#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bvs s ILE 2 N 0.00 2.38 0.00 1.12 1.01 -1.26 -5.00 121.20 119.45 1bvs s ILE 2 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 60.65 59.39 1bvs s ILE 2 Cb 0.00 -1.94 0.00 0.00 0.01 0.00 0.00 42.46 40.53 1bvs s ILE 2 CO 0.00 0.39 0.00 0.49 0.00 0.00 0.00 174.94 175.82 1bvs n PHE 3 N 1.81 0.00 -3.61 3.97 3.01 -1.26 -3.90 117.46 117.47 1bvs n PHE 3 Ca -0.17 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.16 1bvs n PHE 3 Cb 0.52 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.93 1bvs n PHE 3 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1bvs s SER 4 N -0.30 -0.39 -0.39 4.37 1.04 -1.26 0.51 113.70 117.28 1bvs s SER 4 Ca 0.00 0.17 0.02 0.00 0.48 0.00 0.00 55.95 56.62 1bvs s SER 4 Cb 0.00 0.46 0.16 0.00 0.10 0.00 0.00 66.02 66.74 1bvs s SER 4 CO 0.00 -0.67 0.28 -0.69 0.98 0.00 0.00 173.24 173.15 1bvs s VAL 5 N -2.23 0.29 -0.08 5.02 1.01 -1.25 -4.96 120.40 118.20 1bvs s VAL 5 Ca -0.07 -2.25 -0.28 0.00 0.00 0.00 0.00 61.98 59.39 1bvs s VAL 5 Cb -0.01 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 1bvs s VAL 5 CO -0.00 -1.12 0.91 -0.60 0.00 0.00 0.00 175.10 174.28 1bvs s ARG 6 N 0.50 4.44 0.00 2.72 3.52 -1.26 -3.60 118.95 125.27 1bvs s ARG 6 Ca 0.26 1.23 0.00 0.00 -0.13 0.00 0.00 55.73 57.09 1bvs s ARG 6 Cb -0.08 -3.50 0.00 0.00 -1.56 0.00 0.00 34.95 29.80 1bvs s ARG 6 CO -0.10 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 174.63 1bvs n GLY 7 N 3.11 2.75 3.36 8.12 0.00 -0.16 -4.65 105.19 117.72 1bvs n GLY 7 Ca 0.05 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1bvs n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bvs s GLU 8 N 2.62 3.45 -0.34 1.61 2.12 -1.20 -1.42 118.70 125.53 1bvs s GLU 8 Ca 0.00 -0.61 -0.29 0.00 0.36 0.00 0.00 54.97 54.43 1bvs s GLU 8 Cb 0.00 -2.92 0.01 0.00 0.26 0.00 0.00 34.13 31.47 1bvs s GLU 8 CO 0.00 -0.03 1.23 0.08 -0.54 0.00 0.00 175.26 176.01 1bvs s VAL 9 N 1.03 4.22 0.00 3.70 1.01 0.35 -1.77 120.40 128.94 1bvs s VAL 9 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.34 1bvs s VAL 9 Cb -0.15 -4.28 0.00 0.00 0.00 0.00 0.00 36.38 31.95 1bvs s VAL 9 CO -0.00 -0.57 0.00 0.18 0.00 0.00 0.00 175.10 174.71 1bvs n LEU 10 N 7.57 1.50 -4.94 3.92 4.77 -0.06 -0.20 117.00 129.57 1bvs n LEU 10 Ca 0.14 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.85 1bvs n LEU 10 Cb 0.47 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 1bvs n LEU 10 CO 0.64 0.00 -0.04 -0.70 -1.33 0.00 0.00 177.39 175.96 1bvs s GLU 11 N 0.00 3.47 -0.46 3.23 -6.30 -1.25 -4.55 118.70 112.84 1bvs s GLU 11 Ca 0.00 -0.49 0.05 0.00 -2.50 0.00 0.00 54.97 52.03 1bvs s GLU 11 Cb 0.00 -2.91 0.18 0.00 0.00 0.00 0.00 34.13 31.40 1bvs s GLU 11 CO 0.00 0.47 0.39 0.28 0.02 0.00 0.00 175.26 176.42 1bvs n VAL 12 N -0.61 -0.65 0.00 3.70 0.31 -1.26 0.88 118.33 120.70 1bvs n VAL 12 Ca -0.06 -3.75 0.00 0.00 -0.01 0.00 0.00 64.34 60.52 1bvs n VAL 12 Cb 0.54 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 1bvs n VAL 12 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bvs n ALA 13 N 2.50 0.00 -0.02 3.52 0.00 0.51 -4.93 120.51 122.09 1bvs n ALA 13 Ca 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.71 1bvs n ALA 13 Cb 0.46 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.91 1bvs n ALA 13 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bvs h LEU 14 N 0.00 0.00 0.00 0.00 4.07 -1.99 -3.44 115.31 113.95 1bvs h LEU 14 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1bvs h LEU 14 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1bvs h LEU 14 CO 0.00 0.26 0.00 -0.90 -1.08 0.00 0.00 178.44 176.72 1bvs n ASP 15 N -3.26 0.00 -4.50 -0.43 5.75 -1.26 -4.84 116.55 108.01 1bvs n ASP 15 Ca -0.01 0.23 -0.37 0.00 -0.01 0.00 0.00 54.79 54.64 1bvs n ASP 15 Cb 0.03 -0.29 0.06 0.00 -1.03 0.00 0.00 41.12 39.89 1bvs n ASP 15 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1bvs n HIS 16 N -1.53 -0.46 -3.62 2.11 8.25 -1.26 -2.77 115.22 115.94 1bvs n HIS 16 Ca 0.00 0.39 -0.15 0.00 -0.26 0.00 0.00 57.72 57.70 1bvs n HIS 16 Cb 0.00 -1.97 -0.07 0.00 1.12 0.00 0.00 29.99 29.08 1bvs n HIS 16 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bvs s ALA 17 N -1.80 -1.27 0.00 -1.41 0.00 -1.23 -0.36 121.76 115.70 1bvs s ALA 17 Ca 0.68 0.71 0.05 0.00 0.00 0.00 0.00 51.96 53.40 1bvs s ALA 17 Cb -0.38 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1bvs s ALA 17 CO 0.55 -0.39 -0.14 0.08 0.00 0.00 0.00 175.76 175.86 1bvs s VAL 18 N -1.74 1.13 -0.04 0.00 1.01 0.25 -0.94 120.40 120.07 1bvs s VAL 18 Ca -0.09 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1bvs s VAL 18 Cb -0.02 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.41 1bvs s VAL 18 CO 0.04 0.24 -0.10 -0.63 0.00 0.00 0.00 175.10 174.64 1bvs s ILE 19 N -0.47 0.94 -0.73 2.22 1.01 -0.99 -0.88 121.20 122.30 1bvs s ILE 19 Ca 0.05 -0.41 -0.19 0.00 0.00 0.00 0.00 60.65 60.10 1bvs s ILE 19 Cb -0.06 -0.85 0.11 0.00 0.01 0.00 0.00 42.46 41.68 1bvs s ILE 19 CO -0.00 0.30 0.90 -0.70 0.00 0.00 0.00 174.94 175.44 1bvs s GLU 20 N 0.41 3.28 -0.84 2.79 2.12 -0.73 0.13 118.70 125.87 1bvs s GLU 20 Ca -0.08 -1.44 -0.25 0.00 0.36 0.00 0.00 54.97 53.56 1bvs s GLU 20 Cb -0.12 -4.47 0.05 0.00 0.26 0.00 0.00 34.13 29.85 1bvs s GLU 20 CO 0.02 -1.66 1.30 0.00 -0.54 0.00 0.00 175.26 174.38 1bvs s ALA 21 N 2.78 2.80 -0.26 6.30 0.00 0.43 -3.27 121.76 130.55 1bvs s ALA 21 Ca 0.21 -1.80 -0.23 0.00 0.00 0.00 0.00 51.96 50.14 1bvs s ALA 21 Cb -0.15 -4.30 0.03 0.00 0.00 0.00 0.00 23.12 18.70 1bvs s ALA 21 CO 0.01 -3.34 0.39 0.00 0.00 0.00 0.00 175.76 172.82 1bvs n ALA 22 N 8.90 -1.89 0.00 0.00 0.00 -1.26 -2.90 120.51 123.36 1bvs n ALA 22 Ca 0.14 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1bvs n ALA 22 Cb 0.49 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1bvs n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bvs n GLY 23 N 0.12 1.02 3.70 0.00 0.00 -1.26 -4.99 105.19 103.77 1bvs n GLY 23 Ca -0.05 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.12 1bvs n GLY 23 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bvs n ILE 24 N 0.00 3.44 -4.34 -0.61 -0.00 -1.14 -4.89 119.36 111.82 1bvs n ILE 24 Ca 0.00 -0.36 -0.30 0.00 -0.00 0.00 0.00 62.75 62.09 1bvs n ILE 24 Cb 0.00 -1.32 -0.17 0.00 -0.00 0.00 0.00 39.64 38.16 1bvs n ILE 24 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1bvs s GLY 25 N -1.73 1.16 -0.14 7.39 0.00 -1.25 0.16 107.32 112.90 1bvs s GLY 25 Ca 0.78 -0.90 -0.11 0.00 0.00 0.00 0.00 44.72 44.49 1bvs s GLY 25 CO 0.46 0.28 0.22 -0.19 0.00 0.00 0.00 173.10 173.87 1bvs s TYR 26 N 1.13 3.51 -0.18 1.90 1.51 0.12 -4.85 117.35 120.49 1bvs s TYR 26 Ca -0.02 0.55 -0.28 0.00 -1.01 0.00 0.00 57.07 56.30 1bvs s TYR 26 Cb -0.14 -2.19 -0.00 0.00 -0.11 0.00 0.00 41.96 39.52 1bvs s TYR 26 CO -0.05 0.42 0.98 0.50 -1.11 0.00 0.00 175.55 176.28 1bvs s ARG 27 N -0.09 4.31 -0.54 -0.62 3.00 -1.26 -2.34 118.95 121.41 1bvs s ARG 27 Ca 0.14 1.28 0.04 0.00 -1.00 0.00 0.00 55.73 56.19 1bvs s ARG 27 Cb -0.13 -3.60 0.14 0.00 0.00 0.00 0.00 34.95 31.37 1bvs s ARG 27 CO 0.03 -0.46 0.32 0.08 0.00 0.00 0.00 175.30 175.27 1bvs s VAL 28 N 2.60 2.17 0.21 7.11 1.01 -0.12 -4.49 120.40 128.89 1bvs s VAL 28 Ca 0.44 -3.30 -0.31 0.00 0.00 0.00 0.00 61.98 58.81 1bvs s VAL 28 Cb -0.16 -2.49 -0.15 0.00 0.00 0.00 0.00 36.38 33.58 1bvs s VAL 28 CO 0.11 -0.91 1.07 0.59 0.00 0.00 0.00 175.10 175.96 1bvs n ASN 29 N 2.93 1.11 -0.81 3.32 5.03 -0.76 -3.52 115.26 122.56 1bvs n ASN 29 Ca 0.11 1.15 0.00 0.00 0.87 0.00 0.00 54.58 56.72 1bvs n ASN 29 Cb 0.35 -1.21 0.00 0.00 -1.02 0.00 0.00 39.78 37.89 1bvs n ASN 29 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bvs n ALA 30 N 1.00 0.00 -2.41 5.41 0.00 -1.11 0.41 120.51 123.81 1bvs n ALA 30 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.37 1bvs n ALA 30 Cb 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 1bvs n ALA 30 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1bvs s THR 31 N -2.92 2.05 0.11 0.00 -4.23 -1.24 -4.68 115.64 104.73 1bvs s THR 31 Ca 0.00 -2.29 -0.21 0.00 -1.18 0.00 0.00 61.69 58.01 1bvs s THR 31 Cb 0.00 -2.19 -0.05 0.00 1.34 0.00 0.00 72.50 71.61 1bvs s THR 31 CO 0.00 -0.49 1.29 -0.81 -0.54 0.00 0.00 174.62 174.07 1bvs n PRO 32 N -0.50 -0.30 -0.38 3.99 -0.04 -1.26 0.13 135.00 136.63 1bvs n PRO 32 Ca -0.07 1.27 0.34 0.00 -0.04 0.00 0.00 63.50 65.01 1bvs n PRO 32 Cb 0.60 -1.88 0.59 0.00 -0.04 0.00 0.00 33.50 32.78 1bvs n PRO 32 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1bvs n SER 33 N -4.59 0.24 -0.04 3.54 7.64 -1.26 0.13 113.62 119.28 1bvs n SER 33 Ca 0.01 1.35 -0.03 0.00 1.01 0.00 0.00 58.87 61.22 1bvs n SER 33 Cb 0.18 -0.66 -0.01 0.00 -1.01 0.00 0.00 64.21 62.70 1bvs n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bvs n ALA 34 N -2.46 0.32 -0.44 -0.43 0.00 0.35 -4.21 120.51 113.64 1bvs n ALA 34 Ca 0.36 -0.39 0.41 0.00 0.00 0.00 0.00 53.44 53.82 1bvs n ALA 34 Cb 1.35 0.01 0.68 0.00 0.00 0.00 0.00 19.45 21.49 1bvs n ALA 34 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bvs h LEU 35 N -0.52 0.00 0.00 0.00 3.38 0.13 0.21 115.31 118.51 1bvs h LEU 35 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bvs h LEU 35 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1bvs h LEU 35 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 1bvs n ALA 36 N -2.64 -0.29 -1.35 1.53 0.00 0.12 -3.21 120.51 114.67 1bvs n ALA 36 Ca 0.33 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.41 1bvs n ALA 36 Cb 1.67 0.03 -0.08 0.00 0.00 0.00 0.00 19.45 21.07 1bvs n ALA 36 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bvs n THR 37 N -1.50 1.28 -3.19 0.00 -2.24 0.75 -4.66 114.28 104.72 1bvs n THR 37 Ca 0.00 -1.22 0.01 0.00 -2.27 0.00 0.00 64.05 60.57 1bvs n THR 37 Cb 0.00 -2.18 -0.02 0.00 -2.10 0.00 0.00 70.33 66.03 1bvs n THR 37 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1bvs s LEU 38 N 5.85 -1.31 -0.33 3.22 2.96 -1.20 -4.96 118.68 122.92 1bvs s LEU 38 Ca 0.66 0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 54.92 1bvs s LEU 38 Cb 0.08 1.88 0.01 0.00 0.50 0.00 0.00 46.19 48.66 1bvs s LEU 38 CO 0.18 -0.29 0.14 0.20 -1.32 0.00 0.00 176.35 175.26 1bvs s ASN 39 N 2.78 5.43 0.72 3.68 0.01 -1.26 -5.04 114.94 121.25 1bvs s ASN 39 Ca 0.15 -0.79 -0.17 0.00 -0.71 0.00 0.00 52.86 51.33 1bvs s ASN 39 Cb -0.13 -1.95 -0.14 0.00 0.41 0.00 0.00 41.25 39.44 1bvs s ASN 39 CO -0.23 -0.26 -0.32 1.67 -1.51 0.00 0.00 177.10 176.45 1bvs n GLN 40 N 4.92 0.03 -0.35 -0.60 7.27 -1.26 -0.21 117.38 127.17 1bvs n GLN 40 Ca -0.13 0.01 0.00 0.00 0.07 0.00 0.00 57.00 56.95 1bvs n GLN 40 Cb 0.47 -1.09 0.00 0.00 2.41 0.00 0.00 30.24 32.03 1bvs n GLN 40 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1bvs n GLY 41 N 2.80 0.67 3.94 1.69 0.00 0.72 -4.94 105.19 110.07 1bvs n GLY 41 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1bvs n GLY 41 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bvs s SER 42 N -2.51 6.35 0.61 1.61 0.15 0.70 -4.82 113.70 115.80 1bvs s SER 42 Ca 0.00 0.27 -0.07 0.00 0.70 0.00 0.00 55.95 56.85 1bvs s SER 42 Cb 0.00 -1.95 0.00 0.00 -1.71 0.00 0.00 66.02 62.36 1bvs s SER 42 CO 0.00 -0.03 0.94 -1.58 1.20 0.00 0.00 173.24 173.77 1bvs s GLN 43 N -3.46 2.99 0.00 5.44 2.00 -1.26 -0.50 119.66 124.87 1bvs s GLN 43 Ca 0.36 0.14 0.00 0.00 -2.00 0.00 0.00 55.36 53.87 1bvs s GLN 43 Cb -0.11 -2.22 0.00 0.00 0.80 0.00 0.00 33.01 31.48 1bvs s GLN 43 CO 0.29 -0.72 0.00 0.00 -0.50 0.00 0.00 175.29 174.36 1bvs n ALA 44 N -2.65 0.00 -2.77 1.58 0.00 -0.51 -4.83 120.51 111.33 1bvs n ALA 44 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.21 1bvs n ALA 44 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.96 1bvs n ALA 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1bvs s ARG 45 N -0.59 2.82 -0.27 0.00 3.52 -1.26 -0.99 118.95 122.17 1bvs s ARG 45 Ca 0.00 -0.82 -0.07 0.00 -0.13 0.00 0.00 55.73 54.71 1bvs s ARG 45 Cb 0.00 -2.64 0.14 0.00 -1.56 0.00 0.00 34.95 30.88 1bvs s ARG 45 CO 0.00 0.52 0.56 -0.48 -0.81 0.00 0.00 175.30 175.09 1bvs s LEU 46 N -2.76 -1.05 -0.12 -0.88 0.05 -1.24 -4.91 118.68 107.77 1bvs s LEU 46 Ca 0.30 1.17 -0.35 0.00 0.05 0.00 0.00 54.13 55.29 1bvs s LEU 46 Cb -0.11 1.96 -0.17 0.00 -2.05 0.00 0.00 46.19 45.83 1bvs s LEU 46 CO 0.22 -0.24 1.02 0.52 -0.55 0.00 0.00 176.35 177.32 1bvs n VAL 47 N 5.42 0.00 -3.98 1.48 0.31 -1.12 -3.83 118.33 116.62 1bvs n VAL 47 Ca -0.08 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 63.99 1bvs n VAL 47 Cb 0.50 -0.12 -0.02 0.00 -0.91 0.00 0.00 33.84 33.28 1bvs n VAL 47 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1bvs s THR 48 N 0.74 1.71 -0.30 2.52 2.01 0.18 -0.01 115.64 122.50 1bvs s THR 48 Ca 0.79 -1.55 -0.07 0.00 0.31 0.00 0.00 61.69 61.16 1bvs s THR 48 Cb -1.11 -2.27 0.19 0.00 0.01 0.00 0.00 72.50 69.33 1bvs s THR 48 CO 0.53 0.00 0.94 0.00 -0.69 0.00 0.00 174.62 175.40 1bvs s ALA 49 N -2.75 -3.65 -0.54 7.40 0.00 -0.73 -4.79 121.76 116.71 1bvs s ALA 49 Ca 0.32 1.30 -0.22 0.00 0.00 0.00 0.00 51.96 53.36 1bvs s ALA 49 Cb -0.01 -2.75 0.05 0.00 0.00 0.00 0.00 23.12 20.40 1bvs s ALA 49 CO 0.20 -2.01 0.83 1.41 0.00 0.00 0.00 175.76 176.19 1bvs s MET 50 N 2.93 3.25 0.03 0.00 1.75 -1.25 -2.41 119.30 123.59 1bvs s MET 50 Ca 0.23 -0.51 -0.22 0.00 -1.25 0.00 0.00 55.69 53.94 1bvs s MET 50 Cb -0.04 -4.08 -0.06 0.00 2.84 0.00 0.00 34.83 33.50 1bvs s MET 50 CO -0.23 -1.40 0.65 0.08 -0.65 0.00 0.00 175.02 173.46 1bvs s VAL 51 N 3.48 4.81 -0.02 10.11 1.01 -0.71 -4.61 120.40 134.48 1bvs s VAL 51 Ca 0.25 1.37 0.07 0.00 0.00 0.00 0.00 61.98 63.66 1bvs s VAL 51 Cb -0.15 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 1bvs s VAL 51 CO 0.16 0.42 -0.23 -0.69 0.00 0.00 0.00 175.10 174.76 1bvs s VAL 52 N -0.30 1.83 0.21 2.92 1.01 -1.26 -2.56 120.40 122.24 1bvs s VAL 52 Ca 0.33 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 1bvs s VAL 52 Cb -0.19 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 1bvs s VAL 52 CO 0.19 0.52 0.20 -0.13 0.00 0.00 0.00 175.10 175.88 1bvs s ARG 53 N -0.54 1.29 0.42 2.72 1.81 -1.15 -4.98 118.95 118.52 1bvs s ARG 53 Ca 0.09 -1.58 0.16 0.00 -1.72 0.00 0.00 55.73 52.68 1bvs s ARG 53 Cb -0.09 0.31 1.05 0.00 -0.45 0.00 0.00 34.95 35.77 1bvs s ARG 53 CO -0.01 -0.45 1.89 1.49 -0.68 0.00 0.00 175.30 177.54 1bvs h GLU 54 N 2.53 0.42 -0.30 3.54 4.81 -2.07 -2.10 114.58 121.42 1bvs h GLU 54 Ca -0.34 -0.03 -0.24 0.00 -0.13 0.00 0.00 59.36 58.63 1bvs h GLU 54 Cb 1.25 -0.09 -0.25 0.00 0.63 0.00 0.00 28.75 30.29 1bvs h GLU 54 CO 0.49 0.28 -0.76 -0.40 -0.73 0.00 0.00 179.01 177.89 1bvs n ASP 55 N -4.50 2.63 -3.83 1.04 5.68 -1.26 -5.07 116.55 111.25 1bvs n ASP 55 Ca 0.17 -3.34 -0.09 0.00 -0.50 0.00 0.00 54.79 51.03 1bvs n ASP 55 Cb 0.61 -0.43 -0.05 0.00 -1.14 0.00 0.00 41.12 40.11 1bvs n ASP 55 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1bvs s SER 56 N -3.24 -0.14 -0.41 -1.12 0.01 -0.79 -5.03 113.70 102.98 1bvs s SER 56 Ca 0.40 -0.64 0.05 0.00 1.31 0.00 0.00 55.95 57.08 1bvs s SER 56 Cb 0.38 0.53 0.32 0.00 0.21 0.00 0.00 66.02 67.45 1bvs s SER 56 CO -0.05 -1.00 1.22 0.23 0.41 0.00 0.00 173.24 174.05 1bvs n MET 57 N -0.29 0.64 -3.29 12.44 2.81 -1.26 -2.92 117.12 125.25 1bvs n MET 57 Ca -0.09 -1.41 -0.30 0.00 -1.81 0.00 0.00 57.70 54.09 1bvs n MET 57 Cb 0.63 -0.70 -0.04 0.00 -0.71 0.00 0.00 33.22 32.40 1bvs n MET 57 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1bvs s THR 58 N 0.20 4.94 -0.04 2.03 -1.32 -1.06 -4.97 115.64 115.42 1bvs s THR 58 Ca 0.22 0.34 0.04 0.00 -1.21 0.00 0.00 61.69 61.09 1bvs s THR 58 Cb 0.29 -3.68 -0.00 0.00 -1.51 0.00 0.00 72.50 67.59 1bvs s THR 58 CO -0.12 -0.24 -0.17 -0.76 -2.21 0.00 0.00 174.62 171.11 1bvs s LEU 59 N -3.27 1.93 -0.01 9.08 1.43 -1.26 -1.73 118.68 124.85 1bvs s LEU 59 Ca 0.47 -0.36 0.07 0.00 -1.03 0.00 0.00 54.13 53.28 1bvs s LEU 59 Cb -0.11 -0.98 -0.03 0.00 0.03 0.00 0.00 46.19 45.11 1bvs s LEU 59 CO 0.26 0.16 -0.21 -0.31 0.23 0.00 0.00 176.35 176.48 1bvs s TYR 60 N -0.00 2.48 0.05 0.29 1.51 -1.01 -1.84 117.35 118.83 1bvs s TYR 60 Ca -0.03 -0.32 0.06 0.00 -1.01 0.00 0.00 57.07 55.78 1bvs s TYR 60 Cb -0.11 -1.51 -0.02 0.00 -0.11 0.00 0.00 41.96 40.20 1bvs s TYR 60 CO 0.02 0.11 -0.18 0.20 -1.11 0.00 0.00 175.55 174.59 1bvs s GLY 61 N -0.92 1.00 0.07 0.71 0.00 0.16 -1.78 107.32 106.57 1bvs s GLY 61 Ca 0.12 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1bvs s GLY 61 CO 0.01 -0.94 -0.05 -1.36 0.00 0.00 0.00 173.10 170.76 1bvs s PHE 62 N -0.86 0.70 0.56 1.90 0.40 0.98 -3.69 117.98 117.97 1bvs s PHE 62 Ca 0.05 -0.97 0.28 0.00 -0.60 0.00 0.00 56.93 55.69 1bvs s PHE 62 Cb -0.09 -0.45 1.47 0.00 0.51 0.00 0.00 43.02 44.46 1bvs s PHE 62 CO 0.02 -0.26 1.95 0.66 0.70 0.00 0.00 175.22 178.29 1bvs h SER 63 N 3.11 0.00 -5.04 1.36 4.64 -1.90 -2.95 113.55 112.76 1bvs h SER 63 Ca -0.35 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.93 1bvs h SER 63 Cb 1.15 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.11 1bvs h SER 63 CO 0.64 0.00 0.03 1.51 -0.87 0.00 0.00 176.83 178.15 1bvs s ASP 64 N -5.72 -0.39 0.55 4.97 1.47 -1.26 -4.70 116.67 111.60 1bvs s ASP 64 Ca -0.05 -0.07 0.30 0.00 1.18 0.00 0.00 52.55 53.91 1bvs s ASP 64 Cb 0.18 0.51 1.46 0.00 -0.34 0.00 0.00 42.92 44.74 1bvs s ASP 64 CO 0.66 -0.84 1.90 0.00 0.68 0.00 0.00 175.17 177.58 1bvs h ALA 65 N 2.42 2.59 -1.32 2.11 0.00 -1.95 -1.92 119.26 121.19 1bvs h ALA 65 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1bvs h ALA 65 Cb 1.26 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1bvs h ALA 65 CO 0.43 -0.93 0.00 0.39 0.00 0.00 0.00 179.25 179.14 1bvs n GLU 66 N -4.09 0.00 0.00 0.00 4.71 -1.26 -2.20 120.64 117.80 1bvs n GLU 66 Ca 0.14 0.28 0.00 0.00 -0.01 0.00 0.00 57.16 57.57 1bvs n GLU 66 Cb 0.83 -1.24 0.00 0.00 -1.01 0.00 0.00 31.44 30.02 1bvs n GLU 66 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1bvs n ASN 67 N -1.34 0.00 -0.10 1.62 4.13 -0.77 -0.87 115.26 117.94 1bvs n ASN 67 Ca 0.00 0.14 -0.23 0.00 1.68 0.00 0.00 54.58 56.17 1bvs n ASN 67 Cb 0.00 -0.14 -0.12 0.00 -1.54 0.00 0.00 39.78 37.99 1bvs n ASN 67 CO 0.00 0.00 0.00 -2.11 0.28 0.00 0.00 177.26 175.43 1bvs n ARG 68 N -1.02 0.65 -0.25 3.52 1.85 -0.93 -3.91 116.66 116.56 1bvs n ARG 68 Ca 0.00 0.28 0.01 0.00 -1.00 0.00 0.00 57.85 57.14 1bvs n ARG 68 Cb 0.13 -1.59 0.13 0.00 -1.05 0.00 0.00 32.46 30.08 1bvs n ARG 68 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1bvs h ASP 69 N -0.42 0.52 -0.41 2.89 5.19 -0.51 0.25 116.42 123.94 1bvs h ASP 69 Ca -0.54 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 55.91 1bvs h ASP 69 Cb 1.76 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 41.20 1bvs h ASP 69 CO -0.16 0.31 0.23 -0.07 -3.12 0.00 0.00 179.24 176.43 1bvs h LEU 70 N 0.66 0.51 -0.24 1.55 3.38 -1.76 0.67 115.31 120.08 1bvs h LEU 70 Ca 0.34 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.26 1bvs h LEU 70 Cb 0.32 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1bvs h LEU 70 CO -0.24 0.44 -0.37 0.15 0.09 0.00 0.00 178.44 178.51 1bvs h PHE 71 N 0.53 -1.13 -0.77 1.13 3.57 -0.76 1.75 116.94 121.26 1bvs h PHE 71 Ca 0.15 0.05 0.18 0.00 3.53 0.00 0.00 57.97 61.88 1bvs h PHE 71 Cb 0.04 0.53 -0.13 0.00 2.79 0.00 0.00 35.95 39.17 1bvs h PHE 71 CO -0.03 -0.34 0.06 -0.07 -2.23 0.00 0.00 178.31 175.71 1bvs h LEU 72 N -0.29 -0.26 0.00 0.59 3.38 -0.17 1.24 115.31 119.80 1bvs h LEU 72 Ca 0.04 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1bvs h LEU 72 Cb 0.41 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1bvs h LEU 72 CO -0.38 -0.16 0.00 0.00 0.09 0.00 0.00 178.44 177.99 1bvs n ALA 73 N -2.88 -0.15 -0.31 1.53 0.00 0.35 0.37 120.51 119.41 1bvs n ALA 73 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.73 1bvs n ALA 73 Cb 0.51 0.18 0.30 0.00 0.00 0.00 0.00 19.45 20.43 1bvs n ALA 73 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bvs h LEU 74 N 0.00 -0.21 -0.88 0.00 4.07 0.35 2.18 115.31 120.82 1bvs h LEU 74 Ca 0.00 0.24 0.20 0.00 0.08 0.00 0.00 57.88 58.40 1bvs h LEU 74 Cb 0.00 0.37 -0.12 0.00 1.08 0.00 0.00 40.66 41.99 1bvs h LEU 74 CO 0.00 -0.27 0.38 0.25 -1.08 0.00 0.00 178.44 177.73 1bvs h LEU 75 N 0.10 0.34 -2.19 1.67 5.85 0.30 0.25 115.31 121.62 1bvs h LEU 75 Ca 0.58 0.14 0.06 0.00 0.84 0.00 0.00 57.88 59.51 1bvs h LEU 75 Cb 1.22 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.36 1bvs h LEU 75 CO -0.78 0.03 0.22 -1.28 -0.34 0.00 0.00 178.44 176.29 1bvs h SER 76 N 0.43 0.00 -3.25 1.25 0.87 0.85 -3.42 113.55 110.27 1bvs h SER 76 Ca 0.53 0.00 -0.41 0.00 -1.23 0.00 0.00 61.79 60.68 1bvs h SER 76 Cb 0.96 0.00 0.21 0.00 -0.44 0.00 0.00 62.40 63.13 1bvs h SER 76 CO -0.50 0.00 -0.01 -0.69 -0.53 0.00 0.00 176.83 175.10 1bvs s VAL 77 N -4.67 1.57 0.57 2.23 1.01 0.88 -5.00 120.40 116.99 1bvs s VAL 77 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.79 1bvs s VAL 77 Cb 0.16 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 1bvs s VAL 77 CO 0.56 0.00 1.02 -0.44 0.00 0.00 0.00 175.10 176.24 1bvs s SER 78 N -3.16 6.24 0.00 3.32 0.01 -1.26 -4.57 113.70 114.28 1bvs s SER 78 Ca 0.69 1.58 0.00 0.00 1.31 0.00 0.00 55.95 59.53 1bvs s SER 78 Cb -0.16 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.57 1bvs s SER 78 CO 0.59 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 174.00 1bvs n GLY 79 N -1.80 0.10 0.00 3.44 0.00 -1.26 -4.68 105.19 101.00 1bvs n GLY 79 Ca 0.07 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1bvs n GLY 79 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1bvs n VAL 80 N 0.00 0.00 0.00 1.61 0.24 -1.26 -4.92 118.33 114.00 1bvs n VAL 80 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1bvs n VAL 80 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1bvs n VAL 80 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bvs n GLY 81 N 0.00 -0.23 0.35 7.63 0.00 -1.26 -4.21 105.19 107.47 1bvs n GLY 81 Ca 0.00 -1.67 0.16 0.00 0.00 0.00 0.00 46.02 44.50 1bvs n GLY 81 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bvs h PRO 82 N 0.00 0.00 0.00 1.61 0.11 -1.93 -0.36 132.00 131.42 1bvs h PRO 82 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1bvs h PRO 82 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1bvs h PRO 82 CO 0.00 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.33 1bvs n ARG 83 N -3.02 0.00 0.00 1.05 1.74 -1.26 -1.21 116.66 113.95 1bvs n ARG 83 Ca -0.00 0.36 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1bvs n ARG 83 Cb 0.46 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.87 1bvs n ARG 83 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1bvs n LEU 84 N -0.94 0.00 0.00 0.55 4.32 -0.29 -1.72 117.00 118.92 1bvs n LEU 84 Ca 0.00 0.52 0.00 0.00 -0.02 0.00 0.00 56.01 56.51 1bvs n LEU 84 Cb 0.00 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.78 1bvs n LEU 84 CO 0.00 -0.02 0.00 0.00 -1.22 0.00 0.00 177.39 176.15 1bvs n ALA 85 N -0.59 0.00 -0.20 -1.18 0.00 -0.35 0.37 120.51 118.56 1bvs n ALA 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bvs n ALA 85 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bvs n ALA 85 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1bvs n MET 86 N -2.39 0.00 -0.23 0.00 2.81 -0.35 -1.25 117.12 115.71 1bvs n MET 86 Ca 0.00 0.43 -0.01 0.00 -1.81 0.00 0.00 57.70 56.31 1bvs n MET 86 Cb 0.00 -1.40 0.02 0.00 -0.71 0.00 0.00 33.22 31.13 1bvs n MET 86 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1bvs n ALA 87 N -1.76 -0.09 -0.00 3.04 0.00 1.16 0.12 120.51 122.97 1bvs n ALA 87 Ca 0.00 0.58 -0.03 0.00 0.00 0.00 0.00 53.44 53.99 1bvs n ALA 87 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 19.45 19.18 1bvs n ALA 87 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1bvs h THR 88 N 0.00 0.00 0.00 0.00 2.02 0.32 0.68 112.91 115.93 1bvs h THR 88 Ca 0.20 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.38 1bvs h THR 88 Cb 0.34 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.75 1bvs h THR 88 CO -0.58 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.49 1bvs n LEU 89 N -3.15 0.29 -0.05 2.58 4.77 0.94 -0.57 117.00 121.81 1bvs n LEU 89 Ca -0.01 0.63 -0.16 0.00 -0.03 0.00 0.00 56.01 56.44 1bvs n LEU 89 Cb 0.07 -0.67 -0.06 0.00 -2.33 0.00 0.00 43.42 40.44 1bvs n LEU 89 CO 0.01 -0.72 0.35 0.00 -1.33 0.00 0.00 177.39 175.71 1bvs h ALA 90 N 2.02 0.35 -3.00 -1.18 0.00 0.68 -3.40 119.26 114.72 1bvs h ALA 90 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1bvs h ALA 90 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1bvs h ALA 90 CO 0.00 0.63 0.00 0.28 0.00 0.00 0.00 179.25 180.16 1bvs n VAL 91 N -4.02 0.00 -1.65 0.00 0.31 0.26 -4.82 118.33 108.41 1bvs n VAL 91 Ca -0.06 0.00 -0.47 0.00 -0.01 0.00 0.00 64.34 63.79 1bvs n VAL 91 Cb 0.67 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.56 1bvs n VAL 91 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1bvs n HIS 92 N 0.00 2.03 0.00 3.52 -0.00 -1.26 -4.96 115.22 114.55 1bvs n HIS 92 Ca 0.00 0.40 0.00 0.00 -0.00 0.00 0.00 57.72 58.12 1bvs n HIS 92 Cb 0.00 -2.47 0.00 0.00 -0.00 0.00 0.00 29.99 27.52 1bvs n HIS 92 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1bvs n ASP 93 N 2.94 0.00 -1.70 0.41 5.75 -1.26 -4.64 116.55 118.04 1bvs n ASP 93 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.94 1bvs n ASP 93 Cb 0.27 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1bvs n ASP 93 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bvs n ALA 94 N -3.00 0.00 0.00 2.12 0.00 -1.26 -3.60 120.51 114.77 1bvs n ALA 94 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bvs n ALA 94 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bvs n ALA 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bvs n ALA 95 N -3.00 0.00 0.00 0.00 0.00 -1.26 -1.39 120.51 114.86 1bvs n ALA 95 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bvs n ALA 95 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bvs n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bvs n ALA 96 N 4.54 0.00 -0.96 0.00 0.00 -1.26 0.31 120.51 123.15 1bvs n ALA 96 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bvs n ALA 96 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1bvs n ALA 96 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1bvs n LEU 97 N -2.17 0.10 -0.12 0.00 7.94 -0.48 0.71 117.00 122.99 1bvs n LEU 97 Ca 0.00 0.50 0.02 0.00 -1.11 0.00 0.00 56.01 55.42 1bvs n LEU 97 Cb 0.00 -0.02 0.05 0.00 0.53 0.00 0.00 43.42 43.98 1bvs n LEU 97 CO 0.00 -0.02 0.22 0.54 -1.11 0.00 0.00 177.39 177.02 1bvs n ARG 98 N -0.56 -0.03 0.00 1.96 1.74 0.93 0.18 116.66 120.89 1bvs n ARG 98 Ca 0.00 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.59 1bvs n ARG 98 Cb 0.00 -0.77 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 1bvs n ARG 98 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1bvs n GLN 99 N -4.52 0.00 0.00 5.56 1.13 0.98 -1.17 117.38 119.36 1bvs n GLN 99 Ca 0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.12 1bvs n GLN 99 Cb 0.17 -0.53 0.00 0.00 0.11 0.00 0.00 30.24 29.99 1bvs n GLN 99 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bvs n ALA 100 N -2.85 0.00 -0.06 -1.58 0.00 0.22 0.41 120.51 116.65 1bvs n ALA 100 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1bvs n ALA 100 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1bvs n ALA 100 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bvs h LEU 101 N 0.00 -0.32 0.00 0.00 4.07 -0.88 2.23 115.31 120.42 1bvs h LEU 101 Ca 0.00 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1bvs h LEU 101 Cb 0.00 0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.88 1bvs h LEU 101 CO 0.00 -0.03 0.00 0.00 -1.08 0.00 0.00 178.44 177.33 1bvs n ALA 102 N -3.03 0.00 0.63 1.53 0.00 1.39 0.11 120.51 121.13 1bvs n ALA 102 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1bvs n ALA 102 Cb 0.04 0.25 0.05 0.00 0.00 0.00 0.00 19.45 19.79 1bvs n ALA 102 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bvs n ASP 103 N -1.09 0.00 -4.13 0.00 5.75 -1.01 -4.80 116.55 111.28 1bvs n ASP 103 Ca 0.00 -0.58 -0.38 0.00 -0.01 0.00 0.00 54.79 53.81 1bvs n ASP 103 Cb 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 1bvs n ASP 103 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1bvs n SER 104 N -0.58 -1.89 0.12 -1.12 3.41 0.74 -4.81 113.62 109.49 1bvs n SER 104 Ca 0.01 -1.22 -0.13 0.00 -0.26 0.00 0.00 58.87 57.27 1bvs n SER 104 Cb 0.01 -1.49 -0.08 0.00 -0.26 0.00 0.00 64.21 62.39 1bvs n SER 104 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1bvs h ASP 105 N -2.05 -1.20 0.00 4.04 1.82 -1.32 -3.44 116.42 114.27 1bvs h ASP 105 Ca -0.65 0.12 0.00 0.00 -0.39 0.00 0.00 57.03 56.11 1bvs h ASP 105 Cb 1.32 0.43 0.00 0.00 0.68 0.00 0.00 39.33 41.76 1bvs h ASP 105 CO 0.56 -0.45 0.00 0.52 -1.61 0.00 0.00 179.24 178.26 1bvs n VAL 106 N -4.78 0.00 0.00 2.25 0.31 -1.26 -4.65 118.33 110.20 1bvs n VAL 106 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1bvs n VAL 106 Cb 0.33 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.26 1bvs n VAL 106 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bvs n ALA 107 N 0.00 0.00 -0.10 3.52 0.00 -1.26 -1.85 120.51 120.82 1bvs n ALA 107 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1bvs n ALA 107 Cb 0.00 0.17 -0.02 0.00 0.00 0.00 0.00 19.45 19.60 1bvs n ALA 107 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bvs n SER 108 N -0.82 -0.23 0.00 0.00 3.41 -1.26 -2.86 113.62 111.85 1bvs n SER 108 Ca 0.00 0.43 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 1bvs n SER 108 Cb 0.00 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 1bvs n SER 108 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1bvs n LEU 109 N -4.32 0.00 0.00 1.04 4.77 -0.77 -0.11 117.00 117.61 1bvs n LEU 109 Ca 0.01 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1bvs n LEU 109 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1bvs n LEU 109 CO -0.04 0.00 0.29 1.07 -1.33 0.00 0.00 177.39 177.38 1bvs n THR 110 N -0.18 0.00 -0.22 -5.08 5.66 -1.14 -0.84 114.28 112.48 1bvs n THR 110 Ca 0.00 0.29 -0.05 0.00 -3.05 0.00 0.00 64.05 61.24 1bvs n THR 110 Cb 0.00 -1.14 0.01 0.00 -1.55 0.00 0.00 70.33 67.65 1bvs n THR 110 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1bvs h ARG 111 N 0.00 -0.14 -6.76 1.09 3.08 -0.63 -3.40 114.38 107.63 1bvs h ARG 111 Ca 0.00 0.01 -0.39 0.00 0.07 0.00 0.00 59.98 59.67 1bvs h ARG 111 Cb 0.58 0.03 0.21 0.00 0.08 0.00 0.00 29.97 30.87 1bvs h ARG 111 CO 0.00 -0.09 -0.44 1.33 -1.07 0.00 0.00 179.97 179.70 1bvs n VAL 112 N -5.44 0.00 -2.88 2.04 0.24 -0.02 -5.02 118.33 107.25 1bvs n VAL 112 Ca 0.05 -0.26 -0.21 0.00 -2.04 0.00 0.00 64.34 61.89 1bvs n VAL 112 Cb 0.36 -0.79 0.09 0.00 -1.47 0.00 0.00 33.84 32.03 1bvs n VAL 112 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1bvs n PRO 113 N -3.76 0.34 -0.15 7.34 -0.04 -1.26 -4.17 135.00 133.30 1bvs n PRO 113 Ca 0.05 -2.95 0.00 0.00 -0.04 0.00 0.00 63.50 60.56 1bvs n PRO 113 Cb 0.55 -0.40 0.00 0.00 -0.04 0.00 0.00 33.50 33.61 1bvs n PRO 113 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bvs n GLY 114 N -2.24 0.00 3.35 0.55 0.00 -1.26 -4.83 105.19 100.76 1bvs n GLY 114 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1bvs n GLY 114 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bvs s ILE 115 N -0.70 3.56 0.56 -0.61 -1.09 -1.26 -5.05 121.20 116.61 1bvs s ILE 115 Ca 0.00 -0.43 0.04 0.00 -2.23 0.00 0.00 60.65 58.03 1bvs s ILE 115 Cb 0.00 -2.63 0.04 0.00 -1.58 0.00 0.00 42.46 38.29 1bvs s ILE 115 CO 0.00 0.41 0.35 -0.83 -1.23 0.00 0.00 174.94 173.65 1bvs s GLY 116 N 1.42 2.51 0.00 6.18 0.00 -1.26 -4.54 107.32 111.62 1bvs s GLY 116 Ca 0.05 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 43.79 1bvs s GLY 116 CO -0.01 -2.00 0.19 0.54 0.00 0.00 0.00 173.10 171.81 1bvs n ARG 117 N -1.74 0.00 -0.13 2.90 3.00 -1.26 0.18 116.66 119.62 1bvs n ARG 117 Ca -0.05 0.12 0.01 0.00 -0.01 0.00 0.00 57.85 57.91 1bvs n ARG 117 Cb 0.65 -0.69 0.03 0.00 0.00 0.00 0.00 32.46 32.45 1bvs n ARG 117 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1bvs n ARG 118 N -0.30 -0.06 0.17 5.56 3.00 -1.26 0.13 116.66 123.90 1bvs n ARG 118 Ca 0.00 0.53 -0.11 0.00 -0.00 0.00 0.00 57.85 58.26 1bvs n ARG 118 Cb 0.00 -0.79 -0.06 0.00 0.00 0.00 0.00 32.46 31.61 1bvs n ARG 118 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1bvs h GLY 119 N 0.00 -1.08 -0.67 5.14 0.00 -1.83 0.59 103.07 105.22 1bvs h GLY 119 Ca 0.14 0.50 0.12 0.00 0.00 0.00 0.00 47.33 48.09 1bvs h GLY 119 CO -0.34 -0.34 -0.38 0.00 0.00 0.00 0.00 176.54 175.48 1bvs h ALA 120 N -1.18 -0.04 -0.00 3.60 0.00 0.54 0.73 119.26 122.91 1bvs h ALA 120 Ca -0.04 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1bvs h ALA 120 Cb 0.54 0.93 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 1bvs h ALA 120 CO -0.06 -0.70 -0.00 0.93 0.00 0.00 0.00 179.25 179.42 1bvs h GLU 121 N -0.11 -0.00 -0.77 0.00 5.08 -0.52 0.16 114.58 118.42 1bvs h GLU 121 Ca 0.26 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.78 1bvs h GLU 121 Cb 0.56 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.67 1bvs h GLU 121 CO -0.81 -0.00 -0.17 0.54 -1.00 0.00 0.00 179.01 177.57 1bvs n ARG 122 N -2.77 -0.07 0.14 2.33 1.74 0.20 0.41 116.66 118.65 1bvs n ARG 122 Ca -0.00 1.19 -0.10 0.00 -0.77 0.00 0.00 57.85 58.17 1bvs n ARG 122 Cb 0.00 -1.79 -0.06 0.00 -1.02 0.00 0.00 32.46 29.59 1bvs n ARG 122 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1bvs h ILE 123 N 0.00 0.00 -0.26 0.55 1.08 0.30 -1.43 117.51 117.75 1bvs h ILE 123 Ca 0.38 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.91 1bvs h ILE 123 Cb 0.60 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.27 1bvs h ILE 123 CO -0.79 0.00 -0.31 0.58 -0.69 0.00 0.00 178.15 176.95 1bvs h VAL 124 N -0.55 0.28 -0.82 1.67 2.07 0.15 0.06 116.25 119.11 1bvs h VAL 124 Ca -0.03 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.67 1bvs h VAL 124 Cb 0.49 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 30.49 1bvs h VAL 124 CO -0.07 0.00 0.55 0.25 0.02 0.00 0.00 177.57 178.32 1bvs h LEU 125 N -0.31 0.35 -3.94 2.57 6.46 -0.58 -1.85 115.31 118.01 1bvs h LEU 125 Ca 0.13 0.03 -0.60 0.00 -0.12 0.00 0.00 57.88 57.32 1bvs h LEU 125 Cb 0.53 -0.04 -0.30 0.00 -0.73 0.00 0.00 40.66 40.12 1bvs h LEU 125 CO -0.43 0.16 0.63 1.21 -0.62 0.00 0.00 178.44 179.39 1bvs n GLU 126 N -4.47 2.61 0.00 1.25 0.00 -0.00 -4.63 120.64 115.39 1bvs n GLU 126 Ca 0.17 -3.29 0.00 0.00 0.00 0.00 0.00 57.16 54.04 1bvs n GLU 126 Cb 0.64 -2.23 0.00 0.00 0.00 0.00 0.00 31.44 29.85 1bvs n GLU 126 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1bvs n LEU 127 N -0.97 0.00 -0.22 4.31 4.77 -0.73 -4.92 117.00 119.24 1bvs n LEU 127 Ca 0.59 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.69 1bvs n LEU 127 Cb 0.96 0.09 0.22 0.00 -2.33 0.00 0.00 43.42 42.37 1bvs n LEU 127 CO 0.68 -0.11 0.54 0.00 -1.33 0.00 0.00 177.39 177.17 1bvs n ALA 128 N -1.72 0.39 -1.00 -1.18 0.00 -0.99 -1.42 120.51 114.59 1bvs n ALA 128 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 53.44 54.12 1bvs n ALA 128 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1bvs n ALA 128 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1bvs n ASP 129 N -4.76 0.00 -0.92 0.00 2.03 -1.26 -4.86 116.55 106.78 1bvs n ASP 129 Ca 0.17 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.58 1bvs n ASP 129 Cb 0.55 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 1bvs n ASP 129 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1bvs n LYS 130 N -0.12 3.23 0.00 -0.67 2.85 -0.51 -5.05 118.16 117.89 1bvs n LYS 130 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1bvs n LYS 130 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1bvs n LYS 130 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1bvs n VAL 131 N 0.00 0.00 -0.44 0.58 3.14 -1.26 -4.93 118.33 115.42 1bvs n VAL 131 Ca 0.00 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.25 1bvs n VAL 131 Cb 0.00 0.00 0.13 0.00 -1.06 0.00 0.00 33.84 32.91 1bvs n VAL 131 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1bvs n GLY 132 N 1.96 -1.88 2.11 7.55 0.00 -1.26 -5.16 105.19 108.51 1bvs n GLY 132 Ca 0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 46.02 45.41 1bvs n GLY 132 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bvs n PRO 133 N -1.20 1.93 -0.30 1.61 -0.02 -1.26 -5.18 135.00 130.58 1bvs n PRO 133 Ca 0.06 -0.01 -0.02 0.00 -2.02 0.00 0.00 63.50 61.50 1bvs n PRO 133 Cb 0.26 -0.77 -0.03 0.00 -0.02 0.00 0.00 33.50 32.93 1bvs n PRO 133 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bvs n GLY 147 N 2.23 1.55 0.19 -1.23 0.00 -1.26 -5.17 105.19 101.50 1bvs n GLY 147 Ca 0.00 -0.23 -0.15 0.00 0.00 0.00 0.00 46.02 45.63 1bvs n GLY 147 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1bvs h ASN 148 N 3.73 0.69 -0.83 1.61 -0.00 -2.06 -3.28 115.58 115.43 1bvs h ASN 148 Ca 0.04 -0.59 0.15 0.00 -0.00 0.00 0.00 56.30 55.90 1bvs h ASN 148 Cb 0.51 -0.20 -0.15 0.00 -0.00 0.00 0.00 38.32 38.48 1bvs h ASN 148 CO 0.19 1.16 -0.25 0.00 -0.00 0.00 0.00 177.43 178.52 1bvs n ALA 149 N -2.54 0.08 -0.31 1.57 0.00 -1.26 0.13 120.51 118.19 1bvs n ALA 149 Ca -0.07 0.87 0.09 0.00 0.00 0.00 0.00 53.44 54.34 1bvs n ALA 149 Cb 0.58 -0.47 0.21 0.00 0.00 0.00 0.00 19.45 19.76 1bvs n ALA 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bvs h VAL 150 N 0.00 0.16 0.00 0.00 2.07 -1.97 2.21 116.25 118.73 1bvs h VAL 150 Ca 0.35 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.83 1bvs h VAL 150 Cb 0.56 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1bvs h VAL 150 CO -0.84 0.01 -0.13 -0.09 0.02 0.00 0.00 177.57 176.54 1bvs h ARG 151 N 0.05 0.00 0.00 1.57 2.43 0.92 -3.08 114.38 116.27 1bvs h ARG 151 Ca 0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.67 1bvs h ARG 151 Cb 0.92 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 1bvs h ARG 151 CO -0.83 0.13 0.00 0.41 -1.51 0.00 0.00 179.97 178.17 1bvs n GLY 152 N -0.89 -0.62 0.12 2.80 0.00 0.74 -2.60 105.19 104.74 1bvs n GLY 152 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.97 1bvs n GLY 152 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1bvs n SER 153 N -0.23 -0.27 0.00 1.61 7.64 -0.95 0.37 113.62 121.78 1bvs n SER 153 Ca 0.00 0.51 0.00 0.00 1.01 0.00 0.00 58.87 60.39 1bvs n SER 153 Cb 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1bvs n SER 153 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1bvs n VAL 154 N -4.37 0.00 -0.22 0.44 0.31 -1.16 -1.13 118.33 112.20 1bvs n VAL 154 Ca 0.01 1.20 -0.06 0.00 -0.01 0.00 0.00 64.34 65.49 1bvs n VAL 154 Cb 0.08 -1.80 -0.05 0.00 -0.91 0.00 0.00 33.84 31.16 1bvs n VAL 154 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1bvs n VAL 155 N -1.66 -0.35 -0.29 2.52 0.31 0.16 0.21 118.33 119.22 1bvs n VAL 155 Ca 0.00 1.44 -0.07 0.00 -0.01 0.00 0.00 64.34 65.70 1bvs n VAL 155 Cb 0.00 -1.80 -0.03 0.00 -0.91 0.00 0.00 33.84 31.10 1bvs n VAL 155 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1bvs h GLU 156 N 0.00 -0.12 -0.08 5.55 4.22 -0.86 0.66 114.58 123.95 1bvs h GLU 156 Ca 0.08 0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.54 1bvs h GLU 156 Cb 0.21 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1bvs h GLU 156 CO -0.49 -0.08 -0.05 0.00 -2.18 0.00 0.00 179.01 176.21 1bvs n ALA 157 N -3.25 -0.05 -0.29 2.92 0.00 0.55 0.49 120.51 120.87 1bvs n ALA 157 Ca 0.04 0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.62 1bvs n ALA 157 Cb 0.34 0.44 0.18 0.00 0.00 0.00 0.00 19.45 20.42 1bvs n ALA 157 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bvs h LEU 158 N 0.00 -0.49 -0.39 0.00 -0.00 -0.26 2.70 115.31 116.87 1bvs h LEU 158 Ca 0.01 0.23 0.01 0.00 -0.00 0.00 0.00 57.88 58.14 1bvs h LEU 158 Cb 0.03 0.43 -0.02 0.00 -0.00 0.00 0.00 40.66 41.10 1bvs h LEU 158 CO -0.08 -0.25 0.25 0.58 -0.00 0.00 0.00 178.44 178.94 1bvs h VAL 159 N 0.05 1.07 -0.02 1.22 2.07 0.72 -0.60 116.25 120.76 1bvs h VAL 159 Ca 0.47 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.83 1bvs h VAL 159 Cb 0.84 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 1bvs h VAL 159 CO -0.79 0.09 -0.45 1.23 0.02 0.00 0.00 177.57 177.67 1bvs h GLY 160 N 0.51 -1.18 1.09 2.17 0.00 2.92 0.14 103.07 108.71 1bvs h GLY 160 Ca 0.15 0.66 0.00 0.00 0.00 0.00 0.00 47.33 48.14 1bvs h GLY 160 CO -0.05 -0.28 0.00 1.04 0.00 0.00 0.00 176.54 177.25 1bvs n LEU 161 N -4.96 0.00 0.00 3.11 4.77 0.25 -4.74 117.00 115.44 1bvs n LEU 161 Ca -0.06 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1bvs n LEU 161 Cb 0.33 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1bvs n LEU 161 CO 0.09 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.70 1bvs n GLY 162 N -1.05 0.72 3.79 -0.72 0.00 0.48 -5.07 105.19 103.35 1bvs n GLY 162 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1bvs n GLY 162 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bvs s PHE 163 N -2.05 2.70 0.04 1.61 0.08 -0.29 -5.00 117.98 115.07 1bvs s PHE 163 Ca 0.00 1.12 -0.11 0.00 0.12 0.00 0.00 56.93 58.05 1bvs s PHE 163 Cb 0.00 -3.17 -0.06 0.00 -0.57 0.00 0.00 43.02 39.22 1bvs s PHE 163 CO 0.00 -1.97 0.39 0.00 -0.10 0.00 0.00 175.22 173.54 1bvs s ALA 164 N -3.14 3.72 1.06 5.36 0.00 -1.26 -4.42 121.76 123.09 1bvs s ALA 164 Ca 0.62 -0.33 -0.05 0.00 0.00 0.00 0.00 51.96 52.19 1bvs s ALA 164 Cb -0.15 -2.30 0.08 0.00 0.00 0.00 0.00 23.12 20.75 1bvs s ALA 164 CO 0.54 0.54 0.28 0.00 0.00 0.00 0.00 175.76 177.12 1bvs n ALA 165 N 1.30 -0.85 -3.54 0.00 0.00 -1.26 0.95 120.51 117.10 1bvs n ALA 165 Ca -0.11 -0.42 -0.24 0.00 0.00 0.00 0.00 53.44 52.68 1bvs n ALA 165 Cb 0.52 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 1bvs n ALA 165 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1bvs n LYS 166 N -2.33 -2.26 0.00 0.00 2.85 -1.26 -3.60 118.16 111.55 1bvs n LYS 166 Ca 0.04 0.20 0.00 0.00 -1.05 0.00 0.00 58.31 57.50 1bvs n LYS 166 Cb 0.15 -4.80 0.00 0.00 -0.65 0.00 0.00 35.03 29.73 1bvs n LYS 166 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1bvs n GLN 167 N -3.48 0.00 0.03 -1.58 -0.06 -1.14 -4.77 117.38 106.39 1bvs n GLN 167 Ca 0.04 0.00 -0.02 0.00 -2.00 0.00 0.00 57.00 55.02 1bvs n GLN 167 Cb 0.49 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.67 1bvs n GLN 167 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1bvs h ALA 168 N 0.00 -0.31 -0.85 1.69 0.00 0.53 -3.31 119.26 117.00 1bvs h ALA 168 Ca 0.00 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.09 1bvs h ALA 168 Cb 0.00 0.04 -0.16 0.00 0.00 0.00 0.00 17.79 17.68 1bvs h ALA 168 CO 0.00 -0.30 -0.05 1.05 0.00 0.00 0.00 179.25 179.95 1bvs h GLU 169 N -0.33 0.05 -4.97 0.00 4.11 -1.86 -1.58 114.58 110.00 1bvs h GLU 169 Ca -0.01 -0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.85 1bvs h GLU 169 Cb 0.09 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1bvs h GLU 169 CO 0.02 0.03 2.05 0.39 0.07 0.00 0.00 179.01 181.57 1bvs n GLU 170 N -5.44 2.09 0.00 1.06 1.02 -1.25 -0.19 120.64 117.93 1bvs n GLU 170 Ca 0.16 -2.44 0.00 0.00 -0.02 0.00 0.00 57.16 54.86 1bvs n GLU 170 Cb 0.55 -3.34 0.00 0.00 -0.02 0.00 0.00 31.44 28.62 1bvs n GLU 170 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bvs n ALA 171 N 9.56 0.00 -0.00 0.62 0.00 -0.97 -4.70 120.51 125.02 1bvs n ALA 171 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1bvs n ALA 171 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1bvs n ALA 171 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1bvs n THR 172 N 0.00 0.00 -0.24 0.00 -1.04 0.74 -2.87 114.28 110.87 1bvs n THR 172 Ca 0.00 1.50 -0.08 0.00 -2.04 0.00 0.00 64.05 63.43 1bvs n THR 172 Cb 0.00 -2.50 -0.07 0.00 -1.82 0.00 0.00 70.33 65.95 1bvs n THR 172 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1bvs h ASP 173 N 0.00 -1.44 -0.48 8.00 3.32 -1.23 0.27 116.42 124.86 1bvs h ASP 173 Ca 0.00 0.21 0.19 0.00 0.02 0.00 0.00 57.03 57.45 1bvs h ASP 173 Cb 0.00 0.62 -0.08 0.00 0.22 0.00 0.00 39.33 40.10 1bvs h ASP 173 CO 0.00 -0.19 0.27 1.67 -1.72 0.00 0.00 179.24 179.27 1bvs n GLN 174 N -4.54 -0.02 0.00 3.56 7.27 -1.21 -0.10 117.38 122.33 1bvs n GLN 174 Ca 0.00 0.60 0.00 0.00 0.07 0.00 0.00 57.00 57.67 1bvs n GLN 174 Cb 0.19 -1.10 0.00 0.00 2.41 0.00 0.00 30.24 31.74 1bvs n GLN 174 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1bvs n VAL 175 N -3.91 0.00 -0.33 1.69 0.31 0.94 -3.77 118.33 113.26 1bvs n VAL 175 Ca 0.17 0.74 0.23 0.00 -0.01 0.00 0.00 64.34 65.47 1bvs n VAL 175 Cb 0.60 -1.54 0.43 0.00 -0.91 0.00 0.00 33.84 32.42 1bvs n VAL 175 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1bvs n LEU 176 N -1.48 0.10 -3.11 7.52 7.94 0.85 -0.46 117.00 128.36 1bvs n LEU 176 Ca 0.00 1.67 -0.30 0.00 -1.11 0.00 0.00 56.01 56.26 1bvs n LEU 176 Cb 0.00 -0.70 -0.04 0.00 0.53 0.00 0.00 43.42 43.21 1bvs n LEU 176 CO 0.00 -1.77 2.85 0.47 -1.11 0.00 0.00 177.39 177.83 1bvs n ASP 177 N -5.37 7.09 0.00 1.96 8.00 -0.40 -0.91 116.55 126.92 1bvs n ASP 177 Ca 0.30 -2.47 0.00 0.00 0.71 0.00 0.00 54.79 53.33 1bvs n ASP 177 Cb 1.00 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 1bvs n ASP 177 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bvs n GLY 178 N 3.50 0.00 0.00 0.44 0.00 0.40 -4.87 105.19 104.66 1bvs n GLY 178 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1bvs n GLY 178 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bvs n GLU 179 N 0.00 0.00 -1.93 1.61 2.13 -0.09 -5.11 120.64 117.26 1bvs n GLU 179 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1bvs n GLU 179 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1bvs n GLU 179 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bvs n ALA 187 N 0.00 -1.45 0.00 4.31 0.00 -1.26 -5.10 120.51 117.01 1bvs n ALA 187 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1bvs n ALA 187 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1bvs n ALA 187 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1bvs n THR 188 N 1.80 0.00 -0.05 0.00 5.66 -1.26 -0.59 114.28 119.84 1bvs n THR 188 Ca 0.00 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.93 1bvs n THR 188 Cb 0.00 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.73 1bvs n THR 188 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1bvs n SER 189 N -1.17 3.20 0.03 1.09 7.64 -1.26 -4.06 113.62 119.09 1bvs n SER 189 Ca 0.00 -0.05 0.22 0.00 1.01 0.00 0.00 58.87 60.04 1bvs n SER 189 Cb 0.00 -0.14 0.64 0.00 -1.01 0.00 0.00 64.21 63.70 1bvs n SER 189 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1bvs h SER 190 N 0.00 0.00 0.00 6.43 4.64 -1.29 -2.19 113.55 121.14 1bvs h SER 190 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1bvs h SER 190 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 1bvs h SER 190 CO -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.93 1bvs n ALA 191 N -2.25 0.00 0.00 5.18 0.00 -1.16 -3.42 120.51 118.86 1bvs n ALA 191 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1bvs n ALA 191 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.33 1bvs n ALA 191 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1bvs n LEU 192 N 0.00 0.00 0.19 0.00 7.94 -0.87 0.84 117.00 125.10 1bvs n LEU 192 Ca 0.00 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 54.98 1bvs n LEU 192 Cb 0.00 0.00 0.41 0.00 0.53 0.00 0.00 43.42 44.36 1bvs n LEU 192 CO 0.00 0.00 0.85 0.03 -1.11 0.00 0.00 177.39 177.16 1bvs h ARG 193 N 0.00 0.00 0.00 1.96 3.08 -1.59 -0.30 114.38 117.53 1bvs h ARG 193 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bvs h ARG 193 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1bvs h ARG 193 CO 0.00 0.00 -0.07 0.00 -1.07 0.00 0.00 179.97 178.83 1bvs h ALA 194 N 1.17 0.00 -0.82 0.04 0.00 3.52 -3.17 119.26 119.99 1bvs h ALA 194 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1bvs h ALA 194 Cb 0.65 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.41 1bvs h ALA 194 CO 0.00 0.07 -0.48 0.00 0.00 0.00 0.00 179.25 178.83 1bvs n ALA 195 N -2.41 -0.52 -0.28 0.00 0.00 -0.22 0.82 120.51 117.90 1bvs n ALA 195 Ca -0.01 0.70 0.02 0.00 0.00 0.00 0.00 53.44 54.15 1bvs n ALA 195 Cb 0.04 -0.06 0.16 0.00 0.00 0.00 0.00 19.45 19.59 1bvs n ALA 195 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1bvs h LEU 196 N 0.00 0.63 -1.57 0.00 3.38 -1.53 1.66 115.31 117.89 1bvs h LEU 196 Ca 0.13 0.05 0.21 0.00 0.09 0.00 0.00 57.88 58.36 1bvs h LEU 196 Cb 0.34 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 1bvs h LEU 196 CO -0.77 0.36 0.60 -1.28 0.09 0.00 0.00 178.44 177.44 1bvs h SER 197 N 0.76 0.36 0.00 -0.43 0.87 0.29 0.65 113.55 116.03 1bvs h SER 197 Ca 0.38 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.98 1bvs h SER 197 Cb 0.35 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1bvs h SER 197 CO -0.25 0.14 0.00 -0.11 -0.53 0.00 0.00 176.83 176.08 1bvs n LEU 198 N -4.49 1.85 0.03 2.23 0.00 0.47 -3.58 117.00 113.51 1bvs n LEU 198 Ca 0.19 0.22 0.00 0.00 0.00 0.00 0.00 56.01 56.42 1bvs n LEU 198 Cb 0.73 -0.12 0.00 0.00 0.00 0.00 0.00 43.42 44.03 1bvs n LEU 198 CO 0.31 -0.12 0.32 0.18 0.00 0.00 0.00 177.39 178.09 1bvs n LEU 199 N -0.86 0.00 0.00 -1.96 4.32 0.39 0.79 117.00 119.68 1bvs n LEU 199 Ca 0.00 0.04 0.08 0.00 -0.02 0.00 0.00 56.01 56.12 1bvs n LEU 199 Cb 0.00 0.00 0.50 0.00 -1.62 0.00 0.00 43.42 42.30 1bvs n LEU 199 CO 0.00 -0.04 0.77 0.61 -1.22 0.00 0.00 177.39 177.51 1bvs n GLY 200 N -0.63 -0.86 0.00 -0.72 0.00 0.22 -4.76 105.19 98.43 1bvs n GLY 200 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1bvs n GLY 200 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bvs n LYS 201 N -0.81 0.00 -3.27 1.61 4.81 0.24 -3.07 118.16 117.67 1bvs n LYS 201 Ca 0.13 0.00 -0.45 0.00 -0.87 0.00 0.00 58.31 57.12 1bvs n LYS 201 Cb 0.06 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.05 1bvs n LYS 201 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1bvs s THR 202 N 0.00 5.08 -2.00 3.15 2.01 -1.26 -5.11 115.64 117.51 1bvs s THR 202 Ca 0.00 -1.08 0.09 0.00 0.31 0.00 0.00 61.69 61.01 1bvs s THR 202 Cb 0.00 -4.30 0.25 0.00 0.01 0.00 0.00 72.50 68.47 1bvs s THR 202 CO 0.00 -0.82 0.98 -2.11 -0.69 0.00 0.00 174.62 171.98