#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u10 s THR 21 N 0.00 4.73 0.44 0.00 -4.23 -1.26 -4.95 115.64 110.38 1u10 s THR 21 Ca 0.00 0.76 0.14 0.00 -1.18 0.00 0.00 61.69 61.40 1u10 s THR 21 Cb 0.00 -3.82 0.32 0.00 1.34 0.00 0.00 72.50 70.34 1u10 s THR 21 CO 0.00 -0.89 2.01 -0.65 -0.54 0.00 0.00 174.62 174.55 1u10 h PRO 22 N 0.30 0.36 -0.60 3.99 0.11 -1.99 -1.24 132.00 132.92 1u10 h PRO 22 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1u10 h PRO 22 Cb 1.19 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1u10 h PRO 22 CO 0.62 0.24 0.35 -1.49 -0.21 0.00 0.00 178.00 177.51 1u10 h TRP 23 N 0.37 0.80 -0.01 0.65 4.06 -1.92 -1.57 115.95 118.33 1u10 h TRP 23 Ca 0.23 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.17 1u10 h TRP 23 Cb 0.41 -0.26 0.00 0.00 -1.00 0.00 0.00 29.16 28.31 1u10 h TRP 23 CO -0.00 0.55 -0.00 1.04 -3.56 0.00 0.00 178.44 176.46 1u10 n GLN 24 N -4.40 1.41 -0.04 0.49 6.02 -0.49 -4.09 117.38 116.28 1u10 n GLN 24 Ca 0.06 -0.61 -0.04 0.00 -0.01 0.00 0.00 57.00 56.40 1u10 n GLN 24 Cb 0.08 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.78 1u10 n GLN 24 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1u10 n LYS 25 N -0.27 2.34 -1.91 -1.09 5.02 -0.66 -4.88 118.16 116.70 1u10 n LYS 25 Ca 0.21 -0.01 -0.38 0.00 -2.02 0.00 0.00 58.31 56.10 1u10 n LYS 25 Cb 0.27 -1.23 0.02 0.00 -0.02 0.00 0.00 35.03 34.06 1u10 n LYS 25 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1u10 s ILE 26 N -2.26 2.35 -0.24 -0.18 2.07 -0.79 -4.94 121.20 117.21 1u10 s ILE 26 Ca -0.04 0.28 0.04 0.00 -1.41 0.00 0.00 60.65 59.52 1u10 s ILE 26 Cb 0.03 -3.15 -0.04 0.00 0.13 0.00 0.00 42.46 39.43 1u10 s ILE 26 CO 0.38 0.01 0.22 0.35 -1.91 0.00 0.00 174.94 173.99 1u10 n THR 27 N -0.63 0.00 -4.94 4.00 -2.24 -1.26 -4.72 114.28 104.49 1u10 n THR 27 Ca 0.08 -0.41 -0.28 0.00 -2.27 0.00 0.00 64.05 61.18 1u10 n THR 27 Cb 0.45 1.01 -0.15 0.00 -2.10 0.00 0.00 70.33 69.54 1u10 n THR 27 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1u10 s GLN 28 N -1.34 1.69 0.68 -0.78 -1.52 -1.26 -4.91 119.66 112.22 1u10 s GLN 28 Ca 0.02 -0.90 -0.16 0.00 -1.95 0.00 0.00 55.36 52.38 1u10 s GLN 28 Cb 0.03 -1.73 0.01 0.00 -0.22 0.00 0.00 33.01 31.11 1u10 s GLN 28 CO 0.17 0.46 1.16 -2.14 -0.25 0.00 0.00 175.29 174.69 1u10 s PRO 29 N -0.84 2.58 -0.25 2.91 0.02 -1.26 -4.74 135.00 133.41 1u10 s PRO 29 Ca 0.09 1.59 -0.29 0.00 0.02 0.00 0.00 61.00 62.41 1u10 s PRO 29 Cb -0.09 -1.90 -0.01 0.00 0.02 0.00 0.00 34.50 32.52 1u10 s PRO 29 CO 0.00 -1.46 1.36 0.08 -0.33 0.00 0.00 177.00 176.66 1u10 s VAL 30 N -2.10 4.07 0.31 3.83 1.01 -1.26 -4.92 120.40 121.33 1u10 s VAL 30 Ca 0.71 1.22 -0.29 0.00 0.00 0.00 0.00 61.98 63.62 1u10 s VAL 30 Cb -0.25 -4.02 -0.11 0.00 0.00 0.00 0.00 36.38 32.00 1u10 s VAL 30 CO 0.41 -0.36 1.49 -2.16 0.00 0.00 0.00 175.10 174.48 1u10 s PRO 31 N 4.13 4.18 0.00 2.72 0.04 -1.26 0.42 135.00 145.24 1u10 s PRO 31 Ca 0.59 2.47 0.00 0.00 0.04 0.00 0.00 61.00 64.10 1u10 s PRO 31 Cb -0.20 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.31 1u10 s PRO 31 CO 0.23 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1u10 n GLY 32 N 1.54 -1.11 3.74 0.56 0.00 -1.26 -4.67 105.19 103.98 1u10 n GLY 32 Ca 0.05 -1.10 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 1u10 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u10 s SER 33 N -4.00 7.52 -0.18 1.61 0.01 -1.26 -4.57 113.70 112.83 1u10 s SER 33 Ca 0.00 1.81 -0.36 0.00 1.31 0.00 0.00 55.95 58.71 1u10 s SER 33 Cb 0.00 -2.58 -0.13 0.00 0.21 0.00 0.00 66.02 63.52 1u10 s SER 33 CO 0.00 0.04 1.90 0.00 0.41 0.00 0.00 173.24 175.58 1u10 n ALA 34 N 2.26 0.64 -3.56 1.44 0.00 -1.26 -4.33 120.51 115.71 1u10 n ALA 34 Ca -0.00 0.25 -0.16 0.00 0.00 0.00 0.00 53.44 53.54 1u10 n ALA 34 Cb 0.48 -2.45 -0.13 0.00 0.00 0.00 0.00 19.45 17.36 1u10 n ALA 34 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1u10 s GLN 35 N 4.29 0.17 -0.03 0.00 -1.52 0.01 -4.88 119.66 117.70 1u10 s GLN 35 Ca 0.97 0.46 -0.26 0.00 -1.95 0.00 0.00 55.36 54.58 1u10 s GLN 35 Cb -0.80 -0.63 -0.04 0.00 -0.22 0.00 0.00 33.01 31.32 1u10 s GLN 35 CO 0.55 -0.48 0.80 -1.12 -0.25 0.00 0.00 175.29 174.78 1u10 s SER 36 N 2.37 7.14 -0.11 5.90 0.01 -1.26 -1.34 113.70 126.41 1u10 s SER 36 Ca 0.05 1.37 0.01 0.00 1.31 0.00 0.00 55.95 58.69 1u10 s SER 36 Cb -0.14 -2.47 0.02 0.00 0.21 0.00 0.00 66.02 63.64 1u10 s SER 36 CO -0.10 -0.14 -0.12 -0.63 0.41 0.00 0.00 173.24 172.66 1u10 s ILE 37 N 0.72 1.27 0.00 1.44 1.01 0.05 -3.85 121.20 121.84 1u10 s ILE 37 Ca 0.42 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.58 1u10 s ILE 37 Cb -0.19 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.07 1u10 s ILE 37 CO 0.22 0.40 0.00 0.61 0.00 0.00 0.00 174.94 176.17 1u10 n GLY 38 N 4.43 -0.63 3.70 6.18 0.00 0.68 -0.71 105.19 118.84 1u10 n GLY 38 Ca -0.18 -1.80 -0.24 0.00 0.00 0.00 0.00 46.02 43.81 1u10 n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u10 s SER 39 N -4.00 4.44 0.41 1.61 1.04 -0.80 -1.08 113.70 115.32 1u10 s SER 39 Ca 0.00 -0.92 0.17 0.00 0.48 0.00 0.00 55.95 55.68 1u10 s SER 39 Cb 0.00 -0.60 1.07 0.00 0.10 0.00 0.00 66.02 66.59 1u10 s SER 39 CO 0.00 -0.33 1.85 -0.26 0.98 0.00 0.00 173.24 175.48 1u10 h PHE 40 N 1.62 0.56 -0.44 5.02 0.04 -1.94 -1.88 116.94 119.92 1u10 h PHE 40 Ca -0.43 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.36 1u10 h PHE 40 Cb 1.25 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 39.23 1u10 h PHE 40 CO 0.66 0.14 0.00 0.43 -0.60 0.00 0.00 178.31 178.94 1u10 n SER 41 N -4.52 4.51 -2.79 2.17 7.64 -1.26 -1.88 113.62 117.49 1u10 n SER 41 Ca 0.20 -2.77 0.02 0.00 1.01 0.00 0.00 58.87 57.33 1u10 n SER 41 Cb 0.70 -0.56 0.01 0.00 -1.01 0.00 0.00 64.21 63.35 1u10 n SER 41 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1u10 s ASN 42 N -1.29 -0.32 0.00 6.43 2.47 -0.71 -4.94 114.94 116.58 1u10 s ASN 42 Ca 0.46 -0.15 0.00 0.00 0.42 0.00 0.00 52.86 53.59 1u10 s ASN 42 Cb 0.34 0.47 0.00 0.00 -1.45 0.00 0.00 41.25 40.61 1u10 s ASN 42 CO 0.15 -0.04 0.00 0.61 -3.72 0.00 0.00 177.10 174.10 1u10 n GLY 43 N 3.80 -0.69 2.32 1.21 0.00 -1.22 -1.91 105.19 108.70 1u10 n GLY 43 Ca 0.06 -0.73 -0.06 0.00 0.00 0.00 0.00 46.02 45.29 1u10 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u10 s ILE 45 N -2.47 -0.03 -0.10 0.00 2.07 -0.68 -0.77 121.20 119.23 1u10 s ILE 45 Ca 0.11 0.09 -0.03 0.00 -1.41 0.00 0.00 60.65 59.41 1u10 s ILE 45 Cb -0.03 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 42.19 1u10 s ILE 45 CO 0.08 0.04 0.04 -0.69 -1.91 0.00 0.00 174.94 172.50 1u10 s VAL 46 N 0.81 4.60 -0.87 4.00 1.01 -0.45 -4.42 120.40 125.07 1u10 s VAL 46 Ca -0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 1u10 s VAL 46 Cb -0.07 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1u10 s VAL 46 CO -0.05 0.60 0.42 0.61 0.00 0.00 0.00 175.10 176.68 1u10 n GLY 47 N 2.19 0.01 3.76 4.51 0.00 0.17 -0.81 105.19 115.02 1u10 n GLY 47 Ca -0.19 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.21 1u10 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u10 s ALA 48 N -2.96 2.98 0.43 4.61 0.00 -1.26 -4.15 121.76 121.41 1u10 s ALA 48 Ca 0.21 1.39 -0.02 0.00 0.00 0.00 0.00 51.96 53.54 1u10 s ALA 48 Cb -0.09 -3.58 -0.02 0.00 0.00 0.00 0.00 23.12 19.43 1u10 s ALA 48 CO 0.26 -1.31 0.67 0.34 0.00 0.00 0.00 175.76 175.72 1u10 s ASP 49 N -0.78 6.10 -0.16 0.00 2.15 0.24 -4.82 116.67 119.40 1u10 s ASP 49 Ca 0.68 0.55 -0.00 0.00 0.43 0.00 0.00 52.55 54.20 1u10 s ASP 49 Cb -0.42 -1.92 -0.01 0.00 -0.30 0.00 0.00 42.92 40.28 1u10 s ASP 49 CO 0.51 -0.55 -0.14 -0.89 -0.17 0.00 0.00 175.17 173.94 1u10 s THR 50 N -2.55 2.84 0.05 1.71 2.01 -1.26 -1.00 115.64 117.44 1u10 s THR 50 Ca 0.45 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.44 1u10 s THR 50 Cb -0.10 -2.21 -0.08 0.00 0.01 0.00 0.00 72.50 70.13 1u10 s THR 50 CO 0.40 0.51 1.62 -0.22 -0.69 0.00 0.00 174.62 176.23 1u10 s LEU 51 N 0.76 4.35 0.31 4.42 2.96 -0.96 -4.94 118.68 125.59 1u10 s LEU 51 Ca -0.05 2.41 -0.29 0.00 -0.22 0.00 0.00 54.13 55.97 1u10 s LEU 51 Cb -0.15 -3.56 -0.12 0.00 0.50 0.00 0.00 46.19 42.85 1u10 s LEU 51 CO 0.01 -0.87 1.38 -2.65 -1.32 0.00 0.00 176.35 172.90 1u10 n PRO 52 N 5.72 2.22 -0.00 0.98 -0.02 -1.26 -4.91 135.00 137.73 1u10 n PRO 52 Ca 0.16 0.78 -0.18 0.00 -2.02 0.00 0.00 63.50 62.24 1u10 n PRO 52 Cb 0.41 -2.42 -0.09 0.00 -0.02 0.00 0.00 33.50 31.38 1u10 n PRO 52 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1u10 h ILE 53 N 2.82 1.30 -3.39 4.25 1.08 -1.99 -3.43 117.51 118.15 1u10 h ILE 53 Ca -0.46 -2.04 -0.59 0.00 -0.39 0.00 0.00 64.86 61.38 1u10 h ILE 53 Cb 1.27 2.18 -0.10 0.00 -3.07 0.00 0.00 36.82 37.10 1u10 h ILE 53 CO 0.68 0.63 -0.20 -1.10 -0.69 0.00 0.00 178.15 177.48 1u10 s GLN 54 N -3.57 4.25 0.07 2.37 -1.52 -1.26 -4.50 119.66 115.50 1u10 s GLN 54 Ca -0.11 0.27 -0.21 0.00 -1.95 0.00 0.00 55.36 53.36 1u10 s GLN 54 Cb 0.07 -3.48 0.05 0.00 -0.22 0.00 0.00 33.01 29.43 1u10 s GLN 54 CO 0.89 0.08 0.50 0.45 -0.25 0.00 0.00 175.29 176.96 1u10 s SER 55 N 0.78 -0.40 0.03 5.90 0.15 -1.26 -5.05 113.70 113.85 1u10 s SER 55 Ca 0.21 0.06 0.24 0.00 0.70 0.00 0.00 55.95 57.16 1u10 s SER 55 Cb -0.14 0.49 0.39 0.00 -1.71 0.00 0.00 66.02 65.04 1u10 s SER 55 CO 0.08 -0.76 1.33 -0.62 1.20 0.00 0.00 173.24 174.46 1u10 n GLU 56 N 0.24 0.10 -0.00 5.44 -0.58 -1.26 -4.22 120.64 120.35 1u10 n GLU 56 Ca -0.18 0.02 0.05 0.00 -0.42 0.00 0.00 57.16 56.63 1u10 n GLU 56 Cb 0.61 -1.55 -0.06 0.00 -0.57 0.00 0.00 31.44 29.87 1u10 n GLU 56 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1u10 n HIS 57 N -1.68 0.00 -3.87 -0.32 8.25 -1.26 -5.01 115.22 111.33 1u10 n HIS 57 Ca 0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.41 1u10 n HIS 57 Cb 0.37 -0.05 -0.05 0.00 1.12 0.00 0.00 29.99 31.38 1u10 n HIS 57 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1u10 s TYR 58 N -2.08 0.11 0.06 4.41 -0.85 -1.26 -2.06 117.35 115.68 1u10 s TYR 58 Ca 0.02 -0.47 0.03 0.00 -0.52 0.00 0.00 57.07 56.12 1u10 s TYR 58 Cb 0.07 0.29 -0.03 0.00 0.38 0.00 0.00 41.96 42.67 1u10 s TYR 58 CO 0.40 -0.94 -0.09 -0.65 -1.52 0.00 0.00 175.55 172.75 1u10 s GLN 59 N -3.94 0.66 0.54 -3.49 -0.21 0.65 -4.17 119.66 109.70 1u10 s GLN 59 Ca 0.15 -0.93 0.08 0.00 0.02 0.00 0.00 55.36 54.68 1u10 s GLN 59 Cb -0.01 -0.40 0.06 0.00 1.00 0.00 0.00 33.01 33.66 1u10 s GLN 59 CO 0.02 0.06 0.61 0.08 -2.12 0.00 0.00 175.29 173.95 1u10 s VAL 60 N -1.84 2.07 0.00 1.09 1.01 -1.26 -0.91 120.40 120.57 1u10 s VAL 60 Ca -0.03 -1.20 0.00 0.00 0.00 0.00 0.00 61.98 60.75 1u10 s VAL 60 Cb -0.07 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1u10 s VAL 60 CO -0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.10 175.64 1u10 n ARG 62 N -2.00 0.00 0.18 2.72 1.74 0.56 -4.81 116.66 115.05 1u10 n ARG 62 Ca 0.08 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.29 1u10 n ARG 62 Cb 0.62 0.00 0.63 0.00 -1.02 0.00 0.00 32.46 32.69 1u10 n ARG 62 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 1u10 h THR 63 N 0.00 0.00 0.00 0.55 1.35 -1.89 -0.99 112.91 111.93 1u10 h THR 63 Ca 0.00 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1u10 h THR 63 Cb 0.00 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1u10 h THR 63 CO 0.00 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.37 1u10 n ASP 64 N -2.38 0.62 0.16 5.36 5.75 -1.26 -1.11 116.55 123.68 1u10 n ASP 64 Ca -0.00 0.67 0.12 0.00 -0.01 0.00 0.00 54.79 55.57 1u10 n ASP 64 Cb 0.12 -0.79 0.16 0.00 -1.03 0.00 0.00 41.12 39.57 1u10 n ASP 64 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 1u10 h GLN 65 N 0.00 0.00 -5.48 0.11 4.20 -1.60 -3.48 115.11 108.87 1u10 h GLN 65 Ca 0.00 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.46 1u10 h GLN 65 Cb 0.31 0.00 0.19 0.00 0.30 0.00 0.00 27.48 28.28 1u10 h GLN 65 CO 0.00 0.00 -0.84 0.54 -0.67 0.00 0.00 178.83 177.86 1u10 n ARG 66 N -2.79 -2.18 -1.85 1.46 1.74 -0.27 -4.95 116.66 107.82 1u10 n ARG 66 Ca 0.03 0.87 -0.04 0.00 -0.77 0.00 0.00 57.85 57.95 1u10 n ARG 66 Cb 0.51 -5.77 0.07 0.00 -1.02 0.00 0.00 32.46 26.25 1u10 n ARG 66 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1u10 n ARG 67 N -3.22 1.73 -1.73 5.56 1.74 -1.26 -4.41 116.66 115.06 1u10 n ARG 67 Ca -0.07 -3.25 -0.29 0.00 -0.77 0.00 0.00 57.85 53.47 1u10 n ARG 67 Cb 0.62 -1.37 0.05 0.00 -1.02 0.00 0.00 32.46 30.73 1u10 n ARG 67 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 1u10 n TYR 68 N -0.46 2.97 -4.36 -1.55 0.18 -1.22 -2.63 117.16 110.09 1u10 n TYR 68 Ca 0.18 -2.58 -0.24 0.00 1.88 0.00 0.00 57.90 57.14 1u10 n TYR 68 Cb 0.91 -0.82 -0.08 0.00 -0.38 0.00 0.00 39.34 38.96 1u10 n TYR 68 CO 0.00 0.00 0.00 -0.06 -2.08 0.00 0.00 176.86 174.72 1u10 s PHE 69 N -3.70 2.53 -2.22 -3.48 0.08 -0.72 -2.27 117.98 108.21 1u10 s PHE 69 Ca 0.57 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1u10 s PHE 69 Cb 0.45 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.68 1u10 s PHE 69 CO 0.01 0.61 0.00 0.41 -0.10 0.00 0.00 175.22 176.15 1u10 n GLY 70 N -0.83 -1.80 3.77 4.36 0.00 -0.17 -1.81 105.19 108.71 1u10 n GLY 70 Ca -0.05 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.46 1u10 n GLY 70 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1u10 s HIS 71 N -2.18 3.12 0.34 1.61 2.46 -0.59 0.80 115.29 120.86 1u10 s HIS 71 Ca 0.00 1.57 0.15 0.00 0.47 0.00 0.00 55.06 57.25 1u10 s HIS 71 Cb 0.00 -3.35 1.12 0.00 -0.13 0.00 0.00 32.58 30.23 1u10 s HIS 71 CO 0.00 -1.18 1.64 -1.35 -2.47 0.00 0.00 174.74 171.38 1u10 h PRO 72 N 2.67 0.21 -0.86 2.88 0.11 -1.90 0.29 132.00 135.41 1u10 h PRO 72 Ca -0.49 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.64 1u10 h PRO 72 Cb 1.23 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 1u10 h PRO 72 CO 0.63 0.14 0.56 -0.44 -0.21 0.00 0.00 178.00 178.67 1u10 h ASP 73 N 0.22 0.94 -0.04 -2.05 5.19 -1.92 -2.58 116.42 116.17 1u10 h ASP 73 Ca 0.75 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 57.14 1u10 h ASP 73 Cb 1.78 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 41.07 1u10 h ASP 73 CO -0.66 0.65 0.01 0.25 -3.12 0.00 0.00 179.24 176.37 1u10 h LEU 74 N 1.10 0.07 -1.12 1.55 5.85 -0.69 -0.86 115.31 121.21 1u10 h LEU 74 Ca 0.34 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1u10 h LEU 74 Cb -0.03 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1u10 h LEU 74 CO -0.10 0.27 0.00 0.52 -0.34 0.00 0.00 178.44 178.79 1u10 n VAL 75 N -4.94 0.00 0.00 1.05 0.31 -0.78 -1.83 118.33 112.14 1u10 n VAL 75 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1u10 n VAL 75 Cb 0.14 -0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.03 1u10 n VAL 75 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1u10 n PHE 77 N 0.42 0.00 -0.11 3.52 7.35 -0.33 -1.37 117.46 126.94 1u10 n PHE 77 Ca 0.00 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.58 1u10 n PHE 77 Cb 0.00 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 39.80 1u10 n PHE 77 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1u10 h ILE 78 N 0.00 1.28 -0.74 -2.13 2.04 -1.63 0.28 117.51 116.61 1u10 h ILE 78 Ca 0.00 -1.12 -0.05 0.00 1.00 0.00 0.00 64.86 64.70 1u10 h ILE 78 Cb 0.00 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1u10 h ILE 78 CO 0.00 0.36 0.28 1.56 0.00 0.00 0.00 178.15 180.35 1u10 h GLN 79 N 0.38 1.11 -0.39 2.37 4.20 -1.49 -0.23 115.11 121.06 1u10 h GLN 79 Ca 0.08 -0.20 -0.15 0.00 0.06 0.00 0.00 58.65 58.44 1u10 h GLN 79 Cb 0.57 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1u10 h GLN 79 CO 0.03 0.91 -0.32 -0.09 -0.67 0.00 0.00 178.83 178.69 1u10 h ARG 80 N 1.08 0.91 -0.17 1.46 2.43 -1.76 -2.08 114.38 116.25 1u10 h ARG 80 Ca 0.25 -0.46 -0.20 0.00 -0.81 0.00 0.00 59.98 58.77 1u10 h ARG 80 Cb 0.22 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1u10 h ARG 80 CO -0.02 1.11 -0.66 1.25 -1.51 0.00 0.00 179.97 180.14 1u10 h LEU 81 N 0.73 0.88 -0.85 3.80 5.85 -0.22 -2.91 115.31 122.59 1u10 h LEU 81 Ca 0.07 -0.61 -0.11 0.00 0.84 0.00 0.00 57.88 58.07 1u10 h LEU 81 Cb 0.91 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 1u10 h LEU 81 CO 0.08 1.34 -0.36 0.28 -0.34 0.00 0.00 178.44 179.44 1u10 h SER 82 N 0.47 0.44 -0.46 1.25 0.02 -1.07 -2.05 113.55 112.15 1u10 h SER 82 Ca -0.03 -0.18 -0.13 0.00 -0.84 0.00 0.00 61.79 60.61 1u10 h SER 82 Cb 1.29 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1u10 h SER 82 CO 0.14 0.76 -0.21 -1.28 -1.14 0.00 0.00 176.83 175.11 1u10 h SER 83 N 0.36 0.99 -0.06 3.07 0.87 -1.41 -1.96 113.55 115.40 1u10 h SER 83 Ca 0.04 -0.37 -0.01 0.00 -1.23 0.00 0.00 61.79 60.22 1u10 h SER 83 Cb 0.80 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.49 1u10 h SER 83 CO 0.06 1.15 0.01 1.56 -0.53 0.00 0.00 176.83 179.09 1u10 h GLN 84 N 0.84 0.10 -0.66 2.24 4.20 -1.29 -1.18 115.11 119.35 1u10 h GLN 84 Ca 0.11 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.85 1u10 h GLN 84 Cb 0.77 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.49 1u10 h GLN 84 CO 0.06 0.32 0.37 0.28 -0.67 0.00 0.00 178.83 179.19 1u10 h VAL 85 N -0.14 0.98 -0.23 -0.54 2.07 -1.38 -2.28 116.25 114.73 1u10 h VAL 85 Ca 0.02 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1u10 h VAL 85 Cb 0.27 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1u10 h VAL 85 CO 0.00 0.13 0.14 -1.28 0.02 0.00 0.00 177.57 176.58 1u10 h SER 86 N 0.69 0.27 0.31 0.57 0.87 -1.18 -1.99 113.55 113.09 1u10 h SER 86 Ca 0.29 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1u10 h SER 86 Cb 0.17 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1u10 h SER 86 CO -0.17 0.23 0.00 0.59 -0.53 0.00 0.00 176.83 176.94 1u10 n ASN 87 N -4.91 0.00 -0.94 6.23 3.02 -0.46 -0.25 115.26 117.95 1u10 n ASN 87 Ca -0.03 0.45 0.12 0.00 -0.03 0.00 0.00 54.58 55.09 1u10 n ASN 87 Cb 0.04 -0.47 0.11 0.00 -0.61 0.00 0.00 39.78 38.85 1u10 n ASN 87 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1u10 n LEU 88 N -1.47 2.98 -2.65 3.41 4.77 -0.78 -5.09 117.00 118.16 1u10 n LEU 88 Ca 0.03 -1.05 -0.02 0.00 -0.03 0.00 0.00 56.01 54.94 1u10 n LEU 88 Cb 0.11 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1u10 n LEU 88 CO 0.09 0.52 -0.54 0.61 -1.33 0.00 0.00 177.39 176.73 1u10 n GLY 89 N 1.31 -4.59 0.00 -0.72 0.00 0.65 -5.09 105.19 96.76 1u10 n GLY 89 Ca 0.14 0.84 0.00 0.00 0.00 0.00 0.00 46.02 47.00 1u10 n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u10 n GLY 91 N 0.97 7.06 3.59 -0.02 0.00 -1.26 -5.05 105.19 110.48 1u10 n GLY 91 Ca -0.12 -2.07 -0.34 0.00 0.00 0.00 0.00 46.02 43.49 1u10 n GLY 91 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u10 s THR 92 N 0.55 4.27 0.29 2.61 2.01 0.59 -4.19 115.64 121.78 1u10 s THR 92 Ca 0.00 -0.23 -0.29 0.00 0.31 0.00 0.00 61.69 61.48 1u10 s THR 92 Cb 0.00 -2.87 -0.09 0.00 0.01 0.00 0.00 72.50 69.55 1u10 s THR 92 CO 0.00 0.51 1.07 -0.69 -0.69 0.00 0.00 174.62 174.82 1u10 s VAL 93 N 0.03 3.60 -0.23 3.82 1.01 -0.88 -3.65 120.40 124.11 1u10 s VAL 93 Ca 0.03 1.57 -0.03 0.00 0.00 0.00 0.00 61.98 63.55 1u10 s VAL 93 Cb -0.13 -3.98 0.01 0.00 0.00 0.00 0.00 36.38 32.28 1u10 s VAL 93 CO 0.02 0.34 -0.07 -0.76 0.00 0.00 0.00 175.10 174.63 1u10 s LEU 94 N -1.55 2.90 -0.24 3.92 1.43 -1.26 -0.25 118.68 123.63 1u10 s LEU 94 Ca 0.45 -0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 52.85 1u10 s LEU 94 Cb -0.30 -1.68 -0.05 0.00 0.03 0.00 0.00 46.19 44.19 1u10 s LEU 94 CO 0.38 -0.06 0.20 -0.63 0.23 0.00 0.00 176.35 176.47 1u10 s ILE 95 N 1.40 5.33 0.00 -0.59 -1.09 -0.08 -1.93 121.20 124.24 1u10 s ILE 95 Ca 0.04 0.25 0.00 0.00 -2.23 0.00 0.00 60.65 58.71 1u10 s ILE 95 Cb -0.15 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.20 1u10 s ILE 95 CO -0.05 0.32 0.00 0.61 -1.23 0.00 0.00 174.94 174.59 1u10 n GLY 96 N 4.32 1.66 3.73 6.18 0.00 0.87 -4.59 105.19 117.36 1u10 n GLY 96 Ca -0.14 -1.68 -0.33 0.00 0.00 0.00 0.00 46.02 43.87 1u10 n GLY 96 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u10 s ASP 97 N -1.00 4.19 0.00 1.61 1.01 -1.26 -4.66 116.67 116.57 1u10 s ASP 97 Ca 0.00 2.14 0.00 0.00 0.71 0.00 0.00 52.55 55.40 1u10 s ASP 97 Cb 0.00 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.37 1u10 s ASP 97 CO 0.00 -2.25 0.00 0.61 0.21 0.00 0.00 175.17 173.74 1u10 n GLY 99 N -0.14 3.00 0.20 0.21 0.00 -0.75 -0.82 105.19 106.88 1u10 n GLY 99 Ca 0.12 -1.34 -0.07 0.00 0.00 0.00 0.00 46.02 44.73 1u10 n GLY 99 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1u10 h PRO 101 N 0.00 0.44 0.00 1.61 0.11 -1.85 -1.90 132.00 130.42 1u10 h PRO 101 Ca 0.00 -0.27 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 1u10 h PRO 101 Cb 0.00 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 1u10 h PRO 101 CO 0.00 0.87 -0.22 0.00 -0.21 0.00 0.00 178.00 178.44 1u10 n ALA 102 N -2.50 2.19 -0.32 -0.75 0.00 -1.26 -4.13 120.51 113.74 1u10 n ALA 102 Ca -0.03 -2.01 0.00 0.00 0.00 0.00 0.00 53.44 51.40 1u10 n ALA 102 Cb 0.59 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1u10 n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u10 n GLY 103 N -0.85 -0.48 0.00 0.00 0.00 -1.26 -1.68 105.19 100.91 1u10 n GLY 103 Ca 0.10 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1u10 n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u10 n GLY 104 N 0.00 1.68 3.75 -0.02 0.00 -0.93 -4.83 105.19 104.84 1u10 n GLY 104 Ca 0.00 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.66 1u10 n GLY 104 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1u10 s ARG 105 N -2.43 4.41 0.06 1.61 3.52 -1.26 -4.36 118.95 120.51 1u10 s ARG 105 Ca 0.00 2.08 -0.31 0.00 -0.13 0.00 0.00 55.73 57.38 1u10 s ARG 105 Cb 0.00 -3.15 -0.06 0.00 -1.56 0.00 0.00 34.95 30.18 1u10 s ARG 105 CO 0.00 -0.16 1.27 -0.06 -0.81 0.00 0.00 175.30 175.53 1u10 s PHE 106 N -0.53 3.31 -1.09 5.12 2.99 -1.26 -4.85 117.98 121.67 1u10 s PHE 106 Ca 0.52 1.16 -0.22 0.00 0.00 0.00 0.00 56.93 58.39 1u10 s PHE 106 Cb -0.37 -3.51 0.03 0.00 0.00 0.00 0.00 43.02 39.17 1u10 s PHE 106 CO 0.44 -1.68 1.64 1.21 -0.00 0.00 0.00 175.22 176.84 1u10 s ASN 107 N 1.18 6.24 0.00 1.36 2.47 -1.26 -4.63 114.94 120.31 1u10 s ASN 107 Ca 0.60 -1.60 0.00 0.00 0.42 0.00 0.00 52.86 52.29 1u10 s ASN 107 Cb -0.31 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 36.92 1u10 s ASN 107 CO 0.29 -1.76 0.00 0.61 -3.72 0.00 0.00 177.10 172.52 1u10 n GLY 108 N 6.41 1.16 0.00 1.21 0.00 -1.26 -5.11 105.19 107.61 1u10 n GLY 108 Ca 0.39 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1u10 n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u10 n GLY 109 N 2.87 0.54 3.64 -0.02 0.00 -1.26 -5.07 105.19 105.89 1u10 n GLY 109 Ca 0.00 -2.17 -0.31 0.00 0.00 0.00 0.00 46.02 43.55 1u10 n GLY 109 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u10 s HIS 110 N -0.77 1.57 -0.23 1.61 3.76 -1.26 -4.95 115.29 115.02 1u10 s HIS 110 Ca 0.00 1.70 0.18 0.00 -0.15 0.00 0.00 55.06 56.79 1u10 s HIS 110 Cb 0.00 -3.31 0.10 0.00 1.11 0.00 0.00 32.58 30.49 1u10 s HIS 110 CO 0.00 -2.99 1.38 0.00 -0.85 0.00 0.00 174.74 172.28 1u10 h ALA 111 N -2.00 0.74 -3.00 -1.40 0.00 -1.97 -3.42 119.26 108.21 1u10 h ALA 111 Ca -0.46 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1u10 h ALA 111 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1u10 h ALA 111 CO 0.43 0.45 0.00 -1.13 0.00 0.00 0.00 179.25 179.00 1u10 n SER 112 N -3.11 0.00 -1.33 0.00 3.41 -1.26 -4.73 113.62 106.60 1u10 n SER 112 Ca 0.01 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.45 1u10 n SER 112 Cb 0.68 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.56 1u10 n SER 112 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1u10 n HIS 113 N 0.00 0.00 0.42 7.33 -0.00 -1.13 -4.63 115.22 117.21 1u10 n HIS 113 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.84 1u10 n HIS 113 Cb 0.00 -3.06 0.20 0.00 -0.00 0.00 0.00 29.99 27.12 1u10 n HIS 113 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.34 178.30 1u10 h GLN 114 N 0.01 0.00 -0.12 -0.41 4.20 -1.57 -3.36 115.11 113.85 1u10 h GLN 114 Ca -0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1u10 h GLN 114 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1u10 h GLN 114 CO 0.52 0.00 0.00 0.25 -0.67 0.00 0.00 178.83 178.93 1u10 n THR 115 N -2.48 1.50 -1.62 -0.54 -2.24 -1.26 -2.19 114.28 105.45 1u10 n THR 115 Ca 0.03 -1.53 -0.08 0.00 -2.27 0.00 0.00 64.05 60.20 1u10 n THR 115 Cb 0.48 0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.83 1u10 n THR 115 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u10 n GLY 116 N -0.55 0.59 0.00 3.38 0.00 -1.26 -4.64 105.19 102.71 1u10 n GLY 116 Ca 0.11 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1u10 n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u10 n LEU 117 N -1.01 1.43 -4.38 0.99 4.77 -1.26 -1.54 117.00 116.00 1u10 n LEU 117 Ca -0.09 -1.43 -0.32 0.00 -0.03 0.00 0.00 56.01 54.14 1u10 n LEU 117 Cb 0.39 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.34 1u10 n LEU 117 CO 0.12 0.36 -0.49 -1.81 -1.33 0.00 0.00 177.39 174.23 1u10 s ASP 118 N -0.45 3.69 -0.03 -1.43 1.01 -1.26 -1.15 116.67 117.03 1u10 s ASP 118 Ca 0.00 -0.33 -0.01 0.00 0.71 0.00 0.00 52.55 52.92 1u10 s ASP 118 Cb 0.00 -0.99 0.03 0.00 1.01 0.00 0.00 42.92 42.97 1u10 s ASP 118 CO 0.00 0.27 0.06 0.54 0.21 0.00 0.00 175.17 176.25 1u10 s VAL 119 N -0.31 -0.06 -0.02 -1.27 0.11 0.35 -4.52 120.40 114.68 1u10 s VAL 119 Ca 0.02 0.22 -0.20 0.00 -2.93 0.00 0.00 61.98 59.09 1u10 s VAL 119 Cb -0.13 -0.12 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 1u10 s VAL 119 CO 0.02 0.09 0.56 -1.81 -3.33 0.00 0.00 175.10 170.64 1u10 s ASP 120 N 1.16 6.92 -0.08 3.54 1.01 -0.00 -1.17 116.67 128.05 1u10 s ASP 120 Ca -0.08 1.10 0.02 0.00 0.71 0.00 0.00 52.55 54.29 1u10 s ASP 120 Cb -0.13 -2.34 0.01 0.00 1.01 0.00 0.00 42.92 41.47 1u10 s ASP 120 CO -0.04 0.11 -0.12 -0.63 0.21 0.00 0.00 175.17 174.70 1u10 s ILE 121 N -0.17 1.17 0.42 0.77 1.01 -1.26 -0.09 121.20 123.05 1u10 s ILE 121 Ca 0.30 -0.48 -0.26 0.00 0.00 0.00 0.00 60.65 60.20 1u10 s ILE 121 Cb -0.18 -1.08 -0.10 0.00 0.01 0.00 0.00 42.46 41.11 1u10 s ILE 121 CO 0.16 0.37 1.41 0.33 0.00 0.00 0.00 174.94 177.21 1u10 n PHE 122 N 3.97 2.66 -1.58 3.97 -0.00 -0.81 -4.39 117.46 121.29 1u10 n PHE 122 Ca -0.21 0.46 -0.30 0.00 -0.00 0.00 0.00 57.45 57.39 1u10 n PHE 122 Cb 0.51 -2.46 -0.02 0.00 -0.00 0.00 0.00 39.48 37.51 1u10 n PHE 122 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1u10 n LEU 123 N 0.09 6.80 -3.70 -2.13 4.77 0.33 -4.74 117.00 118.43 1u10 n LEU 123 Ca 0.04 -4.25 -0.12 0.00 -0.03 0.00 0.00 56.01 51.65 1u10 n LEU 123 Cb 0.40 -1.17 -0.12 0.00 -2.33 0.00 0.00 43.42 40.19 1u10 n LEU 123 CO 0.61 1.71 -0.09 -1.58 -1.33 0.00 0.00 177.39 176.71 1u10 s GLN 124 N -2.43 0.23 -0.57 3.23 0.74 -1.26 -4.94 119.66 114.65 1u10 s GLN 124 Ca 0.56 0.68 -0.03 0.00 0.05 0.00 0.00 55.36 56.62 1u10 s GLN 124 Cb 0.40 -0.04 0.15 0.00 1.10 0.00 0.00 33.01 34.61 1u10 s GLN 124 CO -0.26 -0.21 0.38 -0.51 -0.55 0.00 0.00 175.29 174.14 1u10 s LEU 125 N 1.76 5.25 0.45 3.68 1.43 -1.26 -4.58 118.68 125.40 1u10 s LEU 125 Ca -0.05 -2.64 -0.25 0.00 -1.03 0.00 0.00 54.13 50.16 1u10 s LEU 125 Cb -0.11 -1.85 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 1u10 s LEU 125 CO -0.10 -0.42 1.35 -2.16 0.23 0.00 0.00 176.35 175.26 1u10 s PRO 126 N 0.25 3.72 0.00 1.29 0.04 -1.24 -4.52 135.00 134.53 1u10 s PRO 126 Ca 0.15 2.24 0.24 0.00 0.04 0.00 0.00 61.00 63.67 1u10 s PRO 126 Cb -0.21 -2.62 0.34 0.00 0.04 0.00 0.00 34.50 32.05 1u10 s PRO 126 CO -0.04 -0.73 1.30 1.63 0.04 0.00 0.00 177.00 179.20 1u10 n LYS 127 N -0.22 0.36 -4.65 4.56 5.02 -1.26 -0.30 118.16 121.67 1u10 n LYS 127 Ca 0.05 -0.25 -0.24 0.00 -2.02 0.00 0.00 58.31 55.85 1u10 n LYS 127 Cb 0.43 -1.49 -0.16 0.00 -0.02 0.00 0.00 35.03 33.79 1u10 n LYS 127 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1u10 s THR 128 N -2.81 1.19 0.39 -0.18 2.01 -1.26 -4.88 115.64 110.09 1u10 s THR 128 Ca 0.15 -0.56 -0.27 0.00 0.31 0.00 0.00 61.69 61.32 1u10 s THR 128 Cb 0.18 -1.05 -0.11 0.00 0.01 0.00 0.00 72.50 71.53 1u10 s THR 128 CO 0.68 0.36 1.28 0.54 -0.69 0.00 0.00 174.62 176.79 1u10 n ARG 129 N 3.42 2.03 -2.06 4.92 1.74 -1.26 -4.97 116.66 120.48 1u10 n ARG 129 Ca -0.20 0.72 -0.31 0.00 -0.77 0.00 0.00 57.85 57.29 1u10 n ARG 129 Cb 0.53 -2.36 0.00 0.00 -1.02 0.00 0.00 32.46 29.61 1u10 n ARG 129 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1u10 s TRP 130 N -1.15 3.60 0.73 -1.55 0.52 -1.26 -5.09 118.94 114.74 1u10 s TRP 130 Ca 0.58 1.23 -0.08 0.00 0.02 0.00 0.00 56.10 57.85 1u10 s TRP 130 Cb -0.53 -2.66 0.07 0.00 -1.15 0.00 0.00 33.47 29.20 1u10 s TRP 130 CO 0.60 -0.58 1.05 0.95 0.02 0.00 0.00 176.95 178.99 1u10 s THR 131 N -3.04 2.22 0.18 2.01 -4.23 -1.26 -4.89 115.64 106.62 1u10 s THR 131 Ca 0.54 -0.22 -0.13 0.00 -1.18 0.00 0.00 61.69 60.70 1u10 s THR 131 Cb -0.11 -2.99 0.09 0.00 1.34 0.00 0.00 72.50 70.83 1u10 s THR 131 CO 0.50 0.00 1.82 0.28 -0.54 0.00 0.00 174.62 176.68 1u10 h SER 132 N -0.70 0.72 -0.81 3.99 0.02 -1.99 -1.57 113.55 113.21 1u10 h SER 132 Ca -0.44 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 60.46 1u10 h SER 132 Cb 1.32 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 1u10 h SER 132 CO 0.60 0.56 0.53 0.00 -1.14 0.00 0.00 176.83 177.39 1u10 h ALA 133 N 1.18 1.04 -0.58 3.77 0.00 -1.98 0.17 119.26 122.86 1u10 h ALA 133 Ca 0.21 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1u10 h ALA 133 Cb -0.03 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1u10 h ALA 133 CO -0.04 0.41 0.14 1.96 0.00 0.00 0.00 179.25 181.72 1u10 h GLN 134 N 1.07 0.92 -0.19 0.00 4.20 -1.76 -2.07 115.11 117.28 1u10 h GLN 134 Ca 0.31 -0.22 -0.11 0.00 0.06 0.00 0.00 58.65 58.69 1u10 h GLN 134 Cb -0.08 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 1u10 h GLN 134 CO -0.08 0.85 -0.34 -0.07 -0.67 0.00 0.00 178.83 178.52 1u10 h LEU 135 N 0.83 0.41 -0.63 1.46 3.38 -0.73 -2.41 115.31 117.61 1u10 h LEU 135 Ca 0.18 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1u10 h LEU 135 Cb 0.34 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1u10 h LEU 135 CO 0.00 0.73 -0.10 0.25 0.09 0.00 0.00 178.44 179.41 1u10 h LEU 136 N 0.34 0.97 -6.44 1.67 5.85 -0.45 0.16 115.31 117.41 1u10 h LEU 136 Ca 0.04 -0.31 -0.59 0.00 0.84 0.00 0.00 57.88 57.86 1u10 h LEU 136 Cb 0.77 -0.26 -0.40 0.00 0.37 0.00 0.00 40.66 41.14 1u10 h LEU 136 CO 0.06 1.08 -0.86 0.54 -0.34 0.00 0.00 178.44 178.93 1u10 n ARG 137 N -4.15 1.01 -1.72 1.25 1.74 -0.80 -4.32 116.66 109.67 1u10 n ARG 137 Ca 0.02 -3.70 -0.39 0.00 -0.77 0.00 0.00 57.85 53.00 1u10 n ARG 137 Cb 0.39 -1.80 0.03 0.00 -1.02 0.00 0.00 32.46 30.07 1u10 n ARG 137 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1u10 n PRO 138 N 2.05 1.76 -3.23 5.56 -0.02 -0.92 -4.77 135.00 135.44 1u10 n PRO 138 Ca 0.26 0.64 -0.45 0.00 -2.02 0.00 0.00 63.50 61.92 1u10 n PRO 138 Cb 0.45 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 1u10 n PRO 138 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1u10 s GLN 139 N -2.62 3.02 0.22 -0.52 2.00 -1.26 -5.03 119.66 115.46 1u10 s GLN 139 Ca 0.68 -1.46 -0.32 0.00 -2.00 0.00 0.00 55.36 52.26 1u10 s GLN 139 Cb -0.45 -4.25 -0.13 0.00 0.80 0.00 0.00 33.01 28.98 1u10 s GLN 139 CO 0.53 -1.36 1.57 0.00 -0.50 0.00 0.00 175.29 175.52 1u10 n ALA 140 N 5.72 1.85 -3.44 1.58 0.00 -1.26 -4.95 120.51 120.01 1u10 n ALA 140 Ca -0.12 0.41 -0.43 0.00 0.00 0.00 0.00 53.44 53.31 1u10 n ALA 140 Cb 0.42 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.44 1u10 n ALA 140 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1u10 s LEU 141 N 0.47 6.22 -0.36 0.00 2.96 -1.26 -5.03 118.68 121.69 1u10 s LEU 141 Ca 0.72 -3.15 -0.30 0.00 -0.22 0.00 0.00 54.13 51.18 1u10 s LEU 141 Cb -0.60 -2.11 -0.08 0.00 0.50 0.00 0.00 46.19 43.90 1u10 s LEU 141 CO 0.42 -0.39 2.28 -0.67 -1.32 0.00 0.00 176.35 176.67 1u10 n ASP 142 N 3.25 2.53 0.10 3.68 2.03 -1.26 -4.65 116.55 122.23 1u10 n ASP 142 Ca 0.17 0.10 -0.23 0.00 0.52 0.00 0.00 54.79 55.35 1u10 n ASP 142 Cb 0.42 -1.44 -0.15 0.00 -0.72 0.00 0.00 41.12 39.23 1u10 n ASP 142 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1u10 h LEU 143 N 15.10 0.68 -9.86 -2.67 3.38 -1.94 -3.47 115.31 116.53 1u10 h LEU 143 Ca -0.31 -0.90 -0.52 0.00 0.09 0.00 0.00 57.88 56.23 1u10 h LEU 143 Cb 1.28 -0.22 0.07 0.00 0.09 0.00 0.00 40.66 41.87 1u10 h LEU 143 CO 1.05 1.75 0.66 -0.69 0.09 0.00 0.00 178.44 181.29 1u10 s VAL 144 N -2.59 2.70 0.90 1.22 1.01 -1.26 0.03 120.40 122.41 1u10 s VAL 144 Ca -0.13 0.69 -0.11 0.00 0.00 0.00 0.00 61.98 62.42 1u10 s VAL 144 Cb 0.05 -3.44 0.12 0.00 0.00 0.00 0.00 36.38 33.12 1u10 s VAL 144 CO 0.88 0.16 1.07 -1.54 0.00 0.00 0.00 175.10 175.67 1u10 n SER 145 N 0.98 0.20 0.04 3.32 3.41 0.47 -4.69 113.62 117.34 1u10 n SER 145 Ca 0.01 0.45 0.20 0.00 -0.26 0.00 0.00 58.87 59.27 1u10 n SER 145 Cb 0.42 -1.45 0.72 0.00 -0.26 0.00 0.00 64.21 63.63 1u10 n SER 145 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1u10 h ARG 146 N -1.65 0.00 0.00 4.33 -0.00 -1.94 -0.48 114.38 114.63 1u10 h ARG 146 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.04 1u10 h ARG 146 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.25 1u10 h ARG 146 CO 0.41 0.00 -1.05 -0.40 0.00 0.00 0.00 179.97 178.93 1u10 n ASP 147 N -4.15 0.83 0.00 7.04 5.68 -1.26 -5.00 116.55 119.69 1u10 n ASP 147 Ca 0.09 -0.73 0.00 0.00 -0.50 0.00 0.00 54.79 53.64 1u10 n ASP 147 Cb 0.60 1.17 0.00 0.00 -1.14 0.00 0.00 41.12 41.75 1u10 n ASP 147 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1u10 n GLY 148 N 1.43 0.73 0.14 6.12 0.00 -0.19 -4.95 105.19 108.47 1u10 n GLY 148 Ca 0.02 -0.17 0.04 0.00 0.00 0.00 0.00 46.02 45.91 1u10 n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u10 n LYS 149 N -2.50 2.78 -4.08 1.61 4.76 -1.26 -4.37 118.16 115.10 1u10 n LYS 149 Ca 0.00 -0.40 -0.12 0.00 -2.87 0.00 0.00 58.31 54.92 1u10 n LYS 149 Cb 0.00 -0.98 -0.06 0.00 -1.84 0.00 0.00 35.03 32.15 1u10 n LYS 149 CO 0.00 0.00 0.00 -3.38 -1.37 0.00 0.00 177.40 172.65 1u10 s HIS 150 N -1.33 0.83 0.04 2.13 -3.43 -1.26 -4.75 115.29 107.52 1u10 s HIS 150 Ca 0.06 -1.10 0.01 0.00 -0.80 0.00 0.00 55.06 53.22 1u10 s HIS 150 Cb 0.06 -0.10 -0.04 0.00 -1.43 0.00 0.00 32.58 31.07 1u10 s HIS 150 CO 0.23 -0.96 0.12 0.14 -2.00 0.00 0.00 174.74 172.28 1u10 s VAL 151 N -3.70 4.89 -0.38 -5.38 -7.23 -1.26 0.18 120.40 107.52 1u10 s VAL 151 Ca 0.30 -0.51 -0.28 0.00 -1.81 0.00 0.00 61.98 59.68 1u10 s VAL 151 Cb 0.01 -3.32 -0.03 0.00 0.56 0.00 0.00 36.38 33.60 1u10 s VAL 151 CO 0.14 0.22 1.99 -0.69 -0.31 0.00 0.00 175.10 176.44 1u10 s VAL 152 N -1.35 3.29 0.52 1.32 1.01 0.10 -4.74 120.40 120.55 1u10 s VAL 152 Ca 0.29 0.26 0.24 0.00 0.00 0.00 0.00 61.98 62.77 1u10 s VAL 152 Cb -0.12 -3.47 0.39 0.00 0.00 0.00 0.00 36.38 33.18 1u10 s VAL 152 CO 0.21 -0.35 1.99 0.77 0.00 0.00 0.00 175.10 177.71 1u10 h SER 153 N 14.68 0.05 0.46 3.32 4.64 -1.93 -0.38 113.55 134.40 1u10 h SER 153 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1u10 h SER 153 Cb 1.20 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1u10 h SER 153 CO 1.07 0.03 -0.01 0.35 -0.87 0.00 0.00 176.83 177.39 1u10 n THR 154 N -4.39 0.00 -0.03 2.95 -2.24 -1.26 -3.68 114.28 105.63 1u10 n THR 154 Ca 0.10 -0.01 -0.03 0.00 -2.27 0.00 0.00 64.05 61.85 1u10 n THR 154 Cb 0.60 -0.46 -0.06 0.00 -2.10 0.00 0.00 70.33 68.31 1u10 n THR 154 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1u10 n LEU 155 N -1.21 0.00 -4.68 3.22 4.77 -0.22 -4.97 117.00 113.91 1u10 n LEU 155 Ca 0.16 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.72 1u10 n LEU 155 Cb 0.22 0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 1u10 n LEU 155 CO 0.22 0.15 1.33 0.86 -1.33 0.00 0.00 177.39 178.63 1u10 s TRP 156 N -2.21 2.30 0.19 -1.77 -0.11 -0.76 -5.00 118.94 111.58 1u10 s TRP 156 Ca -0.03 0.30 0.09 0.00 1.22 0.00 0.00 56.10 57.68 1u10 s TRP 156 Cb 0.02 -3.94 -0.04 0.00 -1.50 0.00 0.00 33.47 28.01 1u10 s TRP 156 CO 0.29 -3.81 -0.13 0.15 -4.62 0.00 0.00 176.95 168.83 1u10 s LYS 157 N 3.04 1.94 0.52 5.86 -0.14 -1.26 -4.96 119.74 124.74 1u10 s LYS 157 Ca 0.74 -1.33 0.17 0.00 -1.36 0.00 0.00 55.97 54.18 1u10 s LYS 157 Cb -0.38 -2.08 1.30 0.00 -1.68 0.00 0.00 37.83 34.99 1u10 s LYS 157 CO 0.32 0.42 2.15 -1.35 -0.76 0.00 0.00 175.35 176.13 1u10 h PRO 158 N 2.96 0.00 -0.15 -1.68 0.11 -2.01 -2.25 132.00 128.98 1u10 h PRO 158 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1u10 h PRO 158 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1u10 h PRO 158 CO 0.53 0.00 -0.01 0.93 -0.21 0.00 0.00 178.00 179.23 1u10 h GLU 159 N 0.00 0.22 -0.28 1.05 3.07 -1.99 -1.81 114.58 114.84 1u10 h GLU 159 Ca 0.00 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.69 1u10 h GLU 159 Cb 0.02 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1u10 h GLU 159 CO -0.00 0.25 -0.42 0.82 -1.40 0.00 0.00 179.01 178.26 1u10 h ILE 160 N 0.22 1.29 -0.21 3.13 1.08 -1.77 -0.51 117.51 120.75 1u10 h ILE 160 Ca 0.05 -1.61 0.00 0.00 -0.39 0.00 0.00 64.86 62.92 1u10 h ILE 160 Cb 0.18 1.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.45 1u10 h ILE 160 CO 0.00 0.52 0.13 0.15 -0.69 0.00 0.00 178.15 178.26 1u10 h PHE 161 N 0.56 0.26 -0.85 1.37 3.57 -1.40 -2.22 116.94 118.24 1u10 h PHE 161 Ca 0.04 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1u10 h PHE 161 Cb 0.96 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.58 1u10 h PHE 161 CO 0.05 0.18 0.42 0.77 -2.23 0.00 0.00 178.31 177.50 1u10 h SER 162 N 0.27 1.09 -0.36 0.41 0.02 -1.17 -2.04 113.55 111.78 1u10 h SER 162 Ca 0.07 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1u10 h SER 162 Cb -0.01 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 1u10 h SER 162 CO -0.02 0.91 0.22 0.25 -1.14 0.00 0.00 176.83 177.06 1u10 h LEU 163 N 1.20 0.37 -0.52 5.07 5.85 -0.79 0.04 115.31 126.53 1u10 h LEU 163 Ca 0.29 -0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.85 1u10 h LEU 163 Cb 0.09 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1u10 h LEU 163 CO -0.04 0.27 -0.54 0.40 -0.34 0.00 0.00 178.44 178.19 1u10 h ILE 164 N 0.45 1.32 -0.44 4.05 2.04 -1.19 -2.44 117.51 121.31 1u10 h ILE 164 Ca 0.14 -1.79 -0.08 0.00 1.00 0.00 0.00 64.86 64.12 1u10 h ILE 164 Cb -0.03 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1u10 h ILE 164 CO -0.05 0.56 -0.05 0.50 0.00 0.00 0.00 178.15 179.11 1u10 h LYS 165 N 0.43 0.81 -0.16 2.37 3.64 -1.12 0.27 116.57 122.80 1u10 h LYS 165 Ca 0.01 -0.28 0.01 0.00 -1.27 0.00 0.00 60.65 59.11 1u10 h LYS 165 Cb 1.09 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 1u10 h LYS 165 CO 0.10 0.90 0.09 -0.07 -2.27 0.00 0.00 179.45 178.20 1u10 h LEU 166 N 0.64 0.15 0.30 5.20 3.38 -0.94 -1.18 115.31 122.86 1u10 h LEU 166 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1u10 h LEU 166 Cb 0.56 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1u10 h LEU 166 CO 0.03 0.11 -0.15 0.00 0.09 0.00 0.00 178.44 178.53 1u10 h ALA 167 N 1.07 -0.41 -0.10 1.53 0.00 -1.30 -2.03 119.26 118.02 1u10 h ALA 167 Ca 0.06 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1u10 h ALA 167 Cb -0.01 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1u10 h ALA 167 CO -0.03 -0.73 0.16 0.00 0.00 0.00 0.00 179.25 178.65 1u10 h ALA 168 N 0.30 1.54 0.00 0.00 0.00 -0.76 -1.19 119.26 119.14 1u10 h ALA 168 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1u10 h ALA 168 Cb 0.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1u10 h ALA 168 CO 0.06 -0.21 -0.11 1.04 0.00 0.00 0.00 179.25 180.03 1u10 n GLN 169 N -3.51 0.21 -2.19 0.00 6.02 -0.46 -4.85 117.38 112.60 1u10 n GLN 169 Ca -0.00 0.15 -0.41 0.00 -0.01 0.00 0.00 57.00 56.72 1u10 n GLN 169 Cb 0.26 -1.72 -0.03 0.00 1.02 0.00 0.00 30.24 29.77 1u10 n GLN 169 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1u10 s ASP 170 N -4.16 6.87 0.55 1.08 2.15 -0.45 -4.89 116.67 117.82 1u10 s ASP 170 Ca 0.11 2.43 0.32 0.00 0.43 0.00 0.00 52.55 55.84 1u10 s ASP 170 Cb 0.14 -2.61 1.56 0.00 -0.30 0.00 0.00 42.92 41.71 1u10 s ASP 170 CO 0.61 -0.55 2.08 0.07 -0.17 0.00 0.00 175.17 177.21 1u10 h LYS 171 N 5.32 0.00 0.00 4.34 2.10 -1.89 -2.52 116.57 123.92 1u10 h LYS 171 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1u10 h LYS 171 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1u10 h LYS 171 CO 0.77 0.07 0.00 -0.44 -2.00 0.00 0.00 179.45 177.86 1u10 h ASP 172 N 0.00 0.00 -3.34 7.07 3.32 -1.94 -3.45 116.42 118.08 1u10 h ASP 172 Ca -0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1u10 h ASP 172 Cb 0.37 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.85 1u10 h ASP 172 CO 0.01 0.00 0.27 -0.69 -1.72 0.00 0.00 179.24 177.11 1u10 s VAL 173 N -3.15 4.94 -0.24 -1.35 1.01 -0.95 -1.06 120.40 119.61 1u10 s VAL 173 Ca 0.09 1.54 -0.01 0.00 0.00 0.00 0.00 61.98 63.61 1u10 s VAL 173 Cb 0.10 -4.09 -0.18 0.00 0.00 0.00 0.00 36.38 32.20 1u10 s VAL 173 CO 0.62 0.10 -0.13 0.35 0.00 0.00 0.00 175.10 176.04 1u10 n THR 174 N 4.45 1.54 -3.86 3.92 -2.24 -0.39 -4.89 114.28 112.82 1u10 n THR 174 Ca 0.02 -0.57 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 1u10 n THR 174 Cb 0.50 -1.51 -0.12 0.00 -2.10 0.00 0.00 70.33 67.10 1u10 n THR 174 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1u10 s ARG 175 N -2.52 0.27 -0.19 -0.78 0.52 -1.16 -4.69 118.95 110.39 1u10 s ARG 175 Ca -0.33 -0.08 -0.01 0.00 -0.52 0.00 0.00 55.73 54.79 1u10 s ARG 175 Cb 0.09 0.12 0.05 0.00 0.52 0.00 0.00 34.95 35.73 1u10 s ARG 175 CO 0.62 -0.05 -0.01 0.42 0.02 0.00 0.00 175.30 176.30 1u10 s ILE 176 N -0.54 0.94 -0.14 1.52 1.01 0.90 -1.06 121.20 123.84 1u10 s ILE 176 Ca -0.06 -0.71 -0.20 0.00 0.00 0.00 0.00 60.65 59.67 1u10 s ILE 176 Cb -0.04 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 1u10 s ILE 176 CO 0.01 -0.06 0.57 -0.36 0.00 0.00 0.00 174.94 175.10 1u10 s PHE 177 N 1.68 3.47 0.10 3.97 0.08 0.39 0.02 117.98 127.69 1u10 s PHE 177 Ca -0.01 0.96 -0.05 0.00 0.12 0.00 0.00 56.93 57.94 1u10 s PHE 177 Cb -0.17 -2.69 -0.02 0.00 -0.57 0.00 0.00 43.02 39.57 1u10 s PHE 177 CO -0.07 0.02 0.13 0.14 -0.10 0.00 0.00 175.22 175.33 1u10 s VAL 178 N 1.15 0.14 0.70 -0.44 -7.23 -0.75 -0.17 120.40 113.80 1u10 s VAL 178 Ca 0.29 -1.50 -0.16 0.00 -1.81 0.00 0.00 61.98 58.79 1u10 s VAL 178 Cb -0.16 -1.59 0.01 0.00 0.56 0.00 0.00 36.38 35.20 1u10 s VAL 178 CO 0.12 -0.65 1.19 -3.20 -0.31 0.00 0.00 175.10 172.25 1u10 n ASN 179 N -0.05 1.46 -0.01 4.85 2.85 -0.87 -1.99 115.26 121.49 1u10 n ASN 179 Ca -0.12 0.74 0.09 0.00 -0.11 0.00 0.00 54.58 55.18 1u10 n ASN 179 Cb 0.62 -1.51 0.50 0.00 1.24 0.00 0.00 39.78 40.63 1u10 n ASN 179 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1u10 h PRO 180 N 0.03 0.38 -0.23 1.20 0.11 -1.86 -1.64 132.00 129.99 1u10 h PRO 180 Ca -0.49 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.48 1u10 h PRO 180 Cb 1.33 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1u10 h PRO 180 CO 0.50 0.25 -0.35 0.00 -0.21 0.00 0.00 178.00 178.19 1u10 h ALA 181 N 1.75 0.96 -0.32 -0.75 0.00 -1.85 -1.46 119.26 117.58 1u10 h ALA 181 Ca 0.20 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1u10 h ALA 181 Cb 0.30 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1u10 h ALA 181 CO -0.05 0.61 -0.28 0.82 0.00 0.00 0.00 179.25 180.36 1u10 h ILE 182 N 0.43 1.29 -0.23 0.00 2.04 -1.65 -1.82 117.51 117.57 1u10 h ILE 182 Ca 0.05 -1.44 -0.04 0.00 1.00 0.00 0.00 64.86 64.43 1u10 h ILE 182 Cb 0.82 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 1u10 h ILE 182 CO 0.07 0.47 -0.05 0.50 0.00 0.00 0.00 178.15 179.14 1u10 h LYS 183 N 0.53 0.36 -0.71 2.37 3.64 -1.30 -1.57 116.57 119.88 1u10 h LYS 183 Ca 0.06 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1u10 h LYS 183 Cb 0.85 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.58 1u10 h LYS 183 CO 0.07 0.43 0.31 0.37 -2.27 0.00 0.00 179.45 178.36 1u10 h GLN 184 N 0.35 1.04 -0.02 1.90 -0.00 -0.95 0.15 115.11 117.58 1u10 h GLN 184 Ca 0.08 -0.17 -0.09 0.00 -0.00 0.00 0.00 58.65 58.46 1u10 h GLN 184 Cb 0.31 -0.18 -0.01 0.00 0.00 0.00 0.00 27.48 27.60 1u10 h GLN 184 CO 0.01 0.84 -0.42 0.37 0.00 0.00 0.00 178.83 179.64 1u10 h GLN 185 N 1.00 0.04 -0.23 1.69 5.75 -0.54 -2.18 115.11 120.64 1u10 h GLN 185 Ca 0.24 -0.02 -0.16 0.00 -0.15 0.00 0.00 58.65 58.56 1u10 h GLN 185 Cb 0.17 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.72 1u10 h GLN 185 CO -0.02 0.45 -0.46 -0.07 -2.65 0.00 0.00 178.83 176.08 1u10 h LEU 186 N 0.04 0.80 -0.99 -2.39 3.38 -0.59 -2.60 115.31 112.96 1u10 h LEU 186 Ca 0.00 -0.55 0.02 0.00 0.09 0.00 0.00 57.88 57.45 1u10 h LEU 186 Cb 0.75 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.22 1u10 h LEU 186 CO 0.06 1.20 0.65 0.00 0.09 0.00 0.00 178.44 180.44 1u10 h LEU 188 N 1.30 0.98 0.00 0.00 3.38 -1.32 -3.24 115.31 116.41 1u10 h LEU 188 Ca 0.38 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1u10 h LEU 188 Cb -0.08 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.40 1u10 h LEU 188 CO -0.10 1.06 -0.38 0.47 0.09 0.00 0.00 178.44 179.58 1u10 n ASP 189 N -4.23 0.52 -0.02 -0.43 8.00 -0.98 -4.33 116.55 115.08 1u10 n ASP 189 Ca 0.02 0.14 0.02 0.00 0.71 0.00 0.00 54.79 55.68 1u10 n ASP 189 Cb 0.35 -0.07 0.36 0.00 -0.02 0.00 0.00 41.12 41.74 1u10 n ASP 189 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1u10 h ALA 190 N 2.76 1.56 -0.83 2.24 0.00 -1.19 -3.47 119.26 120.33 1u10 h ALA 190 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1u10 h ALA 190 Cb 0.62 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1u10 h ALA 190 CO 0.00 0.35 0.00 0.41 0.00 0.00 0.00 179.25 180.01 1u10 n GLY 191 N -1.25 3.28 0.09 0.00 0.00 -1.26 -3.34 105.19 102.71 1u10 n GLY 191 Ca 0.03 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 1u10 n GLY 191 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1u10 h THR 192 N 0.00 1.67 -1.48 2.61 2.02 -1.99 -3.41 112.91 112.32 1u10 h THR 192 Ca 0.00 -2.34 -0.47 0.00 0.77 0.00 0.00 66.41 64.37 1u10 h THR 192 Cb 0.00 3.24 -0.06 0.00 -1.74 0.00 0.00 68.15 69.59 1u10 h THR 192 CO 0.00 0.63 1.14 -0.62 0.37 0.00 0.00 175.52 177.05 1u10 s ASP 193 N -6.47 5.71 0.00 4.18 2.15 -1.21 -4.68 116.67 116.34 1u10 s ASP 193 Ca -0.17 -0.54 0.00 0.00 0.43 0.00 0.00 52.55 52.27 1u10 s ASP 193 Cb -0.01 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 1u10 s ASP 193 CO 0.74 -2.17 0.54 -2.11 -0.17 0.00 0.00 175.17 172.00 1u10 n ARG 194 N 9.06 0.00 0.11 4.34 1.85 -1.26 -4.83 116.66 125.93 1u10 n ARG 194 Ca 0.26 -0.53 0.03 0.00 -1.00 0.00 0.00 57.85 56.60 1u10 n ARG 194 Cb 0.50 -0.48 0.41 0.00 -1.05 0.00 0.00 32.46 31.84 1u10 n ARG 194 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1u10 h ASP 195 N 0.00 0.25 -0.15 2.89 3.32 -1.98 -2.05 116.42 118.70 1u10 h ASP 195 Ca 0.00 -0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.05 1u10 h ASP 195 Cb 1.05 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1u10 h ASP 195 CO 0.00 0.35 0.18 4.11 -1.72 0.00 0.00 179.24 182.16 1u10 h TRP 196 N 0.26 0.00 -0.36 4.55 5.08 -1.94 -1.99 115.95 121.56 1u10 h TRP 196 Ca 0.06 0.00 0.10 0.00 1.08 0.00 0.00 58.89 60.13 1u10 h TRP 196 Cb 0.28 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.43 1u10 h TRP 196 CO 0.00 0.00 0.30 -0.07 -1.28 0.00 0.00 178.44 177.40 1u10 h LEU 197 N 0.00 0.00 -1.32 0.11 3.38 -1.69 -1.76 115.31 114.03 1u10 h LEU 197 Ca 0.07 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.15 1u10 h LEU 197 Cb 0.42 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.11 1u10 h LEU 197 CO -0.00 0.00 0.54 -0.09 0.09 0.00 0.00 178.44 178.98 1u10 h ARG 198 N 0.00 0.72 0.00 1.13 2.43 -1.53 -0.58 114.38 116.54 1u10 h ARG 198 Ca 0.17 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1u10 h ARG 198 Cb 0.77 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1u10 h ARG 198 CO -0.00 0.48 0.00 0.87 -1.51 0.00 0.00 179.97 179.80 1u10 h LYS 199 N 0.74 0.00 -6.09 0.20 1.57 -1.54 -3.42 116.57 108.03 1u10 h LYS 199 Ca 0.39 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.58 1u10 h LYS 199 Cb 0.50 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.73 1u10 h LYS 199 CO -0.16 0.00 0.64 0.08 -0.57 0.00 0.00 179.45 179.44 1u10 s VAL 200 N -3.56 4.60 -0.08 0.50 1.01 -0.23 -0.07 120.40 122.58 1u10 s VAL 200 Ca 0.02 1.36 0.01 0.00 0.00 0.00 0.00 61.98 63.37 1u10 s VAL 200 Cb 0.09 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1u10 s VAL 200 CO 0.53 -0.46 -0.10 -0.13 0.00 0.00 0.00 175.10 174.93 1u10 s ARG 201 N 3.43 2.86 0.56 2.72 1.81 0.10 -4.93 118.95 125.50 1u10 s ARG 201 Ca 0.39 -0.62 -0.16 0.00 -1.72 0.00 0.00 55.73 53.61 1u10 s ARG 201 Cb -0.12 -2.55 -0.05 0.00 -0.45 0.00 0.00 34.95 31.77 1u10 s ARG 201 CO 0.16 0.53 1.04 -2.14 -0.68 0.00 0.00 175.30 174.21 1u10 s PRO 202 N -0.46 3.53 -0.07 3.54 0.02 -1.26 -1.82 135.00 138.49 1u10 s PRO 202 Ca 0.06 1.15 -0.31 0.00 0.02 0.00 0.00 61.00 61.92 1u10 s PRO 202 Cb -0.12 -2.07 0.11 0.00 0.02 0.00 0.00 34.50 32.45 1u10 s PRO 202 CO 0.02 -0.63 1.00 -0.46 -0.33 0.00 0.00 177.00 176.60 1u10 s TRP 203 N -2.46 -0.27 0.57 6.54 -0.11 -0.84 -4.82 118.94 117.54 1u10 s TRP 203 Ca 0.63 0.16 -0.20 0.00 1.22 0.00 0.00 56.10 57.90 1u10 s TRP 203 Cb -0.14 0.53 -0.05 0.00 -1.50 0.00 0.00 33.47 32.31 1u10 s TRP 203 CO 0.34 -0.43 1.11 1.19 -4.62 0.00 0.00 176.95 174.54 1u10 n PHE 204 N -0.20 1.38 0.00 5.86 3.72 -1.26 -4.07 117.46 122.89 1u10 n PHE 204 Ca -0.05 0.45 0.00 0.00 -0.05 0.00 0.00 57.45 57.79 1u10 n PHE 204 Cb 0.61 -2.22 0.00 0.00 -0.94 0.00 0.00 39.48 36.92 1u10 n PHE 204 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1u10 n GLN 205 N -0.93 0.00 -4.03 -1.08 3.00 -1.26 -4.85 117.38 108.22 1u10 n GLN 205 Ca 0.12 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.83 1u10 n GLN 205 Cb 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 30.24 30.67 1u10 n GLN 205 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1u10 n HIS 206 N 14.00 -1.71 0.05 1.08 8.25 -1.26 -3.64 115.22 131.99 1u10 n HIS 206 Ca 0.00 0.77 0.01 0.00 -0.26 0.00 0.00 57.72 58.24 1u10 n HIS 206 Cb 0.00 -3.53 -0.06 0.00 1.12 0.00 0.00 29.99 27.52 1u10 n HIS 206 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u10 h ARG 207 N -1.76 0.00 0.00 -0.41 3.08 -1.93 -2.31 114.38 111.04 1u10 h ARG 207 Ca -0.62 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.43 1u10 h ARG 207 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.43 1u10 h ARG 207 CO 0.67 0.29 -0.86 0.00 -1.07 0.00 0.00 179.97 179.00 1u10 n ALA 208 N -2.36 2.30 -3.00 0.04 0.00 -1.26 -3.10 120.51 113.13 1u10 n ALA 208 Ca -0.08 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1u10 n ALA 208 Cb 0.81 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1u10 n ALA 208 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1u10 n HIS 209 N -1.47 0.00 -3.48 0.00 8.25 -1.26 -0.51 115.22 116.75 1u10 n HIS 209 Ca -0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.35 1u10 n HIS 209 Cb 0.10 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.12 1u10 n HIS 209 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1u10 s HIS 211 N 2.61 -0.72 -0.21 4.41 5.04 0.77 -4.70 115.29 122.49 1u10 s HIS 211 Ca 0.00 0.97 -0.10 0.00 -1.54 0.00 0.00 55.06 54.39 1u10 s HIS 211 Cb 0.00 0.05 -0.05 0.00 0.04 0.00 0.00 32.58 32.62 1u10 s HIS 211 CO 0.00 -0.60 0.13 0.08 -2.34 0.00 0.00 174.74 172.00 1u10 s VAL 212 N 2.53 5.33 -0.09 0.89 1.01 -0.32 -0.46 120.40 129.29 1u10 s VAL 212 Ca 0.07 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.25 1u10 s VAL 212 Cb -0.14 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.80 1u10 s VAL 212 CO -0.14 0.42 -0.23 -0.60 0.00 0.00 0.00 175.10 174.56 1u10 s ARG 213 N 0.49 2.87 0.26 2.72 3.52 -0.22 -0.50 118.95 128.10 1u10 s ARG 213 Ca 0.07 -0.82 0.04 0.00 -0.13 0.00 0.00 55.73 54.90 1u10 s ARG 213 Cb -0.12 -2.18 -0.03 0.00 -1.56 0.00 0.00 34.95 31.06 1u10 s ARG 213 CO -0.01 0.16 0.39 -0.51 -0.81 0.00 0.00 175.30 174.53 1u10 s LEU 214 N 0.37 4.26 0.75 -0.88 1.43 -0.30 -1.26 118.68 123.05 1u10 s LEU 214 Ca -0.18 0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 52.94 1u10 s LEU 214 Cb -0.18 -2.94 0.04 0.00 0.03 0.00 0.00 46.19 43.15 1u10 s LEU 214 CO 0.08 -0.12 1.08 0.00 0.23 0.00 0.00 176.35 177.62 1u10 s ARG 215 N -4.04 2.45 0.31 1.70 1.70 -0.22 -4.77 118.95 116.08 1u10 s ARG 215 Ca 0.35 1.03 -0.29 0.00 -0.47 0.00 0.00 55.73 56.35 1u10 s ARG 215 Cb -0.09 -1.93 -0.10 0.00 -0.57 0.00 0.00 34.95 32.26 1u10 s ARG 215 CO 0.30 -1.47 1.35 0.00 -1.08 0.00 0.00 175.30 174.41 1u10 n PRO 217 N 1.18 2.61 -0.22 0.00 -0.02 -1.26 -4.91 135.00 132.38 1u10 n PRO 217 Ca 0.02 0.93 -0.08 0.00 -2.02 0.00 0.00 63.50 62.35 1u10 n PRO 217 Cb 0.41 -2.69 -0.03 0.00 -0.02 0.00 0.00 33.50 31.17 1u10 n PRO 217 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u10 h ALA 218 N 4.68 -0.27 0.00 3.55 0.00 -2.03 -0.79 119.26 124.41 1u10 h ALA 218 Ca -0.47 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1u10 h ALA 218 Cb 1.23 0.96 0.00 0.00 0.00 0.00 0.00 17.79 19.98 1u10 h ALA 218 CO 0.79 -0.80 0.00 -0.40 0.00 0.00 0.00 179.25 178.83 1u10 n ASP 219 N -5.41 0.00 -4.58 0.00 5.75 -1.26 -4.68 116.55 106.37 1u10 n ASP 219 Ca 0.03 -0.07 -0.42 0.00 -0.01 0.00 0.00 54.79 54.31 1u10 n ASP 219 Cb 0.35 -0.27 -0.02 0.00 -1.03 0.00 0.00 41.12 40.15 1u10 n ASP 219 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1u10 s SER 220 N -2.54 6.42 0.21 -1.12 0.01 -0.30 -4.89 113.70 111.49 1u10 s SER 220 Ca 0.22 0.15 0.11 0.00 1.31 0.00 0.00 55.95 57.74 1u10 s SER 220 Cb 0.15 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.85 1u10 s SER 220 CO 0.34 -1.49 1.41 -0.07 0.41 0.00 0.00 173.24 173.83 1u10 h LEU 221 N 12.01 0.00 -4.10 2.44 3.38 -1.85 -3.32 115.31 123.87 1u10 h LEU 221 Ca -0.25 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.04 1u10 h LEU 221 Cb 1.06 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.51 1u10 h LEU 221 CO 1.18 0.76 0.74 -0.62 0.09 0.00 0.00 178.44 180.59 1u10 n GLU 222 N -3.40 2.79 -4.78 1.13 1.02 -1.26 -4.94 120.64 111.20 1u10 n GLU 222 Ca 0.00 -3.41 -0.33 0.00 -0.02 0.00 0.00 57.16 53.41 1u10 n GLU 222 Cb 0.80 -2.29 -0.14 0.00 -0.02 0.00 0.00 31.44 29.80 1u10 n GLU 222 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1u10 s GLU 224 N -0.12 3.45 0.73 0.00 2.02 -0.24 -4.92 118.70 119.63 1u10 s GLU 224 Ca -0.01 -0.64 -0.09 0.00 0.02 0.00 0.00 54.97 54.26 1u10 s GLU 224 Cb -0.14 -3.51 0.06 0.00 0.10 0.00 0.00 34.13 30.65 1u10 s GLU 224 CO 0.03 -0.34 1.07 -0.51 0.02 0.00 0.00 175.26 175.53 1u10 s ASP 225 N 1.62 4.83 0.15 -0.19 1.01 -1.26 -4.66 116.67 118.17 1u10 s ASP 225 Ca 0.05 0.65 0.06 0.00 0.71 0.00 0.00 52.55 54.03 1u10 s ASP 225 Cb -0.16 -1.29 -0.04 0.00 1.01 0.00 0.00 42.92 42.44 1u10 s ASP 225 CO 0.06 -1.64 0.02 -1.10 0.21 0.00 0.00 175.17 172.72 1u10 s GLN 226 N -5.35 2.53 1.24 8.23 -0.21 -1.26 -5.11 119.66 119.73 1u10 s GLN 226 Ca 0.60 -0.99 -0.17 0.00 0.02 0.00 0.00 55.36 54.82 1u10 s GLN 226 Cb -0.11 -2.46 0.30 0.00 1.00 0.00 0.00 33.01 31.74 1u10 s GLN 226 CO 0.47 0.49 1.02 -2.14 -2.12 0.00 0.00 175.29 173.00 1u10 s PRO 227 N -2.78 -1.50 0.77 2.91 0.02 -1.26 -4.97 135.00 128.19 1u10 s PRO 227 Ca 0.27 0.37 -0.11 0.00 0.02 0.00 0.00 61.00 61.55 1u10 s PRO 227 Cb -0.10 -1.52 0.06 0.00 0.02 0.00 0.00 34.50 32.95 1u10 s PRO 227 CO 0.19 -3.99 1.09 -0.51 -0.33 0.00 0.00 177.00 173.45 1u10 s LEU 228 N -7.28 2.70 0.72 -5.54 1.43 -1.26 -5.04 118.68 104.42 1u10 s LEU 228 Ca 0.69 1.33 -0.10 0.00 -1.03 0.00 0.00 54.13 55.01 1u10 s LEU 228 Cb -0.17 -4.00 0.04 0.00 0.03 0.00 0.00 46.19 42.08 1u10 s LEU 228 CO 0.60 -1.83 1.09 -2.84 0.23 0.00 0.00 176.35 173.60 1u10 s PRO 229 N -5.16 2.53 0.69 1.29 0.02 -1.26 -5.00 135.00 128.11 1u10 s PRO 229 Ca 0.60 0.23 -0.17 0.00 0.02 0.00 0.00 61.00 61.68 1u10 s PRO 229 Cb -0.14 -2.05 -0.05 0.00 0.02 0.00 0.00 34.50 32.28 1u10 s PRO 229 CO 0.54 -1.18 0.49 -2.30 -0.33 0.00 0.00 177.00 174.21 1u10 n PRO 230 N -3.04 0.33 -2.60 5.54 -0.02 -1.26 -4.94 135.00 129.01 1u10 n PRO 230 Ca 0.07 0.15 -0.33 0.00 -2.02 0.00 0.00 63.50 61.36 1u10 n PRO 230 Cb 0.59 -1.77 -0.04 0.00 -0.02 0.00 0.00 33.50 32.25 1u10 n PRO 230 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1u10 s SER 231 N -1.39 6.54 0.00 2.55 1.04 -1.26 -4.91 113.70 116.27 1u10 s SER 231 Ca 0.65 1.81 0.00 0.00 0.48 0.00 0.00 55.95 58.89 1u10 s SER 231 Cb -0.37 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.20 1u10 s SER 231 CO 0.58 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.77 1u10 n GLY 232 N -0.54 0.67 0.23 7.32 0.00 -1.26 -4.55 105.19 107.06 1u10 n GLY 232 Ca 0.08 -1.78 0.15 0.00 0.00 0.00 0.00 46.02 44.47 1u10 n GLY 232 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1u10 h ASP 233 N 0.00 0.00 -0.15 1.61 3.04 -1.89 -3.38 116.42 115.65 1u10 h ASP 233 Ca 0.00 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.73 1u10 h ASP 233 Cb 0.00 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.26 1u10 h ASP 233 CO 0.00 0.00 -0.06 0.61 -2.04 0.00 0.00 179.24 177.75 1u10 n GLY 234 N -1.22 0.49 0.03 7.15 0.00 -1.26 -4.26 105.19 106.12 1u10 n GLY 234 Ca -0.02 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.00 1u10 n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u10 n GLY 236 N 0.96 0.63 0.32 0.00 0.00 -1.26 -4.69 105.19 101.15 1u10 n GLY 236 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 1u10 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u10 h ALA 237 N -2.00 -0.25 -0.43 4.61 0.00 -1.98 -0.77 119.26 118.43 1u10 h ALA 237 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1u10 h ALA 237 Cb 0.00 0.61 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 1u10 h ALA 237 CO 0.00 -0.74 0.06 1.49 0.00 0.00 0.00 179.25 180.05 1u10 h GLU 238 N -0.32 0.17 -0.86 0.00 4.81 -1.92 0.95 114.58 117.43 1u10 h GLU 238 Ca 0.13 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1u10 h GLU 238 Cb 0.52 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 1u10 h GLU 238 CO -0.42 0.11 0.48 1.25 -0.73 0.00 0.00 179.01 179.71 1u10 h LEU 239 N 0.18 1.06 -1.47 1.64 5.85 -1.49 -2.37 115.31 118.71 1u10 h LEU 239 Ca 0.21 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1u10 h LEU 239 Cb 0.28 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1u10 h LEU 239 CO -0.31 0.84 0.14 -0.61 -0.34 0.00 0.00 178.44 178.17 1u10 h GLN 240 N 1.19 0.50 -0.06 1.25 4.15 0.31 -1.23 115.11 121.22 1u10 h GLN 240 Ca 0.30 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.68 1u10 h GLN 240 Cb 0.01 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1u10 h GLN 240 CO -0.05 0.41 0.06 0.66 -1.93 0.00 0.00 178.83 177.98 1u10 h SER 241 N 0.50 0.00 0.98 -0.69 4.64 -0.32 -0.31 113.55 118.35 1u10 h SER 241 Ca 0.12 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.34 1u10 h SER 241 Cb 0.10 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 1u10 h SER 241 CO -0.01 0.00 -0.52 -0.50 -0.87 0.00 0.00 176.83 174.93 1u10 h TRP 242 N 0.00 0.00 -0.10 4.77 4.06 -1.26 -3.03 115.95 120.39 1u10 h TRP 242 Ca 0.03 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.98 1u10 h TRP 242 Cb 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.31 1u10 h TRP 242 CO 0.00 0.52 0.00 1.19 -3.56 0.00 0.00 178.44 176.59 1u10 n PHE 243 N -3.48 0.14 -0.76 0.49 3.72 -0.13 -5.04 117.46 112.40 1u10 n PHE 243 Ca 0.00 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1u10 n PHE 243 Cb 0.63 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.17 1u10 n PHE 243 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1u10 n GLU 244 N -0.22 0.00 -4.57 -1.08 4.07 -1.15 -5.05 120.64 112.64 1u10 n GLU 244 Ca 0.08 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 56.96 1u10 n GLU 244 Cb 0.13 -0.25 -0.14 0.00 -0.06 0.00 0.00 31.44 31.11 1u10 n GLU 244 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 1u10 s LEU 261 N 0.00 2.10 0.22 4.31 2.96 -1.26 -5.09 118.68 121.92 1u10 s LEU 261 Ca 0.00 -0.38 -0.31 0.00 -0.22 0.00 0.00 54.13 53.22 1u10 s LEU 261 Cb 0.00 -0.75 -0.15 0.00 0.50 0.00 0.00 46.19 45.80 1u10 s LEU 261 CO 0.00 0.13 1.21 -2.65 -1.32 0.00 0.00 176.35 173.72 1u10 n PRO 262 N 2.27 1.50 -0.29 0.98 -0.02 -1.26 -4.66 135.00 133.52 1u10 n PRO 262 Ca -0.16 0.53 0.10 0.00 -2.02 0.00 0.00 63.50 61.96 1u10 n PRO 262 Cb 0.54 -2.06 0.26 0.00 -0.02 0.00 0.00 33.50 32.23 1u10 n PRO 262 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1u10 h PRO 263 N 3.33 0.37 -0.91 0.52 0.11 -2.02 0.24 132.00 133.65 1u10 h PRO 263 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1u10 h PRO 263 Cb 1.32 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 1u10 h PRO 263 CO 0.70 0.24 0.58 1.03 -0.21 0.00 0.00 178.00 180.34 1u10 h SER 264 N 0.38 1.06 -0.11 -2.05 0.87 -2.00 0.81 113.55 112.51 1u10 h SER 264 Ca 0.51 -0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.97 1u10 h SER 264 Cb 0.93 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 1u10 h SER 264 CO -0.51 0.78 -0.17 0.00 -0.53 0.00 0.00 176.83 176.40 1u10 h GLN 266 N -0.11 0.89 -0.89 0.00 5.75 -0.78 -0.97 115.11 119.00 1u10 h GLN 266 Ca 0.01 -0.05 0.12 0.00 -0.15 0.00 0.00 58.65 58.57 1u10 h GLN 266 Cb 0.73 -0.20 -0.08 0.00 1.07 0.00 0.00 27.48 29.00 1u10 h GLN 266 CO 0.04 0.59 0.51 0.00 -2.65 0.00 0.00 178.83 177.32 1u10 h ALA 267 N 1.55 1.31 -0.59 3.38 0.00 -0.78 0.38 119.26 124.50 1u10 h ALA 267 Ca 0.39 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.39 1u10 h ALA 267 Cb 0.33 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1u10 h ALA 267 CO -0.16 0.09 0.39 -0.07 0.00 0.00 0.00 179.25 179.50 1u10 h LEU 268 N 0.81 0.55 0.18 0.00 3.38 -1.17 -1.50 115.31 117.57 1u10 h LEU 268 Ca 0.45 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.40 1u10 h LEU 268 Cb 0.48 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1u10 h LEU 268 CO -0.28 0.37 -0.09 -0.07 0.09 0.00 0.00 178.44 178.46 1u10 h LEU 269 N 0.63 -0.21 -1.68 1.67 3.38 -0.38 0.59 115.31 119.31 1u10 h LEU 269 Ca 0.24 -0.23 0.10 0.00 0.09 0.00 0.00 57.88 58.08 1u10 h LEU 269 Cb 0.18 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1u10 h LEU 269 CO -0.07 0.34 0.58 0.44 0.09 0.00 0.00 178.44 179.81 1u10 h ASP 270 N -0.98 0.00 -0.28 -0.43 3.32 -0.22 0.78 116.42 118.62 1u10 h ASP 270 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1u10 h ASP 270 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1u10 h ASP 270 CO 0.04 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.94 1u10 n GLU 271 N -3.31 2.63 -3.50 3.56 1.02 -0.58 -5.01 120.64 115.46 1u10 n GLU 271 Ca 0.07 -1.90 -0.20 0.00 -0.02 0.00 0.00 57.16 55.10 1u10 n GLU 271 Cb 0.72 -1.23 0.08 0.00 -0.02 0.00 0.00 31.44 30.99 1u10 n GLU 271 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1u10 n HIS 272 N 0.42 -2.53 0.29 -0.32 8.25 0.27 -4.92 115.22 116.67 1u10 n HIS 272 Ca 0.10 0.96 0.11 0.00 -0.26 0.00 0.00 57.72 58.63 1u10 n HIS 272 Cb 0.39 -4.98 -0.04 0.00 1.12 0.00 0.00 29.99 26.48 1u10 n HIS 272 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1u10 n VAL 273 N -4.57 0.25 1.60 1.59 0.31 0.18 -5.05 118.33 112.65 1u10 n VAL 273 Ca -0.12 -0.39 0.14 0.00 -0.01 0.00 0.00 64.34 63.96 1u10 n VAL 273 Cb 0.61 0.01 0.61 0.00 -0.91 0.00 0.00 33.84 34.16 1u10 n VAL 273 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13