#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rst s GLU 14 N 0.00 1.20 0.13 2.12 2.56 -1.26 -4.61 118.70 118.84 1rst s GLU 14 Ca 0.00 -1.66 -0.26 0.00 0.00 0.00 0.00 54.97 53.04 1rst s GLU 14 Cb 0.00 -2.61 -0.06 0.00 2.00 0.00 0.00 34.13 33.46 1rst s GLU 14 CO 0.00 -1.01 1.40 0.00 -0.56 0.00 0.00 175.26 175.09 1rst n ALA 15 N 4.26 -0.54 0.36 6.30 0.00 -1.26 -3.27 120.51 126.36 1rst n ALA 15 Ca 0.03 0.72 0.02 0.00 0.00 0.00 0.00 53.44 54.20 1rst n ALA 15 Cb 0.40 -0.07 0.14 0.00 0.00 0.00 0.00 19.45 19.92 1rst n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rst n GLY 16 N -1.21 2.01 0.14 0.00 0.00 -1.26 -4.16 105.19 100.70 1rst n GLY 16 Ca 0.02 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 1rst n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1rst h ILE 17 N 1.35 0.75 -2.38 -0.61 2.04 -1.96 -3.47 117.51 113.23 1rst h ILE 17 Ca 0.00 -2.38 -0.56 0.00 1.00 0.00 0.00 64.86 62.92 1rst h ILE 17 Cb 1.01 2.58 0.06 0.00 -0.74 0.00 0.00 36.82 39.72 1rst h ILE 17 CO 0.17 0.85 0.89 0.41 0.00 0.00 0.00 178.15 180.47 1rst n THR 18 N -3.59 0.05 -0.48 -0.27 -1.04 -1.26 -4.77 114.28 102.91 1rst n THR 18 Ca -0.30 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.71 1rst n THR 18 Cb 1.03 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.83 1rst n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rst n GLY 19 N 3.66 0.77 3.57 3.41 0.00 -0.19 -5.00 105.19 111.40 1rst n GLY 19 Ca 0.17 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.04 1rst n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rst s THR 20 N -2.64 4.44 0.11 2.61 2.01 -1.26 -1.40 115.64 119.51 1rst s THR 20 Ca 0.00 -0.16 0.10 0.00 0.31 0.00 0.00 61.69 61.94 1rst s THR 20 Cb 0.00 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.48 1rst s THR 20 CO 0.00 0.46 -0.25 0.26 -0.69 0.00 0.00 174.62 174.40 1rst s TRP 21 N 0.53 2.11 -0.03 4.92 0.52 0.45 -4.58 118.94 122.86 1rst s TRP 21 Ca 0.01 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 55.77 1rst s TRP 21 Cb -0.13 -1.16 -0.00 0.00 -1.15 0.00 0.00 33.47 31.03 1rst s TRP 21 CO 0.02 0.28 -0.13 0.71 0.02 0.00 0.00 176.95 177.84 1rst s TYR 22 N -1.07 1.31 0.52 -1.98 2.02 -0.01 -1.02 117.35 117.11 1rst s TYR 22 Ca 0.11 -0.35 -0.00 0.00 -0.37 0.00 0.00 57.07 56.46 1rst s TYR 22 Cb -0.10 -0.90 0.10 0.00 -0.40 0.00 0.00 41.96 40.66 1rst s TYR 22 CO 0.05 -0.12 0.71 0.27 -1.57 0.00 0.00 175.55 174.89 1rst n ASN 23 N 3.19 0.93 0.00 2.29 6.94 -0.80 -1.38 115.26 126.43 1rst n ASN 23 Ca -0.18 -1.79 0.14 0.00 -0.02 0.00 0.00 54.58 52.73 1rst n ASN 23 Cb 0.54 -0.46 0.72 0.00 -2.36 0.00 0.00 39.78 38.21 1rst n ASN 23 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rst n GLN 24 N -2.32 0.40 0.00 -3.83 1.13 -1.24 -3.00 117.38 108.52 1rst n GLN 24 Ca 0.12 0.02 0.12 0.00 -1.94 0.00 0.00 57.00 55.31 1rst n GLN 24 Cb 0.42 -1.50 0.10 0.00 0.11 0.00 0.00 30.24 29.36 1rst n GLN 24 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1rst n LEU 25 N -1.29 1.88 0.00 1.08 4.77 -1.26 -4.96 117.00 117.22 1rst n LEU 25 Ca 0.13 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 1rst n LEU 25 Cb 0.23 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1rst n LEU 25 CO 0.22 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1rst n GLY 26 N 1.39 2.90 3.71 -0.72 0.00 -1.16 -5.07 105.19 106.24 1rst n GLY 26 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1rst n GLY 26 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rst n SER 27 N 0.00 2.39 -4.37 1.61 7.64 -1.26 -4.74 113.62 114.89 1rst n SER 27 Ca 0.00 0.99 -0.33 0.00 1.01 0.00 0.00 58.87 60.54 1rst n SER 27 Cb 0.00 -1.53 -0.14 0.00 -1.01 0.00 0.00 64.21 61.52 1rst n SER 27 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1rst s THR 28 N -1.29 2.90 -0.21 0.44 2.01 0.11 -1.90 115.64 117.68 1rst s THR 28 Ca 0.69 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.98 1rst s THR 28 Cb -0.44 -2.18 0.04 0.00 0.01 0.00 0.00 72.50 69.92 1rst s THR 28 CO 0.51 0.54 -0.16 0.12 -0.69 0.00 0.00 174.62 174.95 1rst s PHE 29 N 0.11 2.95 -0.25 4.92 5.36 -0.19 -0.42 117.98 130.46 1rst s PHE 29 Ca -0.07 -1.92 -0.04 0.00 -0.96 0.00 0.00 56.93 53.94 1rst s PHE 29 Cb -0.15 -1.90 0.01 0.00 -0.34 0.00 0.00 43.02 40.64 1rst s PHE 29 CO 0.05 -0.83 -0.02 0.42 -1.46 0.00 0.00 175.22 173.38 1rst s ILE 30 N 1.22 3.31 0.05 3.12 1.01 -0.21 -0.41 121.20 129.30 1rst s ILE 30 Ca -0.01 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.89 1rst s ILE 30 Cb -0.16 -2.64 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 1rst s ILE 30 CO -0.09 0.23 -0.09 0.54 0.00 0.00 0.00 174.94 175.53 1rst s VAL 31 N 1.42 0.69 -0.14 2.92 0.11 -0.49 -1.41 120.40 123.49 1rst s VAL 31 Ca 0.02 -1.21 0.02 0.00 -2.93 0.00 0.00 61.98 57.88 1rst s VAL 31 Cb -0.16 -0.81 0.01 0.00 -1.53 0.00 0.00 36.38 33.89 1rst s VAL 31 CO -0.02 -0.39 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.25 1rst s THR 32 N -1.56 2.09 -0.38 5.04 2.01 0.98 -1.02 115.64 122.81 1rst s THR 32 Ca -0.06 -0.96 -0.17 0.00 0.31 0.00 0.00 61.69 60.81 1rst s THR 32 Cb -0.09 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.59 1rst s THR 32 CO 0.00 0.55 0.43 0.00 -0.69 0.00 0.00 174.62 174.91 1rst s ALA 33 N 0.86 3.46 0.54 7.40 0.00 -1.26 -1.75 121.76 131.00 1rst s ALA 33 Ca -0.06 -1.28 -0.16 0.00 0.00 0.00 0.00 51.96 50.45 1rst s ALA 33 Cb -0.15 -2.96 -0.07 0.00 0.00 0.00 0.00 23.12 19.93 1rst s ALA 33 CO -0.03 -1.32 1.01 0.20 0.00 0.00 0.00 175.76 175.62 1rst s GLY 34 N 1.78 2.09 0.52 0.00 0.00 0.13 -4.91 107.32 106.92 1rst s GLY 34 Ca 0.14 0.24 0.22 0.00 0.00 0.00 0.00 44.72 45.32 1rst s GLY 34 CO 0.13 0.53 2.11 0.00 0.00 0.00 0.00 173.10 175.87 1rst h ALA 35 N 0.80 1.58 0.00 3.20 0.00 -1.98 -1.26 119.26 121.61 1rst h ALA 35 Ca -0.47 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1rst h ALA 35 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1rst h ALA 35 CO 0.60 0.11 0.00 -0.40 0.00 0.00 0.00 179.25 179.56 1rst n ASP 36 N -4.04 0.00 0.00 0.00 5.75 -1.26 -4.11 116.55 112.89 1rst n ASP 36 Ca -0.03 0.27 0.00 0.00 -0.01 0.00 0.00 54.79 55.03 1rst n ASP 36 Cb 0.17 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 1rst n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rst n GLY 37 N 0.67 0.98 3.80 6.12 0.00 -0.47 -4.94 105.19 111.35 1rst n GLY 37 Ca 0.07 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1rst n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rst s ALA 38 N -2.00 3.59 -0.13 4.61 0.00 -1.24 -1.39 121.76 125.20 1rst s ALA 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.97 1rst s ALA 38 Cb 0.00 -2.62 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 1rst s ALA 38 CO 0.00 0.37 -0.14 -0.51 0.00 0.00 0.00 175.76 175.48 1rst s LEU 39 N -0.95 2.65 -0.02 0.00 1.43 -0.50 0.20 118.68 121.48 1rst s LEU 39 Ca 0.29 -0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.01 1rst s LEU 39 Cb -0.19 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.44 1rst s LEU 39 CO 0.18 0.16 0.05 -0.89 0.23 0.00 0.00 176.35 176.08 1rst s THR 40 N 0.38 0.00 -2.88 5.49 2.01 -0.72 -1.18 115.64 118.75 1rst s THR 40 Ca -0.11 -0.03 0.00 0.00 0.31 0.00 0.00 61.69 61.86 1rst s THR 40 Cb -0.16 -0.08 0.00 0.00 0.01 0.00 0.00 72.50 72.26 1rst s THR 40 CO 0.06 -0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 1rst n GLY 41 N 3.00 -0.60 3.07 4.40 0.00 -1.09 -0.01 105.19 113.95 1rst n GLY 41 Ca -0.13 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.17 1rst n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rst s THR 42 N -3.77 0.12 -0.08 2.61 -4.23 -0.50 -1.73 115.64 108.06 1rst s THR 42 Ca 0.00 -0.98 0.04 0.00 -1.18 0.00 0.00 61.69 59.57 1rst s THR 42 Cb 0.00 -0.61 -0.00 0.00 1.34 0.00 0.00 72.50 73.23 1rst s THR 42 CO 0.00 -0.54 -0.23 -0.47 -0.54 0.00 0.00 174.62 172.85 1rst s TYR 43 N -2.00 2.35 -0.05 3.99 6.14 0.47 -1.04 117.35 127.21 1rst s TYR 43 Ca -0.10 -0.87 -0.01 0.00 0.64 0.00 0.00 57.07 56.72 1rst s TYR 43 Cb -0.05 -1.57 0.03 0.00 0.42 0.00 0.00 41.96 40.78 1rst s TYR 43 CO -0.02 -0.34 0.02 -1.83 0.64 0.00 0.00 175.55 174.03 1rst s GLU 44 N 0.23 0.28 -0.11 4.97 -1.05 0.44 -0.33 118.70 123.12 1rst s GLU 44 Ca -0.14 0.21 0.08 0.00 -0.15 0.00 0.00 54.97 54.97 1rst s GLU 44 Cb -0.16 -0.70 0.42 0.00 -0.44 0.00 0.00 34.13 33.24 1rst s GLU 44 CO 0.07 -0.28 1.17 0.43 0.95 0.00 0.00 175.26 177.59 1rst n SER 45 N 5.03 3.30 -3.01 0.83 7.64 -1.21 0.04 113.62 126.24 1rst n SER 45 Ca -0.09 -2.43 -0.17 0.00 1.01 0.00 0.00 58.87 57.19 1rst n SER 45 Cb 0.50 -0.56 -0.07 0.00 -1.01 0.00 0.00 64.21 63.08 1rst n SER 45 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rst n ALA 46 N 0.36 0.62 -2.95 -0.43 0.00 -1.26 -4.65 120.51 112.20 1rst n ALA 46 Ca 0.14 -1.75 -0.44 0.00 0.00 0.00 0.00 53.44 51.39 1rst n ALA 46 Cb 0.69 1.42 -0.03 0.00 0.00 0.00 0.00 19.45 21.54 1rst n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1rst s VAL 47 N -3.21 4.78 -0.43 0.00 -7.23 -1.26 -4.43 120.40 108.62 1rst s VAL 47 Ca 0.36 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 58.91 1rst s VAL 47 Cb 0.02 -4.76 0.00 0.00 0.56 0.00 0.00 36.38 32.20 1rst s VAL 47 CO 0.25 -1.48 0.00 0.61 -0.31 0.00 0.00 175.10 174.18 1rst n GLY 48 N 5.40 0.39 3.63 2.32 0.00 -1.26 -4.90 105.19 110.77 1rst n GLY 48 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 1rst n GLY 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rst s ASN 49 N -2.06 6.48 0.45 1.61 2.47 -1.26 -4.91 114.94 117.72 1rst s ASN 49 Ca 0.00 1.33 0.12 0.00 0.42 0.00 0.00 52.86 54.73 1rst s ASN 49 Cb 0.00 -2.54 1.01 0.00 -1.45 0.00 0.00 41.25 38.28 1rst s ASN 49 CO 0.00 -1.22 2.05 0.00 -3.72 0.00 0.00 177.10 174.21 1rst h ALA 50 N 10.17 1.77 0.00 1.71 0.00 -1.96 -1.66 119.26 129.29 1rst h ALA 50 Ca -0.30 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1rst h ALA 50 Cb 1.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1rst h ALA 50 CO 1.03 0.18 0.00 -0.85 0.00 0.00 0.00 179.25 179.61 1rst n GLU 51 N -4.43 0.14 -0.13 0.00 0.28 -1.26 -2.70 120.64 112.53 1rst n GLU 51 Ca -0.01 0.23 0.11 0.00 -0.16 0.00 0.00 57.16 57.33 1rst n GLU 51 Cb 0.15 -1.70 0.17 0.00 1.43 0.00 0.00 31.44 31.49 1rst n GLU 51 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1rst n SER 52 N -1.95 3.22 -4.70 -1.84 3.41 -0.63 -4.83 113.62 106.30 1rst n SER 52 Ca 0.05 -1.95 -0.37 0.00 -0.26 0.00 0.00 58.87 56.33 1rst n SER 52 Cb 0.31 -0.18 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 1rst n SER 52 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1rst s ARG 53 N -1.52 4.25 0.06 4.33 3.52 -1.10 -3.33 118.95 125.15 1rst s ARG 53 Ca 0.34 0.23 0.04 0.00 -0.13 0.00 0.00 55.73 56.21 1rst s ARG 53 Cb 0.21 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 30.10 1rst s ARG 53 CO 0.29 0.11 -0.12 0.71 -0.81 0.00 0.00 175.30 175.48 1rst s TYR 54 N 0.83 1.05 0.28 5.12 1.51 0.55 -4.84 117.35 121.85 1rst s TYR 54 Ca 0.20 -0.44 -0.29 0.00 -1.01 0.00 0.00 57.07 55.53 1rst s TYR 54 Cb -0.14 -0.61 -0.09 0.00 -0.11 0.00 0.00 41.96 41.01 1rst s TYR 54 CO 0.07 0.02 1.00 0.08 -1.11 0.00 0.00 175.55 175.61 1rst s VAL 55 N -1.20 3.86 0.07 0.71 1.01 -1.26 -0.40 120.40 123.19 1rst s VAL 55 Ca -0.03 1.79 0.06 0.00 0.00 0.00 0.00 61.98 63.80 1rst s VAL 55 Cb -0.09 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1rst s VAL 55 CO 0.02 0.37 -0.17 -1.48 0.00 0.00 0.00 175.10 173.84 1rst s LEU 56 N -1.50 2.25 0.01 3.92 0.05 -0.70 -4.31 118.68 118.40 1rst s LEU 56 Ca 0.45 -0.59 0.00 0.00 0.05 0.00 0.00 54.13 54.04 1rst s LEU 56 Cb -0.27 -0.68 -0.01 0.00 -2.05 0.00 0.00 46.19 43.18 1rst s LEU 56 CO 0.34 0.01 -0.02 0.28 -0.55 0.00 0.00 176.35 176.40 1rst s THR 57 N -1.10 0.11 0.00 5.48 -1.32 -1.04 -2.66 115.64 115.11 1rst s THR 57 Ca 0.02 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 59.90 1rst s THR 57 Cb -0.09 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.69 1rst s THR 57 CO 0.03 -0.31 0.00 0.61 -2.21 0.00 0.00 174.62 172.73 1rst n GLY 58 N 2.11 2.24 3.12 6.08 0.00 -0.32 -0.96 105.19 117.45 1rst n GLY 58 Ca -0.20 -0.89 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 1rst n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rst s ARG 59 N -0.79 0.54 0.06 1.61 1.81 -0.39 -1.42 118.95 120.36 1rst s ARG 59 Ca 0.00 -0.53 -0.04 0.00 -1.72 0.00 0.00 55.73 53.44 1rst s ARG 59 Cb 0.00 0.22 -0.02 0.00 -0.45 0.00 0.00 34.95 34.70 1rst s ARG 59 CO 0.00 -0.13 0.06 1.52 -0.68 0.00 0.00 175.30 176.07 1rst s TYR 60 N -1.87 0.34 -0.42 -0.53 1.13 -0.48 -1.47 117.35 114.05 1rst s TYR 60 Ca -0.11 -0.82 -0.29 0.00 -1.41 0.00 0.00 57.07 54.45 1rst s TYR 60 Cb -0.05 -0.24 0.00 0.00 -1.10 0.00 0.00 41.96 40.58 1rst s TYR 60 CO -0.01 -0.44 1.49 0.34 -2.51 0.00 0.00 175.55 174.43 1rst s ASP 61 N -2.79 6.21 0.00 -0.18 2.15 -0.34 -4.64 116.67 117.08 1rst s ASP 61 Ca 0.05 0.83 0.27 0.00 0.43 0.00 0.00 52.55 54.13 1rst s ASP 61 Cb 0.06 -2.54 1.50 0.00 -0.30 0.00 0.00 42.92 41.64 1rst s ASP 61 CO -0.10 -1.54 1.98 -1.54 -0.17 0.00 0.00 175.17 173.80 1rst n SER 62 N 9.27 0.31 -3.10 -0.34 3.41 -1.26 -4.06 113.62 117.85 1rst n SER 62 Ca 0.17 -1.23 -0.20 0.00 -0.26 0.00 0.00 58.87 57.36 1rst n SER 62 Cb 0.48 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.39 1rst n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rst n ALA 63 N -0.70 1.58 -1.12 7.33 0.00 -1.26 0.26 120.51 126.60 1rst n ALA 63 Ca 0.20 -2.99 -0.31 0.00 0.00 0.00 0.00 53.44 50.34 1rst n ALA 63 Cb 0.14 -0.93 0.12 0.00 0.00 0.00 0.00 19.45 18.78 1rst n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rst s PRO 64 N -1.08 1.68 0.68 0.00 0.04 -1.26 -4.99 135.00 130.08 1rst s PRO 64 Ca 0.35 1.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.37 1rst s PRO 64 Cb 0.22 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.94 1rst s PRO 64 CO -0.12 -2.04 1.22 0.00 0.04 0.00 0.00 177.00 176.10 1rst s ALA 65 N -2.85 2.29 -1.30 8.56 0.00 -1.26 -4.93 121.76 122.27 1rst s ALA 65 Ca 0.63 0.97 0.23 0.00 0.00 0.00 0.00 51.96 53.80 1rst s ALA 65 Cb -0.19 -3.48 0.16 0.00 0.00 0.00 0.00 23.12 19.61 1rst s ALA 65 CO 0.57 -1.63 1.18 0.25 0.00 0.00 0.00 175.76 176.12 1rst n THR 66 N -2.27 0.00 0.74 0.00 -2.24 -1.26 -4.42 114.28 104.84 1rst n THR 66 Ca 0.14 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1rst n THR 66 Cb 0.50 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 1rst n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1rst n ASP 67 N -1.10 0.08 0.00 3.42 5.75 -1.26 -4.74 116.55 118.69 1rst n ASP 67 Ca 0.07 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 54.03 1rst n ASP 67 Cb 0.36 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1rst n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rst n GLY 68 N -0.02 0.62 3.77 6.12 0.00 -1.26 -5.07 105.19 109.36 1rst n GLY 68 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1rst n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rst s SER 69 N -2.97 4.70 0.88 1.61 0.01 -1.26 -5.04 113.70 111.62 1rst s SER 69 Ca 0.00 1.88 -0.13 0.00 1.31 0.00 0.00 55.95 59.00 1rst s SER 69 Cb 0.00 -2.53 0.14 0.00 0.21 0.00 0.00 66.02 63.84 1rst s SER 69 CO 0.00 -1.90 1.24 -0.83 0.41 0.00 0.00 173.24 172.15 1rst s GLY 70 N -3.14 1.70 -0.40 3.44 0.00 -1.26 -4.84 107.32 102.82 1rst s GLY 70 Ca 0.63 -0.98 -0.13 0.00 0.00 0.00 0.00 44.72 44.24 1rst s GLY 70 CO 0.51 -0.35 0.27 -1.59 0.00 0.00 0.00 173.10 171.94 1rst s THR 71 N -3.70 4.93 0.37 0.90 2.01 0.08 -4.79 115.64 115.44 1rst s THR 71 Ca 0.68 -0.81 -0.27 0.00 0.31 0.00 0.00 61.69 61.60 1rst s THR 71 Cb -0.07 -3.78 -0.10 0.00 0.01 0.00 0.00 72.50 68.56 1rst s THR 71 CO 0.51 -0.31 1.33 0.00 -0.69 0.00 0.00 174.62 175.46 1rst s ALA 72 N 1.61 3.39 0.25 7.40 0.00 -1.26 -0.44 121.76 132.71 1rst s ALA 72 Ca 0.04 1.30 -0.19 0.00 0.00 0.00 0.00 51.96 53.11 1rst s ALA 72 Cb -0.20 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.44 1rst s ALA 72 CO 0.08 -0.80 0.63 -0.48 0.00 0.00 0.00 175.76 175.19 1rst s LEU 73 N -2.15 -0.09 -0.07 0.00 0.05 0.02 -1.19 118.68 115.24 1rst s LEU 73 Ca 0.53 -0.64 -0.30 0.00 0.05 0.00 0.00 54.13 53.78 1rst s LEU 73 Cb -0.40 2.41 0.09 0.00 -2.05 0.00 0.00 46.19 46.24 1rst s LEU 73 CO 0.53 -1.24 0.79 -0.83 -0.55 0.00 0.00 176.35 175.04 1rst s GLY 74 N -2.93 -0.48 0.13 -3.48 0.00 -0.54 -1.58 107.32 98.44 1rst s GLY 74 Ca 0.13 1.49 -0.12 0.00 0.00 0.00 0.00 44.72 46.22 1rst s GLY 74 CO 0.05 0.91 0.32 0.66 0.00 0.00 0.00 173.10 175.04 1rst s TRP 75 N -1.38 0.06 0.02 1.90 -2.14 -0.83 -1.27 118.94 115.31 1rst s TRP 75 Ca -0.07 -0.43 0.05 0.00 2.66 0.00 0.00 56.10 58.31 1rst s TRP 75 Cb -0.00 0.09 -0.02 0.00 -3.10 0.00 0.00 33.47 30.44 1rst s TRP 75 CO 0.05 -0.68 -0.15 0.99 -2.66 0.00 0.00 176.95 174.51 1rst s THR 76 N -3.87 1.19 -0.10 0.66 2.01 -0.14 -0.95 115.64 114.44 1rst s THR 76 Ca 0.07 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.17 1rst s THR 76 Cb 0.03 -1.04 0.02 0.00 0.01 0.00 0.00 72.50 71.52 1rst s THR 76 CO -0.08 0.12 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.19 1rst s VAL 77 N -0.69 1.12 -0.15 3.82 1.01 -0.27 -2.50 120.40 122.74 1rst s VAL 77 Ca 0.03 -0.39 -0.19 0.00 0.00 0.00 0.00 61.98 61.44 1rst s VAL 77 Cb -0.07 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1rst s VAL 77 CO 0.01 0.37 0.51 0.00 0.00 0.00 0.00 175.10 175.99 1rst s ALA 78 N 1.37 3.49 -1.56 5.51 0.00 -1.26 -1.11 121.76 128.20 1rst s ALA 78 Ca -0.01 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 51.60 1rst s ALA 78 Cb -0.14 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 1rst s ALA 78 CO -0.05 -0.18 2.75 0.91 0.00 0.00 0.00 175.76 179.18 1rst n TRP 79 N 4.13 2.68 -3.74 0.00 7.02 0.15 -4.78 117.44 122.91 1rst n TRP 79 Ca -0.06 -3.05 -0.16 0.00 -1.02 0.00 0.00 57.50 53.22 1rst n TRP 79 Cb 0.51 -2.45 -0.16 0.00 -2.42 0.00 0.00 31.31 26.79 1rst n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1rst s LYS 80 N 2.11 -0.03 0.00 -0.99 2.20 -1.26 -1.06 119.74 120.71 1rst s LYS 80 Ca 0.63 0.27 0.00 0.00 -0.36 0.00 0.00 55.97 56.51 1rst s LYS 80 Cb 0.17 -0.30 0.00 0.00 -1.51 0.00 0.00 37.83 36.19 1rst s LYS 80 CO -0.07 -0.21 0.00 0.27 -0.36 0.00 0.00 175.35 174.98 1rst n ASN 81 N 4.50 0.19 0.00 1.43 0.23 -0.29 -4.80 115.26 116.52 1rst n ASN 81 Ca -0.21 -0.60 0.10 0.00 -0.53 0.00 0.00 54.58 53.34 1rst n ASN 81 Cb 0.50 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.66 1rst n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1rst n ASN 82 N -1.68 0.00 -0.00 0.53 3.02 -1.26 -3.46 115.26 112.41 1rst n ASN 82 Ca 0.00 0.34 0.05 0.00 -0.03 0.00 0.00 54.58 54.94 1rst n ASN 82 Cb 0.00 -0.43 -0.08 0.00 -0.61 0.00 0.00 39.78 38.66 1rst n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1rst n TYR 83 N -1.43 0.00 -3.45 3.10 4.02 -1.26 -5.07 117.16 113.07 1rst n TYR 83 Ca 0.06 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.83 1rst n TYR 83 Cb 0.21 -0.23 -0.03 0.00 -0.02 0.00 0.00 39.34 39.28 1rst n TYR 83 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 1rst s ARG 84 N -2.68 1.19 -0.19 -0.72 3.52 -1.22 -5.13 118.95 113.71 1rst s ARG 84 Ca -0.03 -0.33 -0.05 0.00 -0.13 0.00 0.00 55.73 55.19 1rst s ARG 84 Cb 0.07 0.55 0.07 0.00 -1.56 0.00 0.00 34.95 34.07 1rst s ARG 84 CO 0.43 -0.50 0.10 1.21 -0.81 0.00 0.00 175.30 175.73 1rst s ASN 85 N -2.45 2.55 0.00 -2.12 3.84 -1.26 -1.14 114.94 114.36 1rst s ASN 85 Ca -0.01 -0.73 0.19 0.00 0.21 0.00 0.00 52.86 52.53 1rst s ASN 85 Cb -0.01 -0.26 0.61 0.00 -0.55 0.00 0.00 41.25 41.04 1rst s ASN 85 CO -0.09 -0.37 1.47 0.00 -2.79 0.00 0.00 177.10 175.33 1rst n ALA 86 N 5.27 2.48 -3.95 1.71 0.00 -0.22 -4.98 120.51 120.83 1rst n ALA 86 Ca -0.07 -0.65 -0.39 0.00 0.00 0.00 0.00 53.44 52.33 1rst n ALA 86 Cb 0.48 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.92 1rst n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1rst n HIS 87 N 0.61 -1.58 -3.67 0.00 8.25 -1.26 -4.86 115.22 112.72 1rst n HIS 87 Ca 0.16 0.28 -0.07 0.00 -0.26 0.00 0.00 57.72 57.82 1rst n HIS 87 Cb 0.38 -3.08 -0.02 0.00 1.12 0.00 0.00 29.99 28.40 1rst n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1rst s SER 88 N -3.62 -0.33 -0.09 0.41 1.04 -1.26 -0.95 113.70 108.91 1rst s SER 88 Ca 0.43 -0.31 -0.12 0.00 0.48 0.00 0.00 55.95 56.43 1rst s SER 88 Cb -0.20 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.52 1rst s SER 88 CO 0.93 -1.01 0.31 0.00 0.98 0.00 0.00 173.24 174.45 1rst s ALA 89 N -3.57 -0.77 -0.04 5.32 0.00 -0.34 -0.67 121.76 121.69 1rst s ALA 89 Ca 0.08 0.70 0.06 0.00 0.00 0.00 0.00 51.96 52.80 1rst s ALA 89 Cb -0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1rst s ALA 89 CO -0.02 -0.18 -0.24 0.99 0.00 0.00 0.00 175.76 176.31 1rst s THR 90 N -0.31 1.91 -0.08 0.00 2.01 -0.27 -1.05 115.64 117.85 1rst s THR 90 Ca -0.04 -1.00 0.03 0.00 0.31 0.00 0.00 61.69 60.99 1rst s THR 90 Cb -0.03 -1.60 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 1rst s THR 90 CO 0.02 0.54 -0.18 0.42 -0.69 0.00 0.00 174.62 174.72 1rst s THR 91 N -0.28 2.64 -0.13 -0.82 -4.23 -0.67 -1.12 115.64 111.04 1rst s THR 91 Ca 0.01 -0.84 -0.02 0.00 -1.18 0.00 0.00 61.69 59.66 1rst s THR 91 Cb -0.12 -2.04 -0.02 0.00 1.34 0.00 0.00 72.50 71.66 1rst s THR 91 CO 0.02 0.56 -0.07 0.26 -0.54 0.00 0.00 174.62 174.84 1rst s TRP 92 N -0.08 2.94 -0.10 3.99 0.51 -0.13 -1.68 118.94 124.39 1rst s TRP 92 Ca -0.04 -0.33 0.03 0.00 -2.12 0.00 0.00 56.10 53.64 1rst s TRP 92 Cb -0.14 -1.86 0.01 0.00 -0.81 0.00 0.00 33.47 30.66 1rst s TRP 92 CO 0.04 -0.00 -0.18 0.45 -0.51 0.00 0.00 176.95 176.74 1rst s SER 93 N 0.09 2.61 0.00 2.95 0.15 0.03 -1.96 113.70 117.57 1rst s SER 93 Ca -0.02 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.16 1rst s SER 93 Cb -0.14 -1.19 0.00 0.00 -1.71 0.00 0.00 66.02 62.98 1rst s SER 93 CO 0.03 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.15 1rst n GLY 94 N 3.92 1.41 3.08 9.45 0.00 -0.62 -0.99 105.19 121.43 1rst n GLY 94 Ca -0.20 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1rst n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1rst s GLN 95 N 1.35 0.37 -0.01 1.61 -2.07 -0.77 -0.80 119.66 119.33 1rst s GLN 95 Ca 0.00 -0.17 -0.20 0.00 -1.82 0.00 0.00 55.36 53.17 1rst s GLN 95 Cb 0.00 0.16 -0.05 0.00 -1.09 0.00 0.00 33.01 32.02 1rst s GLN 95 CO 0.00 -0.08 0.58 -0.47 -1.32 0.00 0.00 175.29 174.01 1rst s TYR 96 N -0.83 3.67 -0.21 9.60 5.04 0.41 -1.69 117.35 133.35 1rst s TYR 96 Ca -0.09 1.18 0.00 0.00 -2.44 0.00 0.00 57.07 55.72 1rst s TYR 96 Cb -0.05 -2.60 0.05 0.00 0.35 0.00 0.00 41.96 39.71 1rst s TYR 96 CO 0.01 0.35 -0.05 0.08 -1.34 0.00 0.00 175.55 174.60 1rst s VAL 97 N -0.17 1.35 0.78 3.14 1.01 0.01 -0.75 120.40 125.77 1rst s VAL 97 Ca 0.31 -0.99 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 1rst s VAL 97 Cb -0.18 -1.59 0.19 0.00 0.00 0.00 0.00 36.38 34.80 1rst s VAL 97 CO 0.17 -0.02 0.84 0.61 0.00 0.00 0.00 175.10 176.70 1rst n GLY 98 N 4.76 -2.11 0.00 4.51 0.00 -1.26 -1.41 105.19 109.67 1rst n GLY 98 Ca -0.12 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1rst n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rst n GLY 99 N -1.92 0.48 0.19 -0.02 0.00 -1.26 -4.53 105.19 98.14 1rst n GLY 99 Ca 0.11 -2.31 0.03 0.00 0.00 0.00 0.00 46.02 43.85 1rst n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rst h ALA 100 N 0.00 1.41 -1.85 4.61 0.00 -2.06 -3.03 119.26 118.33 1rst h ALA 100 Ca 0.00 -0.31 -0.71 0.00 0.00 0.00 0.00 54.91 53.90 1rst h ALA 100 Cb 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 17.79 17.39 1rst h ALA 100 CO 0.00 0.42 0.21 -0.85 0.00 0.00 0.00 179.25 179.03 1rst n GLU 101 N -4.09 4.11 -1.97 0.00 -0.00 -1.26 -5.05 120.64 112.38 1rst n GLU 101 Ca -0.02 -4.71 -0.38 0.00 -0.00 0.00 0.00 57.16 52.05 1rst n GLU 101 Cb 0.38 -2.37 0.02 0.00 -0.00 0.00 0.00 31.44 29.47 1rst n GLU 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1rst s ALA 102 N -3.47 2.92 0.00 -1.84 0.00 -1.15 -4.88 121.76 113.34 1rst s ALA 102 Ca 0.41 1.19 -0.29 0.00 0.00 0.00 0.00 51.96 53.28 1rst s ALA 102 Cb 0.18 -3.50 0.08 0.00 0.00 0.00 0.00 23.12 19.88 1rst s ALA 102 CO -0.07 -1.08 0.69 -0.98 0.00 0.00 0.00 175.76 174.32 1rst s ARG 103 N -2.77 1.08 -0.25 0.00 1.70 -0.50 -4.37 118.95 113.83 1rst s ARG 103 Ca 0.67 0.01 0.01 0.00 -0.47 0.00 0.00 55.73 55.96 1rst s ARG 103 Cb -0.36 0.50 0.05 0.00 -0.57 0.00 0.00 34.95 34.57 1rst s ARG 103 CO 0.44 -0.39 -0.10 0.42 -1.08 0.00 0.00 175.30 174.59 1rst s ILE 104 N -2.01 2.43 -0.17 4.99 1.01 -0.68 -0.81 121.20 125.95 1rst s ILE 104 Ca -0.06 -1.36 -0.13 0.00 0.00 0.00 0.00 60.65 59.10 1rst s ILE 104 Cb -0.00 -2.32 -0.05 0.00 0.01 0.00 0.00 42.46 40.10 1rst s ILE 104 CO 0.02 0.09 0.25 0.20 0.00 0.00 0.00 174.94 175.50 1rst s ASN 105 N 1.20 6.37 0.16 3.58 -0.87 -0.68 -1.36 114.94 123.34 1rst s ASN 105 Ca -0.04 0.43 -0.00 0.00 -1.57 0.00 0.00 52.86 51.67 1rst s ASN 105 Cb -0.18 -2.16 -0.04 0.00 -0.02 0.00 0.00 41.25 38.85 1rst s ASN 105 CO -0.06 0.11 0.06 0.42 -2.57 0.00 0.00 177.10 175.07 1rst s THR 106 N 0.47 0.21 -0.01 1.60 -4.23 -0.38 -1.85 115.64 111.45 1rst s THR 106 Ca 0.14 -1.94 0.05 0.00 -1.18 0.00 0.00 61.69 58.76 1rst s THR 106 Cb -0.12 -2.17 -0.01 0.00 1.34 0.00 0.00 72.50 71.54 1rst s THR 106 CO 0.02 -0.36 -0.16 -1.10 -0.54 0.00 0.00 174.62 172.49 1rst s GLN 107 N -4.04 1.30 0.21 3.99 -0.21 -0.17 -2.21 119.66 118.52 1rst s GLN 107 Ca 0.27 -0.56 0.09 0.00 0.02 0.00 0.00 55.36 55.18 1rst s GLN 107 Cb 0.07 -1.24 -0.05 0.00 1.00 0.00 0.00 33.01 32.79 1rst s GLN 107 CO 0.05 0.32 -0.16 1.67 -2.12 0.00 0.00 175.29 175.05 1rst s TRP 108 N -0.32 1.82 -0.14 0.91 1.48 0.28 -0.79 118.94 122.18 1rst s TRP 108 Ca 0.05 -0.51 -0.01 0.00 -1.06 0.00 0.00 56.10 54.57 1rst s TRP 108 Cb -0.06 -0.85 0.04 0.00 -1.16 0.00 0.00 33.47 31.43 1rst s TRP 108 CO -0.00 0.40 -0.05 -0.51 -4.06 0.00 0.00 176.95 172.73 1rst s LEU 109 N -3.19 1.32 -0.33 -4.66 1.43 -0.67 -2.05 118.68 110.53 1rst s LEU 109 Ca 0.22 -0.49 -0.08 0.00 -1.03 0.00 0.00 54.13 52.74 1rst s LEU 109 Cb -0.02 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.40 1rst s LEU 109 CO 0.08 -0.17 0.13 -0.22 0.23 0.00 0.00 176.35 176.39 1rst s LEU 110 N 1.71 4.19 -0.13 1.79 0.20 -0.03 -1.67 118.68 124.75 1rst s LEU 110 Ca 0.02 -0.82 -0.03 0.00 0.69 0.00 0.00 54.13 54.00 1rst s LEU 110 Cb -0.14 -1.94 -0.03 0.00 -0.43 0.00 0.00 46.19 43.65 1rst s LEU 110 CO -0.08 -0.26 -0.03 -0.89 -0.29 0.00 0.00 176.35 174.80 1rst s THR 111 N 1.52 4.01 0.02 3.68 2.01 -0.21 -0.84 115.64 125.82 1rst s THR 111 Ca 0.02 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 61.71 1rst s THR 111 Cb -0.18 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 1rst s THR 111 CO 0.04 0.53 0.00 -0.44 -0.69 0.00 0.00 174.62 174.07 1rst s SER 112 N -0.10 5.10 0.05 3.53 0.01 0.48 -1.20 113.70 121.58 1rst s SER 112 Ca 0.03 -0.04 -0.31 0.00 1.31 0.00 0.00 55.95 56.94 1rst s SER 112 Cb -0.13 -1.31 -0.07 0.00 0.21 0.00 0.00 66.02 64.72 1rst s SER 112 CO 0.02 0.26 1.45 -0.83 0.41 0.00 0.00 173.24 174.56 1rst s GLY 113 N -1.70 1.83 0.32 3.44 0.00 -0.13 -4.78 107.32 106.30 1rst s GLY 113 Ca 0.21 1.04 0.03 0.00 0.00 0.00 0.00 44.72 45.99 1rst s GLY 113 CO 0.12 2.54 0.10 -0.51 0.00 0.00 0.00 173.10 175.35 1rst s THR 114 N 1.99 0.73 0.78 0.90 -4.23 -1.26 -5.01 115.64 109.54 1rst s THR 114 Ca 0.66 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 59.08 1rst s THR 114 Cb -0.35 -2.60 0.10 0.00 1.34 0.00 0.00 72.50 70.98 1rst s THR 114 CO 0.29 0.00 1.11 0.42 -0.54 0.00 0.00 174.62 175.90 1rst s THR 115 N -3.47 2.14 0.23 3.99 -4.23 -1.26 -4.89 115.64 108.15 1rst s THR 115 Ca 0.34 -0.18 -0.08 0.00 -1.18 0.00 0.00 61.69 60.59 1rst s THR 115 Cb 0.06 -2.96 0.20 0.00 1.34 0.00 0.00 72.50 71.14 1rst s THR 115 CO 0.15 0.00 1.86 -0.33 -0.54 0.00 0.00 174.62 175.76 1rst h GLU 116 N -0.91 1.20 0.00 3.99 4.39 -2.01 -2.34 114.58 118.90 1rst h GLU 116 Ca -0.44 -0.13 -0.07 0.00 0.34 0.00 0.00 59.36 59.06 1rst h GLU 116 Cb 1.30 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.70 1rst h GLU 116 CO 0.56 0.87 -0.31 0.00 -1.16 0.00 0.00 179.01 178.96 1rst h ALA 117 N 1.27 1.48 -0.51 3.43 0.00 -2.07 -2.99 119.26 119.86 1rst h ALA 117 Ca 0.31 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1rst h ALA 117 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1rst h ALA 117 CO -0.05 0.39 0.00 0.09 0.00 0.00 0.00 179.25 179.68 1rst n ASN 118 N -4.15 3.20 0.28 0.00 5.03 -0.93 -4.49 115.26 114.20 1rst n ASN 118 Ca -0.02 -1.97 0.15 0.00 0.87 0.00 0.00 54.58 53.61 1rst n ASN 118 Cb 0.36 -0.34 0.87 0.00 -1.02 0.00 0.00 39.78 39.65 1rst n ASN 118 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1rst h ALA 119 N 4.24 1.63 -0.02 5.41 0.00 -1.29 -2.12 119.26 127.11 1rst h ALA 119 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1rst h ALA 119 Cb 0.84 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1rst h ALA 119 CO 0.00 -0.04 0.02 0.11 0.00 0.00 0.00 179.25 179.33 1rst h TRP 120 N 0.00 0.00 -0.49 0.00 5.08 -1.84 -1.14 115.95 117.56 1rst h TRP 120 Ca 0.01 0.00 -0.16 0.00 1.08 0.00 0.00 58.89 59.82 1rst h TRP 120 Cb 0.07 0.00 -0.10 0.00 -3.00 0.00 0.00 29.16 26.14 1rst h TRP 120 CO 0.00 0.00 0.11 0.36 -1.28 0.00 0.00 178.44 177.63 1rst n LYS 121 N -4.19 2.76 0.10 0.12 2.85 -0.80 -4.64 118.16 114.36 1rst n LYS 121 Ca -0.03 -3.04 -0.06 0.00 -1.05 0.00 0.00 58.31 54.14 1rst n LYS 121 Cb 0.11 -1.98 0.04 0.00 -0.65 0.00 0.00 35.03 32.55 1rst n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1rst h SER 122 N 1.74 0.13 -3.12 -5.58 4.64 -1.29 -3.46 113.55 106.62 1rst h SER 122 Ca 0.20 -0.10 -0.64 0.00 -0.47 0.00 0.00 61.79 60.78 1rst h SER 122 Cb 1.90 -0.04 -0.35 0.00 -0.31 0.00 0.00 62.40 63.60 1rst h SER 122 CO 0.50 0.87 -0.85 -0.89 -0.87 0.00 0.00 176.83 175.60 1rst s THR 123 N -3.28 1.84 0.07 2.95 2.01 -1.26 -0.39 115.64 117.58 1rst s THR 123 Ca -0.02 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1rst s THR 123 Cb 0.11 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.90 1rst s THR 123 CO 0.80 0.50 0.18 -0.76 -0.69 0.00 0.00 174.62 174.66 1rst s LEU 124 N 1.26 4.21 0.02 4.42 1.43 -0.02 -4.93 118.68 125.07 1rst s LEU 124 Ca 0.02 0.19 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 1rst s LEU 124 Cb -0.13 -2.83 -0.02 0.00 0.03 0.00 0.00 46.19 43.24 1rst s LEU 124 CO -0.10 0.17 -0.16 0.54 0.23 0.00 0.00 176.35 177.03 1rst s VAL 125 N -1.49 1.23 0.00 -1.59 0.11 -1.26 -0.85 120.40 116.56 1rst s VAL 125 Ca 0.33 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.48 1rst s VAL 125 Cb -0.13 -1.08 0.00 0.00 -1.53 0.00 0.00 36.38 33.65 1rst s VAL 125 CO 0.26 0.15 0.00 0.61 -3.33 0.00 0.00 175.10 172.80 1rst n GLY 126 N 2.17 2.25 3.25 6.54 0.00 -0.87 -5.00 105.19 113.53 1rst n GLY 126 Ca -0.17 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 1rst n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1rst s HIS 127 N -5.03 -0.13 0.02 1.61 -3.43 -1.26 -0.55 115.29 106.52 1rst s HIS 127 Ca 0.00 0.06 -0.02 0.00 -0.80 0.00 0.00 55.06 54.30 1rst s HIS 127 Cb 0.00 0.10 -0.02 0.00 -1.43 0.00 0.00 32.58 31.23 1rst s HIS 127 CO 0.00 -0.47 0.02 -0.51 -2.00 0.00 0.00 174.74 171.78 1rst s ASP 128 N -1.86 0.20 -0.10 7.38 1.01 -0.94 -4.95 116.67 117.41 1rst s ASP 128 Ca -0.07 -0.45 0.01 0.00 0.71 0.00 0.00 52.55 52.74 1rst s ASP 128 Cb -0.02 0.14 0.02 0.00 1.01 0.00 0.00 42.92 44.07 1rst s ASP 128 CO -0.01 -0.34 -0.10 -0.89 0.21 0.00 0.00 175.17 174.03 1rst s THR 129 N -1.63 1.16 -0.07 -1.27 2.01 -1.26 -1.25 115.64 113.34 1rst s THR 129 Ca -0.14 -0.41 -0.01 0.00 0.31 0.00 0.00 61.69 61.43 1rst s THR 129 Cb -0.08 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 1rst s THR 129 CO -0.01 0.38 -0.00 -0.36 -0.69 0.00 0.00 174.62 173.94 1rst s PHE 130 N 1.32 3.14 0.27 4.92 0.40 -0.46 -3.66 117.98 123.91 1rst s PHE 130 Ca -0.02 0.17 0.04 0.00 -0.60 0.00 0.00 56.93 56.52 1rst s PHE 130 Cb -0.14 -1.77 -0.06 0.00 0.51 0.00 0.00 43.02 41.57 1rst s PHE 130 CO -0.05 0.46 0.01 0.95 0.70 0.00 0.00 175.22 177.29 1rst s THR 131 N -0.91 1.21 -1.26 0.64 -4.23 -0.48 -1.69 115.64 108.91 1rst s THR 131 Ca 0.14 -2.04 0.27 0.00 -1.18 0.00 0.00 61.69 58.88 1rst s THR 131 Cb -0.11 -2.53 0.17 0.00 1.34 0.00 0.00 72.50 71.37 1rst s THR 131 CO 0.04 -0.20 1.60 0.29 -0.54 0.00 0.00 174.62 175.81 1rst n LYS 132 N -0.55 0.28 -3.98 3.99 5.02 -1.26 -0.83 118.16 120.83 1rst n LYS 132 Ca -0.04 -0.14 -0.36 0.00 -2.02 0.00 0.00 58.31 55.75 1rst n LYS 132 Cb 0.65 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.09 1rst n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1rst s VAL 133 N -2.81 5.23 -0.23 -0.18 1.01 -1.26 -4.86 120.40 117.30 1rst s VAL 133 Ca 0.17 0.10 -0.41 0.00 0.00 0.00 0.00 61.98 61.85 1rst s VAL 133 Cb 0.19 -3.27 -0.17 0.00 0.00 0.00 0.00 36.38 33.12 1rst s VAL 133 CO 0.60 0.60 1.56 0.29 0.00 0.00 0.00 175.10 178.15 1rst n LYS 134 N 2.14 0.75 0.00 2.72 4.76 -1.26 -4.69 118.16 122.58 1rst n LYS 134 Ca -0.19 0.27 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 1rst n LYS 134 Cb 0.54 -1.89 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 1rst n LYS 134 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73