -4.75 113.62 107.03 1srg n SER 52 Ca -0.17 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.13 1srg n SER 52 Cb 0.57 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.00 1srg n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1srg s ARG 53 N 0.00 3.47 0.07 -1.46 1.70 -1.26 -4.45 118.95 117.03 1srg s ARG 53 Ca 0.00 -0.51 0.06 0.00 -0.47 0.00 0.00 55.73 54.81 1srg s ARG 53 Cb 0.00 -2.81 -0.03 0.00 -0.57 0.00 0.00 34.95 31.54 1srg s ARG 53 CO 0.00 0.34 -0.17 0.71 -1.08 0.00 0.00 175.30 175.10 1srg s TYR 54 N -2.03 1.47 0.31 5.89 1.51 0.02 -4.85 117.35 119.67 1srg s TYR 54 Ca 0.37 -0.42 -0.29 0.00 -1.01 0.00 0.00 57.07 55.72 1srg s TYR 54 Cb -0.10 -0.83 -0.10 0.00 -0.11 0.00 0.00 41.96 40.82 1srg s TYR 54 CO 0.31 0.11 1.17 0.08 -1.11 0.00 0.00 175.55 176.11 1srg s VAL 55 N -1.12 3.23 0.22 0.71 1.01 -1.26 -0.21 120.40 122.98 1srg s VAL 55 Ca 0.02 1.21 0.09 0.00 0.00 0.00 0.00 61.98 63.30 1srg s VAL 55 Cb -0.10 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.48 1srg s VAL 55 CO 0.03 0.26 -0.16 -1.48 0.00 0.00 0.00 175.10 173.75 1srg s LEU 56 N -1.71 2.56 -0.15 3.92 0.05 -0.70 -4.43 118.68 118.22 1srg s LEU 56 Ca 0.48 -1.02 -0.17 0.00 0.05 0.00 0.00 54.13 53.47 1srg s LEU 56 Cb -0.34 -0.78 0.04 0.00 -2.05 0.00 0.00 46.19 43.07 1srg s LEU 56 CO 0.44 -0.11 0.46 0.28 -0.55 0.00 0.00 176.35 176.87 1srg s THR 57 N -2.83 0.01 0.00 5.48 -1.32 -1.04 -3.26 115.64 112.68 1srg s THR 57 Ca 0.24 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.66 1srg s THR 57 Cb -0.02 -0.68 0.00 0.00 -1.51 0.00 0.00 72.50 70.30 1srg s THR 57 CO 0.09 -0.03 0.00 0.61 -2.21 0.00 0.00 174.62 173.07 1srg n GLY 58 N 2.51 1.91 3.09 6.08 0.00 -0.43 -1.42 105.19 116.93 1srg n GLY 58 Ca -0.15 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.84 1srg n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1srg s ARG 59 N -1.64 0.60 0.12 1.61 1.81 -0.54 -0.73 118.95 120.18 1srg s ARG 59 Ca 0.00 -1.07 -0.08 0.00 -1.72 0.00 0.00 55.73 52.86 1srg s ARG 59 Cb 0.00 0.22 -0.01 0.00 -0.45 0.00 0.00 34.95 34.71 1srg s ARG 59 CO 0.00 -0.12 0.21 1.52 -0.68 0.00 0.00 175.30 176.22 1srg s TYR 60 N -3.49 0.29 -0.41 -0.53 1.13 -0.22 -1.42 117.35 112.71 1srg s TYR 60 Ca 0.03 -0.70 -0.29 0.00 -1.41 0.00 0.00 57.07 54.70 1srg s TYR 60 Cb 0.05 -0.09 0.01 0.00 -1.10 0.00 0.00 41.96 40.82 1srg s TYR 60 CO -0.09 -0.60 1.33 0.34 -2.51 0.00 0.00 175.55 174.02 1srg s ASP 61 N -2.91 6.47 0.00 -0.18 2.15 -0.17 -4.66 116.67 117.36 1srg s ASP 61 Ca 0.10 0.82 0.19 0.00 0.43 0.00 0.00 52.55 54.10 1srg s ASP 61 Cb 0.05 -2.54 0.85 0.00 -0.30 0.00 0.00 42.92 40.98 1srg s ASP 61 CO -0.06 -1.32 1.59 -1.54 -0.17 0.00 0.00 175.17 173.66 1srg n SER 62 N 8.37 1.04 -3.01 -0.34 3.41 -1.26 -4.01 113.62 117.82 1srg n SER 62 Ca 0.15 -1.62 -0.17 0.00 -0.26 0.00 0.00 58.87 56.98 1srg n SER 62 Cb 0.48 -0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 64.35 1srg n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1srg n ALA 63 N -0.09 0.91 -0.92 7.33 0.00 -1.26 -5.03 120.51 121.45 1srg n ALA 63 Ca 0.15 -2.62 -0.29 0.00 0.00 0.00 0.00 53.44 50.68 1srg n ALA 63 Cb 0.23 -1.02 0.22 0.00 0.00 0.00 0.00 19.45 18.88 1srg n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1srg s PRO 64 N -0.76 -0.71 0.00 0.00 0.04 -1.26 -5.17 135.00 127.14 1srg s PRO 64 Ca 0.33 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.76 1srg s PRO 64 Cb 0.24 -1.62 0.00 0.00 0.04 0.00 0.00 34.50 33.16 1srg s PRO 64 CO -0.13 -3.47 0.06 0.00 0.04 0.00 0.00 177.00 173.50 1srg n ALA 65 N -4.67 0.00 -0.07 8.56 0.00 -1.26 -5.16 120.51 117.91 1srg n ALA 65 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1srg n ALA 65 Cb 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.02 1srg n ALA 65 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1srg n SER 69 N -0.25 -0.40 -4.66 0.00 7.64 -1.26 -5.06 113.62 109.63 1srg n SER 69 Ca 0.00 0.08 -0.29 0.00 1.01 0.00 0.00 58.87 59.67 1srg n SER 69 Cb 0.00 0.33 0.14 0.00 -1.01 0.00 0.00 64.21 63.67 1srg n SER 69 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1srg s GLY 70 N -3.53 1.61 -0.25 0.23 0.00 -1.26 -5.00 107.32 99.12 1srg s GLY 70 Ca 0.00 -0.68 -0.07 0.00 0.00 0.00 0.00 44.72 43.97 1srg s GLY 70 CO 0.00 -0.08 0.08 -1.59 0.00 0.00 0.00 173.10 171.50 1srg s THR 71 N -3.42 4.36 0.32 0.90 2.01 -0.35 -4.89 115.64 114.57 1srg s THR 71 Ca 0.65 -0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.21 1srg s THR 71 Cb -0.12 -3.04 -0.10 0.00 0.01 0.00 0.00 72.50 69.25 1srg s THR 71 CO 0.52 0.34 1.22 0.00 -0.69 0.00 0.00 174.62 176.01 1srg s ALA 72 N 1.62 3.43 0.28 7.40 0.00 -1.26 -0.49 121.76 132.74 1srg s ALA 72 Ca 0.06 1.11 -0.19 0.00 0.00 0.00 0.00 51.96 52.94 1srg s ALA 72 Cb -0.15 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.57 1srg s ALA 72 CO 0.04 -0.47 0.68 -0.48 0.00 0.00 0.00 175.76 175.53 1srg s LEU 73 N -1.75 -0.15 0.04 0.00 2.34 -0.51 -1.00 118.68 117.64 1srg s LEU 73 Ca 0.48 -0.68 -0.27 0.00 0.06 0.00 0.00 54.13 53.72 1srg s LEU 73 Cb -0.36 2.58 0.08 0.00 -0.56 0.00 0.00 46.19 47.93 1srg s LEU 73 CO 0.48 -1.33 0.71 -0.83 -1.06 0.00 0.00 176.35 174.32 1srg s GLY 74 N -2.94 -0.55 0.18 -3.48 0.00 -0.51 -1.37 107.32 98.65 1srg s GLY 74 Ca 0.13 0.97 -0.16 0.00 0.00 0.00 0.00 44.72 45.66 1srg s GLY 74 CO 0.08 0.50 0.46 0.66 0.00 0.00 0.00 173.10 174.79 1srg s TRP 75 N -2.66 -0.04 0.06 1.90 -2.14 -0.54 -1.46 118.94 114.05 1srg s TRP 75 Ca -0.02 -0.30 0.05 0.00 2.66 0.00 0.00 56.10 58.49 1srg s TRP 75 Cb -0.01 0.29 -0.03 0.00 -3.10 0.00 0.00 33.47 30.62 1srg s TRP 75 CO -0.04 -0.84 -0.15 0.99 -2.66 0.00 0.00 176.95 174.25 1srg s THR 76 N -3.88 1.19 -0.07 0.66 2.01 -0.51 -0.77 115.64 114.28 1srg s THR 76 Ca 0.09 -1.16 0.01 0.00 0.31 0.00 0.00 61.69 60.94 1srg s THR 76 Cb 0.00 -1.10 0.02 0.00 0.01 0.00 0.00 72.50 71.43 1srg s THR 76 CO -0.04 -0.07 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.05 1srg s VAL 77 N -1.02 0.91 -0.17 3.82 1.01 -0.69 -2.50 120.40 121.75 1srg s VAL 77 Ca 0.01 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.57 1srg s VAL 77 Cb -0.09 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1srg s VAL 77 CO 0.02 0.32 0.23 0.00 0.00 0.00 0.00 175.10 175.67 1srg s ALA 78 N 1.09 3.63 -1.44 5.51 0.00 -1.26 -1.09 121.76 128.20 1srg s ALA 78 Ca -0.07 -0.54 -0.09 0.00 0.00 0.00 0.00 51.96 51.26 1srg s ALA 78 Cb -0.14 -2.31 0.05 0.00 0.00 0.00 0.00 23.12 20.72 1srg s ALA 78 CO -0.01 0.13 2.47 0.91 0.00 0.00 0.00 175.76 179.26 1srg n TRP 79 N 3.50 2.74 -3.86 0.00 7.02 -0.37 -4.78 117.44 121.69 1srg n TRP 79 Ca -0.13 -2.93 -0.20 0.00 -1.02 0.00 0.00 57.50 53.21 1srg n TRP 79 Cb 0.52 -2.19 -0.17 0.00 -2.42 0.00 0.00 31.31 27.05 1srg n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1srg s LYS 80 N 0.92 0.39 0.00 -0.99 2.47 -1.26 -1.03 119.74 120.24 1srg s LYS 80 Ca 0.56 0.12 0.00 0.00 -1.56 0.00 0.00 55.97 55.08 1srg s LYS 80 Cb 0.16 -0.68 0.00 0.00 -1.46 0.00 0.00 37.83 35.85 1srg s LYS 80 CO -0.06 -0.21 0.00 0.27 0.16 0.00 0.00 175.35 175.50 1srg n ASN 81 N 4.64 0.55 0.06 1.43 0.23 -0.45 -4.77 115.26 116.95 1srg n ASN 81 Ca -0.16 -0.35 0.10 0.00 -0.53 0.00 0.00 54.58 53.64 1srg n ASN 81 Cb 0.50 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.62 1srg n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1srg n ASN 82 N -0.85 0.34 -0.06 0.53 3.02 -1.26 -3.76 115.26 113.22 1srg n ASN 82 Ca 0.00 0.57 -0.08 0.00 -0.03 0.00 0.00 54.58 55.05 1srg n ASN 82 Cb 0.00 -0.65 -0.07 0.00 -0.61 0.00 0.00 39.78 38.45 1srg n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1srg n TYR 83 N -1.87 0.00 -4.05 3.10 4.01 -1.26 -5.08 117.16 112.01 1srg n TYR 83 Ca 0.03 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.70 1srg n TYR 83 Cb 0.23 -0.53 -0.10 0.00 -0.31 0.00 0.00 39.34 38.63 1srg n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1srg s ARG 84 N -2.27 0.65 -0.12 -0.72 0.52 -1.25 -5.09 118.95 110.68 1srg s ARG 84 Ca -0.13 -1.18 -0.04 0.00 -0.52 0.00 0.00 55.73 53.87 1srg s ARG 84 Cb 0.04 0.23 0.05 0.00 0.52 0.00 0.00 34.95 35.80 1srg s ARG 84 CO 0.37 -0.14 0.11 1.21 0.02 0.00 0.00 175.30 176.87 1srg s ASN 85 N -2.91 1.53 0.00 0.23 3.84 -1.26 -1.35 114.94 115.03 1srg s ASN 85 Ca 0.07 -0.16 0.24 0.00 0.21 0.00 0.00 52.86 53.22 1srg s ASN 85 Cb 0.07 -0.04 0.34 0.00 -0.55 0.00 0.00 41.25 41.08 1srg s ASN 85 CO -0.10 -0.29 1.31 0.00 -2.79 0.00 0.00 177.10 175.22 1srg n ALA 86 N 5.30 3.29 -3.59 1.71 0.00 -0.19 -4.98 120.51 122.04 1srg n ALA 86 Ca -0.05 -0.55 -0.23 0.00 0.00 0.00 0.00 53.44 52.62 1srg n ALA 86 Cb 0.50 -0.94 0.05 0.00 0.00 0.00 0.00 19.45 19.05 1srg n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1srg n HIS 87 N -0.19 -2.03 -3.52 0.00 8.25 -1.26 -4.84 115.22 111.62 1srg n HIS 87 Ca 0.11 0.74 -0.11 0.00 -0.26 0.00 0.00 57.72 58.20 1srg n HIS 87 Cb 0.42 -4.11 -0.02 0.00 1.12 0.00 0.00 29.99 27.41 1srg n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1srg s SER 88 N -3.92 -0.48 -0.04 0.41 1.04 -1.26 -1.12 113.70 108.32 1srg s SER 88 Ca 0.22 -0.14 -0.09 0.00 0.48 0.00 0.00 55.95 56.41 1srg s SER 88 Cb -0.06 0.61 0.02 0.00 0.10 0.00 0.00 66.02 66.69 1srg s SER 88 CO 0.81 -1.03 0.22 0.00 0.98 0.00 0.00 173.24 174.22 1srg s ALA 89 N -3.79 -0.55 -0.02 5.32 0.00 -0.63 -1.23 121.76 120.85 1srg s ALA 89 Ca 0.03 0.33 0.07 0.00 0.00 0.00 0.00 51.96 52.39 1srg s ALA 89 Cb -0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 1srg s ALA 89 CO -0.09 -0.18 -0.21 0.99 0.00 0.00 0.00 175.76 176.27 1srg s THR 90 N -0.69 2.46 -0.09 0.00 2.01 -0.25 -0.78 115.64 118.30 1srg s THR 90 Ca -0.08 -1.00 0.04 0.00 0.31 0.00 0.00 61.69 60.96 1srg s THR 90 Cb -0.04 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.55 1srg s THR 90 CO 0.02 0.55 -0.22 0.42 -0.69 0.00 0.00 174.62 174.70 1srg s THR 91 N -0.69 2.26 -0.11 -0.82 -4.23 -0.43 -1.71 115.64 109.93 1srg s THR 91 Ca 0.11 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 1srg s THR 91 Cb -0.10 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.85 1srg s THR 91 CO 0.00 0.56 -0.10 0.26 -0.54 0.00 0.00 174.62 174.80 1srg s TRP 92 N 0.09 2.86 -0.10 3.99 0.51 0.05 -1.30 118.94 125.04 1srg s TRP 92 Ca -0.10 -0.34 0.03 0.00 -2.12 0.00 0.00 56.10 53.56 1srg s TRP 92 Cb -0.16 -1.80 0.01 0.00 -0.81 0.00 0.00 33.47 30.71 1srg s TRP 92 CO 0.06 0.01 -0.20 0.45 -0.51 0.00 0.00 176.95 176.76 1srg s SER 93 N -0.10 2.72 0.00 2.95 0.15 -0.25 -1.47 113.70 117.69 1srg s SER 93 Ca -0.01 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.15 1srg s SER 93 Cb -0.14 -1.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.93 1srg s SER 93 CO 0.03 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.18 1srg n GLY 94 N 3.76 1.72 3.00 9.45 0.00 -0.47 -1.39 105.19 121.24 1srg n GLY 94 Ca -0.20 -0.58 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 1srg n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1srg s GLN 95 N 1.24 0.33 -0.08 1.61 -2.07 -0.74 -1.43 119.66 118.52 1srg s GLN 95 Ca 0.00 -0.53 -0.14 0.00 -1.82 0.00 0.00 55.36 52.87 1srg s GLN 95 Cb 0.00 0.12 -0.05 0.00 -1.09 0.00 0.00 33.01 31.99 1srg s GLN 95 CO 0.00 -0.06 0.34 -0.47 -1.32 0.00 0.00 175.29 173.78 1srg s TYR 96 N -1.36 3.60 -0.18 9.60 5.04 0.36 -1.53 117.35 132.89 1srg s TYR 96 Ca -0.15 0.79 -0.00 0.00 -2.44 0.00 0.00 57.07 55.27 1srg s TYR 96 Cb -0.09 -2.29 0.04 0.00 0.35 0.00 0.00 41.96 39.97 1srg s TYR 96 CO -0.00 0.47 -0.06 0.08 -1.34 0.00 0.00 175.55 174.70 1srg s VAL 97 N -0.38 1.23 0.70 3.14 1.01 0.94 -1.22 120.40 125.83 1srg s VAL 97 Ca 0.21 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.38 1srg s VAL 97 Cb -0.15 -1.39 0.05 0.00 0.00 0.00 0.00 36.38 34.89 1srg s VAL 97 CO 0.09 0.13 1.03 -0.83 0.00 0.00 0.00 175.10 175.52 1srg s GLY 98 N 1.58 1.65 0.00 4.51 0.00 -1.26 -1.33 107.32 112.47 1srg s GLY 98 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 43.93 1srg s GLY 98 CO -0.08 -0.39 0.00 0.61 0.00 0.00 0.00 173.10 173.24 1srg n GLY 99 N -2.94 0.39 0.08 0.20 0.00 -1.26 -4.81 105.19 96.85 1srg n GLY 99 Ca 0.07 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.38 1srg n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1srg h ALA 100 N 0.00 0.11 -2.99 4.61 0.00 -2.07 -3.32 119.26 115.60 1srg h ALA 100 Ca 0.00 0.03 -0.74 0.00 0.00 0.00 0.00 54.91 54.20 1srg h ALA 100 Cb 0.00 0.05 -0.31 0.00 0.00 0.00 0.00 17.79 17.53 1srg h ALA 100 CO 0.00 -0.45 -0.14 -1.83 0.00 0.00 0.00 179.25 176.83 1srg s GLU 101 N -6.19 3.06 0.23 0.00 -1.05 -1.26 -5.06 118.70 108.43 1srg s GLU 101 Ca -0.13 -2.50 -0.30 0.00 -0.15 0.00 0.00 54.97 51.89 1srg s GLU 101 Cb 0.08 -4.07 -0.09 0.00 -0.44 0.00 0.00 34.13 29.61 1srg s GLU 101 CO 0.68 -1.23 1.33 0.00 0.95 0.00 0.00 175.26 176.99 1srg s ALA 102 N 0.05 3.54 0.01 -0.84 0.00 -1.25 -4.84 121.76 118.44 1srg s ALA 102 Ca 0.17 1.17 -0.06 0.00 0.00 0.00 0.00 51.96 53.25 1srg s ALA 102 Cb -0.16 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.47 1srg s ALA 102 CO -0.06 -0.59 0.11 1.03 0.00 0.00 0.00 175.76 176.25 1srg s ARG 103 N -0.47 0.49 -0.24 0.00 0.52 -0.44 -3.51 118.95 115.29 1srg s ARG 103 Ca 0.56 -0.51 0.02 0.00 -0.52 0.00 0.00 55.73 55.27 1srg s ARG 103 Cb -0.38 0.20 0.05 0.00 0.52 0.00 0.00 34.95 35.33 1srg s ARG 103 CO 0.42 -0.11 -0.13 0.42 0.02 0.00 0.00 175.30 175.92 1srg s ILE 104 N -1.69 2.22 -0.22 1.52 1.01 -0.86 -0.04 121.20 123.14 1srg s ILE 104 Ca -0.13 -1.42 -0.12 0.00 0.00 0.00 0.00 60.65 58.99 1srg s ILE 104 Cb -0.06 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.15 1srg s ILE 104 CO -0.00 0.12 0.20 0.20 0.00 0.00 0.00 174.94 175.46 1srg s ASN 105 N 1.17 6.21 0.19 3.58 0.01 -0.58 -0.81 114.94 124.70 1srg s ASN 105 Ca -0.05 0.23 0.02 0.00 -0.71 0.00 0.00 52.86 52.35 1srg s ASN 105 Cb -0.18 -2.13 -0.05 0.00 0.41 0.00 0.00 41.25 39.30 1srg s ASN 105 CO -0.07 0.07 0.01 0.42 -1.51 0.00 0.00 177.10 176.03 1srg s THR 106 N 0.89 0.66 0.13 1.60 -4.23 -0.28 -1.80 115.64 112.62 1srg s THR 106 Ca 0.10 -1.98 0.09 0.00 -1.18 0.00 0.00 61.69 58.72 1srg s THR 106 Cb -0.13 -2.19 -0.04 0.00 1.34 0.00 0.00 72.50 71.48 1srg s THR 106 CO 0.04 -0.41 -0.21 -1.10 -0.54 0.00 0.00 174.62 172.40 1srg s GLN 107 N -3.93 1.23 0.07 3.99 -0.21 -0.49 -2.19 119.66 118.13 1srg s GLN 107 Ca 0.26 -1.28 0.00 0.00 0.02 0.00 0.00 55.36 54.36 1srg s GLN 107 Cb 0.06 -1.47 -0.04 0.00 1.00 0.00 0.00 33.01 32.57 1srg s GLN 107 CO 0.05 0.33 -0.04 1.67 -2.12 0.00 0.00 175.29 175.18 1srg s TRP 108 N -1.44 0.70 -0.06 0.91 1.48 -0.29 -1.10 118.94 119.14 1srg s TRP 108 Ca 0.11 -1.01 0.02 0.00 -1.06 0.00 0.00 56.10 54.17 1srg s TRP 108 Cb -0.09 -0.45 0.01 0.00 -1.16 0.00 0.00 33.47 31.79 1srg s TRP 108 CO 0.06 -0.28 -0.11 -0.51 -4.06 0.00 0.00 176.95 172.04 1srg s LEU 109 N -2.98 1.63 -0.28 -4.66 1.43 -0.42 -2.00 118.68 111.40 1srg s LEU 109 Ca 0.10 -0.27 -0.02 0.00 -1.03 0.00 0.00 54.13 52.91 1srg s LEU 109 Cb 0.07 -0.76 0.04 0.00 0.03 0.00 0.00 46.19 45.57 1srg s LEU 109 CO -0.07 0.03 -0.02 -0.22 0.23 0.00 0.00 176.35 176.30 1srg s LEU 110 N 0.62 3.64 -0.12 1.79 2.96 -0.37 -1.31 118.68 125.90 1srg s LEU 110 Ca -0.13 -1.12 -0.03 0.00 -0.22 0.00 0.00 54.13 52.64 1srg s LEU 110 Cb -0.15 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 1srg s LEU 110 CO 0.03 -0.21 -0.01 -0.89 -1.32 0.00 0.00 176.35 173.95 1srg s THR 111 N 1.28 4.15 -0.01 3.68 2.01 0.04 -1.26 115.64 125.53 1srg s THR 111 Ca -0.03 -0.29 -0.02 0.00 0.31 0.00 0.00 61.69 61.66 1srg s THR 111 Cb -0.19 -2.78 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 1srg s THR 111 CO -0.02 0.55 0.13 -0.44 -0.69 0.00 0.00 174.62 174.14 1srg s SER 112 N -0.28 6.01 0.14 3.53 0.01 -0.40 -1.61 113.70 121.10 1srg s SER 112 Ca 0.06 0.24 -0.30 0.00 1.31 0.00 0.00 55.95 57.26 1srg s SER 112 Cb -0.12 -1.81 -0.07 0.00 0.21 0.00 0.00 66.02 64.23 1srg s SER 112 CO 0.02 0.27 1.15 -0.83 0.41 0.00 0.00 173.24 174.26 1srg s GLY 113 N -1.81 2.69 0.20 3.44 0.00 -0.27 -4.86 107.32 106.71 1srg s GLY 113 Ca 0.25 0.85 -0.01 0.00 0.00 0.00 0.00 44.72 45.80 1srg s GLY 113 CO 0.16 1.81 0.14 -0.51 0.00 0.00 0.00 173.10 174.70 1srg s THR 114 N 0.20 0.00 0.89 0.90 -4.23 -1.26 -5.01 115.64 107.13 1srg s THR 114 Ca 0.53 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.93 1srg s THR 114 Cb -0.30 -2.49 0.13 0.00 1.34 0.00 0.00 72.50 71.17 1srg s THR 114 CO 0.33 0.00 1.15 0.42 -0.54 0.00 0.00 174.62 175.98 1srg s THR 115 N -4.14 2.00 0.26 3.99 -4.23 -1.26 -4.86 115.64 107.40 1srg s THR 115 Ca 0.39 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.85 1srg s THR 115 Cb 0.07 -2.80 0.25 0.00 1.34 0.00 0.00 72.50 71.36 1srg s THR 115 CO 0.12 -0.00 1.93 -0.33 -0.54 0.00 0.00 174.62 175.80 1srg h GLU 116 N -1.42 1.23 0.00 3.99 4.39 -2.01 -2.34 114.58 118.42 1srg h GLU 116 Ca -0.50 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.08 1srg h GLU 116 Cb 1.33 -0.27 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 1srg h GLU 116 CO 0.63 0.83 -0.18 0.00 -1.16 0.00 0.00 179.01 179.13 1srg h ALA 117 N 1.39 1.34 -0.05 3.43 0.00 -2.07 -2.98 119.26 120.32 1srg h ALA 117 Ca 0.34 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1srg h ALA 117 Cb -0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1srg h ALA 117 CO -0.07 0.23 0.00 0.09 0.00 0.00 0.00 179.25 179.50 1srg n ASN 118 N -3.80 2.52 0.18 0.00 3.02 -0.94 -4.63 115.26 111.61 1srg n ASN 118 Ca -0.02 -1.75 0.10 0.00 -0.03 0.00 0.00 54.58 52.88 1srg n ASN 118 Cb 0.29 -0.02 0.62 0.00 -0.61 0.00 0.00 39.78 40.06 1srg n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1srg h ALA 119 N 3.44 2.05 0.00 5.41 0.00 -1.27 -1.55 119.26 127.33 1srg h ALA 119 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1srg h ALA 119 Cb 0.74 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1srg h ALA 119 CO 0.00 -0.08 -0.05 0.11 0.00 0.00 0.00 179.25 179.23 1srg h TRP 120 N 0.07 0.00 -0.67 0.00 5.08 -1.82 -2.45 115.95 116.17 1srg h TRP 120 Ca 0.06 0.00 -0.45 0.00 1.08 0.00 0.00 58.89 59.58 1srg h TRP 120 Cb 0.17 0.00 -0.29 0.00 -3.00 0.00 0.00 29.16 26.04 1srg h TRP 120 CO -0.00 0.05 -0.20 0.36 -1.28 0.00 0.00 178.44 177.37 1srg n LYS 121 N -3.83 2.80 0.00 0.12 0.00 -0.58 -4.72 118.16 111.95 1srg n LYS 121 Ca -0.03 -3.65 0.11 0.00 -0.00 0.00 0.00 58.31 54.75 1srg n LYS 121 Cb 0.14 -2.12 0.16 0.00 -0.00 0.00 0.00 35.03 33.20 1srg n LYS 121 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1srg n SER 122 N -0.90 0.63 -3.96 -5.58 3.41 -0.92 -4.90 113.62 101.39 1srg n SER 122 Ca 0.45 -0.43 -0.27 0.00 -0.26 0.00 0.00 58.87 58.35 1srg n SER 122 Cb 0.92 0.44 -0.17 0.00 -0.26 0.00 0.00 64.21 65.14 1srg n SER 122 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1srg s THR 123 N -3.00 1.19 0.20 6.66 2.01 -1.26 -1.28 115.64 120.16 1srg s THR 123 Ca 0.10 -0.42 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 1srg s THR 123 Cb 0.17 -1.15 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 1srg s THR 123 CO 0.74 0.39 0.43 -0.76 -0.69 0.00 0.00 174.62 174.73 1srg s LEU 124 N 1.43 4.20 0.07 4.42 1.43 -0.39 -4.93 118.68 124.91 1srg s LEU 124 Ca 0.01 0.55 0.06 0.00 -1.03 0.00 0.00 54.13 53.72 1srg s LEU 124 Cb -0.13 -3.32 -0.03 0.00 0.03 0.00 0.00 46.19 42.74 1srg s LEU 124 CO -0.06 -0.05 -0.17 0.54 0.23 0.00 0.00 176.35 176.84 1srg s VAL 125 N -1.84 1.39 0.08 -1.59 0.11 -1.26 -1.23 120.40 116.06 1srg s VAL 125 Ca 0.41 -1.29 -0.04 0.00 -2.93 0.00 0.00 61.98 58.13 1srg s VAL 125 Cb -0.11 -1.27 0.01 0.00 -1.53 0.00 0.00 36.38 33.48 1srg s VAL 125 CO 0.27 -0.05 0.19 0.61 -3.33 0.00 0.00 175.10 172.79 1srg n GLY 126 N 1.45 1.65 3.01 6.54 0.00 -0.85 -4.99 105.19 112.01 1srg n GLY 126 Ca -0.19 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1srg n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1srg s HIS 127 N -7.03 -0.09 0.03 1.61 -3.43 -1.26 -1.14 115.29 103.98 1srg s HIS 127 Ca 0.04 0.23 0.03 0.00 -0.80 0.00 0.00 55.06 54.56 1srg s HIS 127 Cb -0.01 0.02 -0.02 0.00 -1.43 0.00 0.00 32.58 31.14 1srg s HIS 127 CO 0.03 -0.10 -0.08 -0.51 -2.00 0.00 0.00 174.74 172.07 1srg s ASP 128 N -0.18 0.96 -0.11 7.38 1.01 -0.93 -4.98 116.67 119.83 1srg s ASP 128 Ca -0.02 -0.44 0.02 0.00 0.71 0.00 0.00 52.55 52.82 1srg s ASP 128 Cb -0.02 -0.01 0.01 0.00 1.01 0.00 0.00 42.92 43.91 1srg s ASP 128 CO 0.00 -0.10 -0.17 -0.89 0.21 0.00 0.00 175.17 174.22 1srg s THR 129 N -1.02 1.64 -0.11 -1.27 2.01 -1.26 -1.13 115.64 114.50 1srg s THR 129 Ca -0.05 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.19 1srg s THR 129 Cb -0.08 -1.47 -0.03 0.00 0.01 0.00 0.00 72.50 70.93 1srg s THR 129 CO 0.01 0.47 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.02 1srg s PHE 130 N 0.84 3.08 -0.11 4.92 0.40 0.01 -3.51 117.98 123.60 1srg s PHE 130 Ca -0.09 0.00 -0.00 0.00 -0.60 0.00 0.00 56.93 56.24 1srg s PHE 130 Cb -0.15 -1.85 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 1srg s PHE 130 CO 0.00 0.27 -0.09 0.99 0.70 0.00 0.00 175.22 177.09 1srg s THR 131 N -0.40 3.44 0.18 0.64 2.01 0.70 -2.03 115.64 120.18 1srg s THR 131 Ca 0.07 -0.54 -0.28 0.00 0.31 0.00 0.00 61.69 61.25 1srg s THR 131 Cb -0.12 -2.44 -0.08 0.00 0.01 0.00 0.00 72.50 69.87 1srg s THR 131 CO 0.02 0.54 0.87 -0.75 -0.69 0.00 0.00 174.62 174.61 1srg s LYS 132 N -0.04 4.70 0.00 4.92 2.20 -1.23 -0.88 119.74 129.41 1srg s LYS 132 Ca -0.01 1.32 0.03 0.00 -0.36 0.00 0.00 55.97 56.95 1srg s LYS 132 Cb -0.14 -3.29 0.02 0.00 -1.51 0.00 0.00 37.83 32.91 1srg s LYS 132 CO 0.03 0.48 0.58 1.33 -0.36 0.00 0.00 175.35 177.41