#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gbt s VAL 17 N 0.00 5.14 0.00 1.39 1.01 0.15 -4.01 120.40 124.08 1gbt s VAL 17 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1gbt s VAL 17 Cb 0.00 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.61 1gbt s VAL 17 CO 0.00 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1gbt n GLY 18 N 4.24 0.38 0.00 4.51 0.00 -1.25 -1.54 105.19 111.52 1gbt n GLY 18 Ca -0.06 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1gbt n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gbt n GLY 19 N -2.81 1.80 3.19 -0.02 0.00 -1.26 -4.86 105.19 101.23 1gbt n GLY 19 Ca 0.00 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.90 1gbt n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1gbt s TYR 20 N 2.08 1.03 0.16 1.61 1.13 -0.65 -4.91 117.35 117.80 1gbt s TYR 20 Ca 0.00 -0.81 -0.31 0.00 -1.41 0.00 0.00 57.07 54.53 1gbt s TYR 20 Cb 0.00 -0.56 -0.10 0.00 -1.10 0.00 0.00 41.96 40.20 1gbt s TYR 20 CO 0.00 -0.05 1.64 0.99 -2.51 0.00 0.00 175.55 175.62 1gbt s THR 21 N -3.28 2.53 0.20 -3.49 2.01 -1.26 -1.30 115.64 111.05 1gbt s THR 21 Ca 0.12 0.32 -0.07 0.00 0.31 0.00 0.00 61.69 62.36 1gbt s THR 21 Cb 0.03 -3.20 0.07 0.00 0.01 0.00 0.00 72.50 69.41 1gbt s THR 21 CO -0.02 0.02 1.67 0.00 -0.69 0.00 0.00 174.62 175.59 1gbt n GLY 23 N -0.44 2.86 3.69 0.00 0.00 -1.26 -4.83 105.19 105.21 1gbt n GLY 23 Ca 0.03 -1.32 -0.44 0.00 0.00 0.00 0.00 46.02 44.28 1gbt n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gbt n ALA 24 N 1.41 2.01 -1.22 4.61 0.00 -1.26 -2.22 120.51 123.84 1gbt n ALA 24 Ca 0.00 0.42 -0.08 0.00 0.00 0.00 0.00 53.44 53.79 1gbt n ALA 24 Cb 0.00 -2.43 -0.03 0.00 0.00 0.00 0.00 19.45 16.99 1gbt n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1gbt n ASN 25 N 3.73 -4.93 -0.02 0.00 3.02 -1.26 -4.88 115.26 110.92 1gbt n ASN 25 Ca 0.17 0.19 0.13 0.00 -0.03 0.00 0.00 54.58 55.04 1gbt n ASN 25 Cb 0.32 -3.10 0.50 0.00 -0.61 0.00 0.00 39.78 36.88 1gbt n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1gbt n THR 26 N -2.44 0.00 -3.32 3.41 -2.24 -0.94 -3.90 114.28 104.85 1gbt n THR 26 Ca -0.08 -0.01 -0.27 0.00 -2.27 0.00 0.00 64.05 61.43 1gbt n THR 26 Cb 0.42 -0.19 -0.07 0.00 -2.10 0.00 0.00 70.33 68.38 1gbt n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1gbt n VAL 27 N -1.41 2.26 0.13 2.28 0.31 -1.26 -4.98 118.33 115.66 1gbt n VAL 27 Ca 0.08 -5.20 0.09 0.00 -0.01 0.00 0.00 64.34 59.29 1gbt n VAL 27 Cb 0.33 -1.94 0.47 0.00 -0.91 0.00 0.00 33.84 31.78 1gbt n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1gbt n PRO 28 N 0.68 0.11 -0.10 5.55 -0.04 -1.25 -1.84 135.00 138.11 1gbt n PRO 28 Ca 0.30 0.61 0.12 0.00 -0.04 0.00 0.00 63.50 64.48 1gbt n PRO 28 Cb 0.42 -1.87 0.21 0.00 -0.04 0.00 0.00 33.50 32.23 1gbt n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1gbt n TYR 29 N -2.10 0.26 -2.65 0.54 0.18 -1.22 -2.33 117.16 109.84 1gbt n TYR 29 Ca -0.01 -0.13 -0.42 0.00 1.88 0.00 0.00 57.90 59.22 1gbt n TYR 29 Cb 0.03 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 38.96 1gbt n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1gbt s GLN 30 N -1.74 4.50 0.24 -3.48 2.00 -0.77 -0.88 119.66 119.53 1gbt s GLN 30 Ca 0.34 1.47 0.12 0.00 -2.00 0.00 0.00 55.36 55.29 1gbt s GLN 30 Cb 0.21 -3.47 -0.05 0.00 0.80 0.00 0.00 33.01 30.50 1gbt s GLN 30 CO 0.31 -0.17 -0.22 0.14 -0.50 0.00 0.00 175.29 174.85 1gbt s VAL 31 N 1.34 2.43 -0.19 1.34 -7.23 -0.19 -4.41 120.40 113.48 1gbt s VAL 31 Ca 0.52 -2.22 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 1gbt s VAL 31 Cb -0.22 -2.22 -0.01 0.00 0.56 0.00 0.00 36.38 34.49 1gbt s VAL 31 CO 0.25 -0.26 -0.07 -0.55 -0.31 0.00 0.00 175.10 174.16 1gbt s SER 32 N -3.09 4.21 -0.11 4.85 0.15 -0.75 -2.02 113.70 116.94 1gbt s SER 32 Ca 0.25 -0.37 -0.22 0.00 0.70 0.00 0.00 55.95 56.32 1gbt s SER 32 Cb -0.06 -1.70 -0.04 0.00 -1.71 0.00 0.00 66.02 62.51 1gbt s SER 32 CO 0.12 0.04 0.63 -0.76 1.20 0.00 0.00 173.24 174.47 1gbt s LEU 33 N 1.11 4.27 -0.03 3.45 1.43 0.66 -1.35 118.68 128.22 1gbt s LEU 33 Ca 0.01 1.02 0.02 0.00 -1.03 0.00 0.00 54.13 54.15 1gbt s LEU 33 Cb -0.15 -2.94 0.01 0.00 0.03 0.00 0.00 46.19 43.14 1gbt s LEU 33 CO -0.01 -0.12 -0.06 0.21 0.23 0.00 0.00 176.35 176.60 1gbt s ASN 34 N 0.83 0.97 -0.34 2.29 2.47 -0.22 -1.34 114.94 119.60 1gbt s ASN 34 Ca 0.33 -0.14 0.14 0.00 0.42 0.00 0.00 52.86 53.61 1gbt s ASN 34 Cb -0.17 -0.34 0.46 0.00 -1.45 0.00 0.00 41.25 39.75 1gbt s ASN 34 CO 0.14 0.01 1.05 -1.54 -3.72 0.00 0.00 177.10 173.04 1gbt n SER 37 N 3.58 2.72 0.00 -4.21 3.41 -1.26 -1.73 113.62 116.13 1gbt n SER 37 Ca -0.21 -2.97 0.00 0.00 -0.26 0.00 0.00 58.87 55.43 1gbt n SER 37 Cb 0.53 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1gbt n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gbt n GLY 38 N -0.34 0.52 3.61 5.00 0.00 -1.26 -5.00 105.19 107.71 1gbt n GLY 38 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 1gbt n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1gbt s TYR 39 N -2.00 -0.10 0.01 1.61 1.13 -1.26 -5.13 117.35 111.61 1gbt s TYR 39 Ca 0.00 0.03 -0.30 0.00 -1.41 0.00 0.00 57.07 55.39 1gbt s TYR 39 Cb 0.00 0.52 -0.04 0.00 -1.10 0.00 0.00 41.96 41.34 1gbt s TYR 39 CO 0.00 -0.21 1.10 -1.58 -2.51 0.00 0.00 175.55 172.35 1gbt s HIS 40 N -2.39 3.50 0.00 -3.49 5.65 -1.26 -4.34 115.29 112.95 1gbt s HIS 40 Ca 0.11 1.47 0.00 0.00 0.25 0.00 0.00 55.06 56.89 1gbt s HIS 40 Cb 0.01 -3.28 0.00 0.00 -1.18 0.00 0.00 32.58 28.12 1gbt s HIS 40 CO -0.04 -0.70 0.00 1.97 -0.65 0.00 0.00 174.74 175.32 1gbt n PHE 41 N 4.19 0.00 -3.82 3.88 1.16 -0.45 -4.99 117.46 117.43 1gbt n PHE 41 Ca 0.08 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.58 1gbt n PHE 41 Cb 0.48 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.33 1gbt n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1gbt n GLY 43 N -0.43 3.53 2.76 0.00 0.00 0.48 -0.25 105.19 111.28 1gbt n GLY 43 Ca -0.06 -2.10 -0.01 0.00 0.00 0.00 0.00 46.02 43.86 1gbt n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gbt n GLY 44 N 5.00 0.63 3.10 -0.02 0.00 -0.86 -3.78 105.19 109.26 1gbt n GLY 44 Ca 0.00 -1.05 -0.21 0.00 0.00 0.00 0.00 46.02 44.77 1gbt n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gbt s SER 45 N -2.83 1.50 -0.21 1.61 0.01 0.21 -1.03 113.70 112.96 1gbt s SER 45 Ca 0.18 -0.29 -0.24 0.00 1.31 0.00 0.00 55.95 56.91 1gbt s SER 45 Cb -0.01 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 1gbt s SER 45 CO 0.02 0.11 0.78 -0.22 0.41 0.00 0.00 173.24 174.35 1gbt s LEU 46 N -0.55 4.12 0.00 2.44 2.96 -0.05 -1.33 118.68 126.27 1gbt s LEU 46 Ca 0.04 1.01 0.10 0.00 -0.22 0.00 0.00 54.13 55.06 1gbt s LEU 46 Cb -0.06 -3.12 -0.03 0.00 0.50 0.00 0.00 46.19 43.48 1gbt s LEU 46 CO 0.00 -0.43 0.59 2.30 -1.32 0.00 0.00 176.35 177.49 1gbt n ILE 47 N 5.01 0.00 -3.84 6.68 -5.35 -0.49 -1.28 119.36 120.09 1gbt n ILE 47 Ca 0.04 -0.36 -0.03 0.00 -0.27 0.00 0.00 62.75 62.12 1gbt n ILE 47 Cb 0.48 1.09 0.01 0.00 -1.74 0.00 0.00 39.64 39.49 1gbt n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1gbt s ASN 48 N -1.53 -0.04 0.14 7.28 2.20 -1.08 -4.56 114.94 117.35 1gbt s ASN 48 Ca 0.07 -0.62 0.09 0.00 -0.94 0.00 0.00 52.86 51.47 1gbt s ASN 48 Cb 0.08 0.50 0.51 0.00 -2.00 0.00 0.00 41.25 40.34 1gbt s ASN 48 CO 0.30 -0.98 1.29 -1.54 -2.94 0.00 0.00 177.10 173.23 1gbt n SER 49 N -1.04 0.24 0.00 3.54 3.41 -1.26 -2.42 113.62 116.10 1gbt n SER 49 Ca -0.04 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1gbt n SER 49 Cb 0.60 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1gbt n SER 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gbt n GLN 50 N -1.83 0.02 -3.90 4.33 6.02 -1.26 -0.61 117.38 120.15 1gbt n GLN 50 Ca -0.01 -0.33 -0.14 0.00 -0.01 0.00 0.00 57.00 56.51 1gbt n GLN 50 Cb 0.02 -0.66 -0.15 0.00 1.02 0.00 0.00 30.24 30.47 1gbt n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1gbt s TRP 51 N -0.08 0.14 -0.05 1.08 0.52 -1.01 -1.29 118.94 118.24 1gbt s TRP 51 Ca 0.00 0.02 0.03 0.00 0.02 0.00 0.00 56.10 56.16 1gbt s TRP 51 Cb 0.00 -0.19 -0.03 0.00 -1.15 0.00 0.00 33.47 32.11 1gbt s TRP 51 CO 0.00 -0.05 -0.11 0.08 0.02 0.00 0.00 176.95 176.89 1gbt s VAL 52 N 0.44 3.35 -0.08 4.03 1.01 -0.58 -1.39 120.40 127.17 1gbt s VAL 52 Ca -0.04 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 1gbt s VAL 52 Cb -0.06 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 1gbt s VAL 52 CO -0.01 0.58 -0.02 0.54 0.00 0.00 0.00 175.10 176.19 1gbt s VAL 53 N -0.78 4.12 0.00 2.92 0.11 -0.44 -0.86 120.40 125.46 1gbt s VAL 53 Ca 0.12 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.85 1gbt s VAL 53 Cb -0.11 -2.72 0.00 0.00 -1.53 0.00 0.00 36.38 32.02 1gbt s VAL 53 CO 0.01 0.60 0.00 -0.24 -3.33 0.00 0.00 175.10 172.14 1gbt n SER 54 N 2.23 0.00 -4.90 3.54 2.88 -0.62 -0.61 113.62 116.13 1gbt n SER 54 Ca -0.18 -0.96 -0.33 0.00 -1.33 0.00 0.00 58.87 56.07 1gbt n SER 54 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.95 1gbt n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gbt s ALA 55 N -1.70 3.91 0.39 -1.46 0.00 -1.26 -0.71 121.76 120.94 1gbt s ALA 55 Ca 0.00 -0.69 0.08 0.00 0.00 0.00 0.00 51.96 51.35 1gbt s ALA 55 Cb 0.00 -1.96 0.85 0.00 0.00 0.00 0.00 23.12 22.01 1gbt s ALA 55 CO 0.00 0.72 1.99 0.00 0.00 0.00 0.00 175.76 178.47 1gbt h ALA 56 N 3.63 1.79 0.00 0.00 0.00 -1.71 -1.83 119.26 121.13 1gbt h ALA 56 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1gbt h ALA 56 Cb 1.18 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1gbt h ALA 56 CO 0.70 0.12 0.00 -2.39 0.00 0.00 0.00 179.25 177.68 1gbt n HIS 57 N -4.47 0.00 1.51 0.00 1.44 -1.26 -1.93 115.22 110.50 1gbt n HIS 57 Ca 0.08 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.93 1gbt n HIS 57 Cb 0.22 -0.46 0.58 0.00 0.12 0.00 0.00 29.99 30.45 1gbt n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1gbt n TYR 59 N -0.44 2.53 -3.77 0.00 9.36 -0.81 -4.96 117.16 119.08 1gbt n TYR 59 Ca 0.17 0.10 -0.06 0.00 3.32 0.00 0.00 57.90 61.43 1gbt n TYR 59 Cb 0.30 -2.63 -0.02 0.00 -0.63 0.00 0.00 39.34 36.36 1gbt n TYR 59 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 1gbt s LYS 60 N 1.41 1.46 0.55 2.98 -2.85 -1.26 -5.15 119.74 116.89 1gbt s LYS 60 Ca 0.78 -0.78 -0.02 0.00 -1.00 0.00 0.00 55.97 54.95 1gbt s LYS 60 Cb -0.58 0.51 0.02 0.00 -2.06 0.00 0.00 37.83 35.73 1gbt s LYS 60 CO 0.36 -0.67 0.81 -1.54 0.10 0.00 0.00 175.35 174.41 1gbt s SER 61 N -2.89 5.48 -0.71 0.03 1.04 -1.26 -4.44 113.70 110.95 1gbt s SER 61 Ca 0.10 0.37 -0.04 0.00 0.48 0.00 0.00 55.95 56.86 1gbt s SER 61 Cb -0.04 -1.37 0.00 0.00 0.10 0.00 0.00 66.02 64.72 1gbt s SER 61 CO 0.03 -1.04 0.62 0.61 0.98 0.00 0.00 173.24 174.43 1gbt n GLY 62 N -2.41 0.16 3.74 7.32 0.00 -1.26 -5.02 105.19 107.71 1gbt n GLY 62 Ca 0.05 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 1gbt n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gbt s ILE 63 N -3.17 5.40 -0.22 -0.61 1.01 -1.26 -4.50 121.20 117.84 1gbt s ILE 63 Ca 0.29 0.25 -0.07 0.00 0.00 0.00 0.00 60.65 61.12 1gbt s ILE 63 Cb -0.13 -3.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1gbt s ILE 63 CO 0.38 0.44 0.05 -1.58 0.00 0.00 0.00 174.94 174.23 1gbt s GLN 64 N 0.32 3.72 -0.12 2.79 0.74 -0.70 -1.81 119.66 124.60 1gbt s GLN 64 Ca 0.10 -0.46 -0.25 0.00 0.05 0.00 0.00 55.36 54.80 1gbt s GLN 64 Cb -0.11 -3.23 -0.02 0.00 1.10 0.00 0.00 33.01 30.74 1gbt s GLN 64 CO -0.01 -0.03 0.78 0.08 -0.55 0.00 0.00 175.29 175.57 1gbt s VAL 65 N 1.16 4.95 -0.30 1.34 1.01 -0.14 -1.05 120.40 127.37 1gbt s VAL 65 Ca 0.04 1.57 -0.05 0.00 0.00 0.00 0.00 61.98 63.54 1gbt s VAL 65 Cb -0.14 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.16 1gbt s VAL 65 CO 0.03 0.13 0.04 -0.13 0.00 0.00 0.00 175.10 175.17 1gbt s ARG 65 N 1.52 2.80 0.22 2.72 0.52 -0.46 -0.72 118.95 125.56 1gbt s ARG 65 Ca 0.39 -1.03 0.02 0.00 -0.52 0.00 0.00 55.73 54.58 1gbt s ARG 65 Cb -0.17 -3.27 -0.04 0.00 0.52 0.00 0.00 34.95 31.99 1gbt s ARG 65 CO 0.16 -0.52 0.38 -0.51 0.02 0.00 0.00 175.30 174.83 1gbt s LEU 66 N 1.39 4.25 -1.73 2.53 1.43 0.41 -1.81 118.68 125.16 1gbt s LEU 66 Ca -0.00 0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 1gbt s LEU 66 Cb -0.18 -3.03 0.00 0.00 0.03 0.00 0.00 46.19 43.01 1gbt s LEU 66 CO 0.00 -0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.13 1gbt n GLY 69 N -1.02 0.22 3.85 -3.19 0.00 -1.26 -1.89 105.19 101.90 1gbt n GLY 69 Ca -0.07 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1gbt n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gbt s GLU 70 N -4.56 3.97 0.00 1.61 0.41 -1.26 -3.96 118.70 114.90 1gbt s GLU 70 Ca 0.00 0.57 0.00 0.00 -0.41 0.00 0.00 54.97 55.13 1gbt s GLU 70 Cb 0.00 -2.56 0.00 0.00 -1.78 0.00 0.00 34.13 29.79 1gbt s GLU 70 CO 0.00 0.24 0.00 -3.47 -0.49 0.00 0.00 175.26 171.54 1gbt n ASP 71 N -0.13 0.00 -4.66 -0.19 2.03 -1.26 -4.66 116.55 107.68 1gbt n ASP 71 Ca 0.02 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.90 1gbt n ASP 71 Cb 0.53 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.91 1gbt n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1gbt s ASN 72 N 1.00 7.06 0.01 1.67 3.04 -1.26 -3.50 114.94 122.97 1gbt s ASN 72 Ca 0.00 1.46 0.28 0.00 0.04 0.00 0.00 52.86 54.65 1gbt s ASN 72 Cb 0.00 -2.54 1.10 0.00 -1.54 0.00 0.00 41.25 38.27 1gbt s ASN 72 CO 0.00 -0.69 1.84 2.30 -3.04 0.00 0.00 177.10 177.51 1gbt n ILE 73 N 5.31 0.02 1.00 -5.21 -5.35 -0.47 -3.25 119.36 111.41 1gbt n ILE 73 Ca 0.12 -0.01 0.11 0.00 -0.27 0.00 0.00 62.75 62.70 1gbt n ILE 73 Cb 0.46 -0.37 0.05 0.00 -1.74 0.00 0.00 39.64 38.03 1gbt n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1gbt n ASN 74 N -1.52 0.80 -3.99 7.28 4.13 -1.26 -4.96 115.26 115.74 1gbt n ASN 74 Ca 0.07 -0.69 -0.21 0.00 1.68 0.00 0.00 54.58 55.43 1gbt n ASN 74 Cb 0.34 0.66 -0.16 0.00 -1.54 0.00 0.00 39.78 39.08 1gbt n ASN 74 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1gbt s VAL 75 N -2.98 0.84 -0.24 2.41 1.01 -1.20 -5.11 120.40 115.13 1gbt s VAL 75 Ca 0.10 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.43 1gbt s VAL 75 Cb 0.17 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.78 1gbt s VAL 75 CO 0.79 0.27 1.05 -0.69 0.00 0.00 0.00 175.10 176.52 1gbt s VAL 76 N 0.44 4.65 -0.49 2.92 1.01 -1.26 -4.75 120.40 122.92 1gbt s VAL 76 Ca -0.08 1.99 0.07 0.00 0.00 0.00 0.00 61.98 63.96 1gbt s VAL 76 Cb -0.12 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.91 1gbt s VAL 76 CO 0.01 -0.21 0.41 -0.62 0.00 0.00 0.00 175.10 174.69 1gbt n GLU 77 N 6.39 3.59 0.00 2.72 1.02 -1.26 -5.09 120.64 128.00 1gbt n GLU 77 Ca 0.12 -0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 1gbt n GLU 77 Cb 0.46 -0.91 0.00 0.00 -0.02 0.00 0.00 31.44 30.97 1gbt n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gbt n GLY 78 N 1.00 2.46 1.98 0.62 0.00 -1.26 -5.01 105.19 104.98 1gbt n GLY 78 Ca 0.02 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1gbt n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gbt n ASN 79 N 0.00 0.00 -4.79 1.61 3.02 -1.26 -4.96 115.26 108.89 1gbt n ASN 79 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 1gbt n ASN 79 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 1gbt n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1gbt s GLU 80 N -0.41 3.63 -0.07 3.52 8.01 -1.25 -4.39 118.70 127.73 1gbt s GLU 80 Ca 0.00 1.48 -0.03 0.00 0.01 0.00 0.00 54.97 56.44 1gbt s GLU 80 Cb 0.00 -2.08 0.04 0.00 -4.31 0.00 0.00 34.13 27.78 1gbt s GLU 80 CO 0.00 -0.60 0.12 -0.65 0.01 0.00 0.00 175.26 174.15 1gbt s GLN 81 N -3.21 -0.00 -0.42 1.61 -0.21 -0.79 -4.99 119.66 111.64 1gbt s GLN 81 Ca 0.69 0.47 -0.10 0.00 0.02 0.00 0.00 55.36 56.44 1gbt s GLN 81 Cb -0.20 -0.43 0.07 0.00 1.00 0.00 0.00 33.01 33.45 1gbt s GLN 81 CO 0.23 -0.34 0.27 -0.06 -2.12 0.00 0.00 175.29 173.28 1gbt s PHE 82 N 2.25 3.31 -0.11 0.91 0.08 -1.26 -0.45 117.98 122.71 1gbt s PHE 82 Ca 0.04 -1.34 0.03 0.00 0.12 0.00 0.00 56.93 55.78 1gbt s PHE 82 Cb -0.12 -2.90 0.01 0.00 -0.57 0.00 0.00 43.02 39.44 1gbt s PHE 82 CO -0.05 -0.81 -0.19 0.42 -0.10 0.00 0.00 175.22 174.49 1gbt s ILE 83 N 1.48 1.75 0.97 0.64 1.01 0.10 -4.96 121.20 122.19 1gbt s ILE 83 Ca 0.03 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 59.74 1gbt s ILE 83 Cb -0.23 -1.55 0.17 0.00 0.01 0.00 0.00 42.46 40.86 1gbt s ILE 83 CO 0.04 0.49 1.09 -0.44 0.00 0.00 0.00 174.94 176.11 1gbt s SER 84 N 0.68 2.85 0.04 3.58 0.01 -1.26 -0.97 113.70 118.62 1gbt s SER 84 Ca -0.12 1.40 -0.23 0.00 1.31 0.00 0.00 55.95 58.30 1gbt s SER 84 Cb -0.16 -2.07 -0.06 0.00 0.21 0.00 0.00 66.02 63.94 1gbt s SER 84 CO 0.03 -3.02 0.71 0.00 0.41 0.00 0.00 173.24 171.37 1gbt s ALA 85 N -2.89 3.42 -0.10 1.44 0.00 -0.75 -1.64 121.76 121.24 1gbt s ALA 85 Ca 0.65 0.20 0.18 0.00 0.00 0.00 0.00 51.96 52.99 1gbt s ALA 85 Cb -0.19 -2.90 -0.27 0.00 0.00 0.00 0.00 23.12 19.76 1gbt s ALA 85 CO 0.58 0.13 0.26 -1.13 0.00 0.00 0.00 175.76 175.59 1gbt n SER 86 N 2.64 0.54 -3.60 0.00 3.41 0.65 -4.66 113.62 112.60 1gbt n SER 86 Ca -0.04 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.41 1gbt n SER 86 Cb 0.50 1.45 -0.07 0.00 -0.26 0.00 0.00 64.21 65.83 1gbt n SER 86 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1gbt s LYS 87 N -2.92 0.91 -0.08 4.33 -2.85 -1.15 -4.97 119.74 113.01 1gbt s LYS 87 Ca -0.08 0.41 0.04 0.00 -1.00 0.00 0.00 55.97 55.34 1gbt s LYS 87 Cb 0.09 0.43 -0.01 0.00 -2.06 0.00 0.00 37.83 36.28 1gbt s LYS 87 CO 0.78 -0.23 -0.21 -1.12 0.10 0.00 0.00 175.35 174.67 1gbt s SER 88 N -0.71 3.44 -0.40 0.03 0.01 -1.26 -0.54 113.70 114.27 1gbt s SER 88 Ca -0.08 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.77 1gbt s SER 88 Cb -0.02 -1.07 0.11 0.00 0.21 0.00 0.00 66.02 65.25 1gbt s SER 88 CO 0.06 0.24 0.16 -0.63 0.41 0.00 0.00 173.24 173.48 1gbt s ILE 89 N -0.10 2.81 0.34 1.44 1.01 0.14 -4.94 121.20 121.89 1gbt s ILE 89 Ca -0.04 -2.36 -0.28 0.00 0.00 0.00 0.00 60.65 57.97 1gbt s ILE 89 Cb -0.14 -2.98 -0.10 0.00 0.01 0.00 0.00 42.46 39.26 1gbt s ILE 89 CO 0.04 -0.67 1.22 -0.69 0.00 0.00 0.00 174.94 174.84 1gbt s VAL 90 N 0.83 2.99 0.21 2.92 1.01 -1.26 -2.00 120.40 125.10 1gbt s VAL 90 Ca 0.11 0.95 -0.32 0.00 0.00 0.00 0.00 61.98 62.72 1gbt s VAL 90 Cb -0.21 -3.59 -0.13 0.00 0.00 0.00 0.00 36.38 32.45 1gbt s VAL 90 CO -0.05 0.19 1.60 1.57 0.00 0.00 0.00 175.10 178.41 1gbt n HIS 91 N 0.67 2.52 0.00 5.22 -0.00 -1.05 -4.91 115.22 117.68 1gbt n HIS 91 Ca 0.01 0.22 0.23 0.00 0.46 0.00 0.00 57.72 58.63 1gbt n HIS 91 Cb 0.44 -2.58 0.73 0.00 -0.12 0.00 0.00 29.99 28.45 1gbt n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1gbt h PRO 92 N 5.73 0.00 -0.38 1.57 0.11 -1.93 -1.28 132.00 135.82 1gbt h PRO 92 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1gbt h PRO 92 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1gbt h PRO 92 CO 0.87 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.09 1gbt n SER 93 N -3.95 4.13 -4.72 -2.05 7.64 -1.26 -4.98 113.62 108.43 1gbt n SER 93 Ca 0.11 -2.74 -0.43 0.00 1.01 0.00 0.00 58.87 56.82 1gbt n SER 93 Cb 0.72 -0.52 -0.03 0.00 -1.01 0.00 0.00 64.21 63.38 1gbt n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gbt n TYR 94 N 0.08 2.68 -4.20 1.43 9.36 -0.49 -4.70 117.16 121.32 1gbt n TYR 94 Ca 0.21 0.19 -0.33 0.00 3.32 0.00 0.00 57.90 61.29 1gbt n TYR 94 Cb 0.86 -2.61 -0.16 0.00 -0.63 0.00 0.00 39.34 36.80 1gbt n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1gbt s ASN 95 N 0.79 3.30 0.47 2.98 3.84 -0.63 -5.00 114.94 120.69 1gbt s ASN 95 Ca 0.71 -0.60 0.26 0.00 0.21 0.00 0.00 52.86 53.44 1gbt s ASN 95 Cb -0.54 -1.51 0.99 0.00 -0.55 0.00 0.00 41.25 39.64 1gbt s ASN 95 CO 0.41 0.01 1.85 0.77 -2.79 0.00 0.00 177.10 177.35 1gbt h SER 96 N 7.83 0.00 -0.08 -4.21 4.64 -1.93 0.42 113.55 120.22 1gbt h SER 96 Ca -0.43 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.77 1gbt h SER 96 Cb 1.15 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1gbt h SER 96 CO 0.62 0.17 -0.43 0.78 -0.87 0.00 0.00 176.83 177.10 1gbt h ASN 97 N 0.00 0.51 0.64 4.97 2.35 -1.98 -3.33 115.58 118.74 1gbt h ASN 97 Ca -0.00 -0.66 -0.25 0.00 -0.55 0.00 0.00 56.30 54.84 1gbt h ASN 97 Cb 0.71 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.88 1gbt h ASN 97 CO 0.02 1.08 -1.50 0.71 -1.65 0.00 0.00 177.43 176.09 1gbt h THR 98 N -0.03 0.95 -0.19 2.81 1.35 -1.98 -3.48 112.91 112.34 1gbt h THR 98 Ca -0.03 -2.71 -0.08 0.00 -0.55 0.00 0.00 66.41 63.04 1gbt h THR 98 Cb 1.08 2.44 -0.03 0.00 -1.73 0.00 0.00 68.15 69.91 1gbt h THR 98 CO 0.09 0.54 -0.07 0.18 -0.25 0.00 0.00 175.52 176.01 1gbt n LEU 99 N -3.08 -0.27 -4.77 3.87 4.77 0.15 -5.03 117.00 112.63 1gbt n LEU 99 Ca -0.12 0.10 -0.38 0.00 -0.03 0.00 0.00 56.01 55.58 1gbt n LEU 99 Cb 0.99 -0.96 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 1gbt n LEU 99 CO 0.45 -0.21 0.74 0.21 -1.33 0.00 0.00 177.39 177.24 1gbt s ASN 100 N -2.91 7.00 -0.92 -1.43 2.47 -1.21 -3.10 114.94 114.85 1gbt s ASN 100 Ca 0.00 2.07 -0.05 0.00 0.42 0.00 0.00 52.86 55.31 1gbt s ASN 100 Cb 0.00 -2.60 0.01 0.00 -1.45 0.00 0.00 41.25 37.21 1gbt s ASN 100 CO 0.00 -0.32 0.60 0.59 -3.72 0.00 0.00 177.10 174.25 1gbt n ASN 101 N 0.41 -4.66 -3.65 -4.21 3.02 -1.26 -1.61 115.26 103.31 1gbt n ASN 101 Ca 0.03 -0.28 -0.41 0.00 -0.03 0.00 0.00 54.58 53.89 1gbt n ASN 101 Cb 0.48 -3.36 -0.01 0.00 -0.61 0.00 0.00 39.78 36.28 1gbt n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1gbt n ASP 102 N -1.20 4.60 -3.89 6.41 2.03 -1.18 -4.21 116.55 119.11 1gbt n ASP 102 Ca -0.03 -2.78 -0.11 0.00 0.52 0.00 0.00 54.79 52.39 1gbt n ASP 102 Cb 0.55 -1.61 -0.13 0.00 -0.72 0.00 0.00 41.12 39.21 1gbt n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1gbt s ILE 103 N 3.13 0.02 -0.01 5.18 2.07 -1.26 -4.08 121.20 126.25 1gbt s ILE 103 Ca 0.51 -0.19 -0.11 0.00 -1.41 0.00 0.00 60.65 59.45 1gbt s ILE 103 Cb 0.15 -0.06 0.01 0.00 0.13 0.00 0.00 42.46 42.69 1gbt s ILE 103 CO -0.07 -0.10 0.24 -0.32 -1.91 0.00 0.00 174.94 172.77 1gbt s MET 104 N -0.30 0.58 -0.08 3.50 -2.45 0.11 -2.53 119.30 118.12 1gbt s MET 104 Ca -0.03 -0.26 0.03 0.00 -1.25 0.00 0.00 55.69 54.18 1gbt s MET 104 Cb -0.02 0.25 -0.02 0.00 1.25 0.00 0.00 34.83 36.29 1gbt s MET 104 CO -0.00 -0.15 -0.17 -0.51 1.05 0.00 0.00 175.02 175.24 1gbt s LEU 105 N -1.29 2.53 -0.17 4.11 1.43 -0.85 -1.59 118.68 122.84 1gbt s LEU 105 Ca -0.14 -0.34 -0.04 0.00 -1.03 0.00 0.00 54.13 52.59 1gbt s LEU 105 Cb -0.06 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.61 1gbt s LEU 105 CO 0.03 0.24 -0.03 -0.63 0.23 0.00 0.00 176.35 176.19 1gbt s ILE 106 N -0.13 3.81 -0.05 -0.59 1.01 -0.04 0.25 121.20 125.46 1gbt s ILE 106 Ca -0.02 -0.38 -0.25 0.00 0.00 0.00 0.00 60.65 60.00 1gbt s ILE 106 Cb -0.14 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 1gbt s ILE 106 CO 0.04 0.47 0.76 -0.75 0.00 0.00 0.00 174.94 175.46 1gbt s LYS 107 N 0.65 4.47 0.32 2.79 2.20 0.30 -1.53 119.74 128.94 1gbt s LYS 107 Ca -0.02 1.00 -0.18 0.00 -0.36 0.00 0.00 55.97 56.41 1gbt s LYS 107 Cb -0.14 -3.45 -0.09 0.00 -1.51 0.00 0.00 37.83 32.64 1gbt s LYS 107 CO 0.02 0.04 0.78 -0.51 -0.36 0.00 0.00 175.35 175.33 1gbt s LEU 108 N 0.83 4.11 0.21 5.43 1.43 -0.41 0.24 118.68 130.51 1gbt s LEU 108 Ca 0.41 1.41 -0.06 0.00 -1.03 0.00 0.00 54.13 54.86 1gbt s LEU 108 Cb -0.18 -4.06 0.17 0.00 0.03 0.00 0.00 46.19 42.15 1gbt s LEU 108 CO 0.20 -0.18 1.68 0.50 0.23 0.00 0.00 176.35 178.79 1gbt h LYS 109 N 2.48 0.95 -5.22 1.70 3.64 -1.58 -3.41 116.57 115.12 1gbt h LYS 109 Ca -0.48 -0.29 -0.41 0.00 -1.27 0.00 0.00 60.65 58.20 1gbt h LYS 109 Cb 1.18 -0.09 -0.14 0.00 -0.41 0.00 0.00 32.23 32.77 1gbt h LYS 109 CO 0.65 0.95 -0.67 -1.12 -2.27 0.00 0.00 179.45 176.98 1gbt s SER 110 N -6.62 2.12 0.49 4.20 0.01 -1.26 -5.01 113.70 107.63 1gbt s SER 110 Ca -0.11 -1.18 -0.22 0.00 1.31 0.00 0.00 55.95 55.76 1gbt s SER 110 Cb 0.14 -0.05 -0.07 0.00 0.21 0.00 0.00 66.02 66.25 1gbt s SER 110 CO 0.84 -0.43 1.13 0.00 0.41 0.00 0.00 173.24 175.20 1gbt s ALA 111 N -3.27 2.88 0.49 1.44 0.00 -1.26 -4.88 121.76 117.16 1gbt s ALA 111 Ca 0.27 0.85 -0.15 0.00 0.00 0.00 0.00 51.96 52.93 1gbt s ALA 111 Cb 0.04 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1gbt s ALA 111 CO 0.09 -0.63 0.93 0.00 0.00 0.00 0.00 175.76 176.15 1gbt s ALA 112 N -1.66 3.14 -0.55 0.00 0.00 0.22 -5.01 121.76 117.90 1gbt s ALA 112 Ca 0.67 0.08 -0.23 0.00 0.00 0.00 0.00 51.96 52.48 1gbt s ALA 112 Cb -0.25 -3.02 0.05 0.00 0.00 0.00 0.00 23.12 19.89 1gbt s ALA 112 CO 0.30 -0.19 0.86 -1.12 0.00 0.00 0.00 175.76 175.62 1gbt s SER 113 N -3.12 6.30 0.30 0.00 0.01 -1.26 -4.90 113.70 111.04 1gbt s SER 113 Ca 0.57 -0.53 -0.28 0.00 1.31 0.00 0.00 55.95 57.02 1gbt s SER 113 Cb -0.10 -2.40 -0.09 0.00 0.21 0.00 0.00 66.02 63.64 1gbt s SER 113 CO 0.32 -1.16 1.01 -0.76 0.41 0.00 0.00 173.24 173.06 1gbt s LEU 114 N 3.63 4.45 0.00 2.44 1.43 -1.26 -4.77 118.68 124.60 1gbt s LEU 114 Ca 0.26 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.39 1gbt s LEU 114 Cb -0.14 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.26 1gbt s LEU 114 CO 0.17 -0.11 0.00 -0.46 0.23 0.00 0.00 176.35 176.18 1gbt n ASN 115 N 0.89 0.00 0.04 2.29 0.23 0.00 -4.97 115.26 113.74 1gbt n ASN 115 Ca 0.00 -0.38 0.12 0.00 -0.53 0.00 0.00 54.58 53.79 1gbt n ASN 115 Cb 0.48 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.65 1gbt n ASN 115 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1gbt n SER 116 N -0.45 0.25 -0.00 0.53 3.41 -1.26 -3.26 113.62 112.84 1gbt n SER 116 Ca 0.00 0.54 0.06 0.00 -0.26 0.00 0.00 58.87 59.21 1gbt n SER 116 Cb 0.00 -0.60 -0.08 0.00 -0.26 0.00 0.00 64.21 63.27 1gbt n SER 116 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1gbt n ARG 117 N -1.75 2.32 -3.63 4.33 5.12 -1.26 -4.85 116.66 116.94 1gbt n ARG 117 Ca 0.05 -0.02 -0.27 0.00 -1.93 0.00 0.00 57.85 55.68 1gbt n ARG 117 Cb 0.29 -1.15 -0.16 0.00 -1.16 0.00 0.00 32.46 30.28 1gbt n ARG 117 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1gbt s VAL 118 N -2.35 0.10 0.05 1.55 1.01 -1.20 -4.43 120.40 115.14 1gbt s VAL 118 Ca 0.04 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 1gbt s VAL 118 Cb 0.10 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 1gbt s VAL 118 CO 0.55 -0.38 0.10 0.00 0.00 0.00 0.00 175.10 175.37 1gbt s ALA 119 N 2.04 -0.01 0.40 5.51 0.00 -0.98 -0.82 121.76 127.91 1gbt s ALA 119 Ca 0.03 -0.69 0.06 0.00 0.00 0.00 0.00 51.96 51.36 1gbt s ALA 119 Cb -0.16 0.32 0.00 0.00 0.00 0.00 0.00 23.12 23.28 1gbt s ALA 119 CO -0.15 -0.38 0.57 -1.54 0.00 0.00 0.00 175.76 174.25 1gbt s SER 120 N -2.48 5.76 -0.01 0.00 1.04 -1.26 -3.42 113.70 113.34 1gbt s SER 120 Ca 0.00 -0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.28 1gbt s SER 120 Cb 0.02 -1.02 -0.03 0.00 0.10 0.00 0.00 66.02 65.09 1gbt s SER 120 CO -0.07 -0.66 -0.12 -0.51 0.98 0.00 0.00 173.24 172.85 1gbt s ILE 121 N -2.35 3.23 0.53 -1.02 1.10 -0.40 -4.87 121.20 117.41 1gbt s ILE 121 Ca 0.50 -0.84 -0.19 0.00 -0.51 0.00 0.00 60.65 59.62 1gbt s ILE 121 Cb -0.10 -2.34 -0.06 0.00 0.15 0.00 0.00 42.46 40.11 1gbt s ILE 121 CO 0.33 0.47 1.08 -0.44 -2.11 0.00 0.00 174.94 174.27 1gbt s SER 122 N -1.13 5.98 0.48 4.50 0.01 -1.26 -4.63 113.70 117.65 1gbt s SER 122 Ca 0.14 2.01 -0.08 0.00 1.31 0.00 0.00 55.95 59.33 1gbt s SER 122 Cb -0.11 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 1gbt s SER 122 CO 0.04 -1.03 0.83 -0.76 0.41 0.00 0.00 173.24 172.72 1gbt s LEU 123 N -3.80 3.63 0.47 2.44 1.43 -1.26 -0.47 118.68 121.12 1gbt s LEU 123 Ca 0.69 1.10 -0.08 0.00 -1.03 0.00 0.00 54.13 54.80 1gbt s LEU 123 Cb -0.19 -4.04 -0.05 0.00 0.03 0.00 0.00 46.19 41.94 1gbt s LEU 123 CO 0.26 -0.57 0.82 -2.16 0.23 0.00 0.00 176.35 174.93 1gbt s PRO 124 N -4.49 3.65 0.00 1.29 0.04 -1.26 -4.72 135.00 129.51 1gbt s PRO 124 Ca 0.50 0.39 0.17 0.00 0.04 0.00 0.00 61.00 62.10 1gbt s PRO 124 Cb -0.10 -2.34 -0.16 0.00 0.04 0.00 0.00 34.50 31.94 1gbt s PRO 124 CO 0.41 -0.19 0.77 0.25 0.04 0.00 0.00 177.00 178.29 1gbt n THR 125 N -1.95 0.00 -3.52 1.26 -2.24 -1.26 -4.95 114.28 101.63 1gbt n THR 125 Ca 0.02 -0.12 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 1gbt n THR 125 Cb 0.55 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.77 1gbt n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1gbt s SER 127 N -2.56 -0.52 0.49 3.42 1.04 -1.26 -5.16 113.70 109.16 1gbt s SER 127 Ca 0.08 0.40 -0.21 0.00 0.48 0.00 0.00 55.95 56.70 1gbt s SER 127 Cb 0.13 0.46 -0.07 0.00 0.10 0.00 0.00 66.02 66.64 1gbt s SER 127 CO 0.67 -0.59 1.12 0.00 0.98 0.00 0.00 173.24 175.42 1gbt s ALA 129 N -1.70 3.32 0.37 0.00 0.00 -1.26 -5.07 121.76 117.41 1gbt s ALA 129 Ca 0.67 0.30 -0.01 0.00 0.00 0.00 0.00 51.96 52.92 1gbt s ALA 129 Cb -0.24 -2.97 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1gbt s ALA 129 CO 0.29 0.26 0.59 -1.54 0.00 0.00 0.00 175.76 175.36 1gbt s SER 130 N -1.69 6.29 0.47 0.00 1.04 -1.26 -5.02 113.70 113.54 1gbt s SER 130 Ca 0.47 0.55 -0.22 0.00 0.48 0.00 0.00 55.95 57.22 1gbt s SER 130 Cb -0.17 -2.08 -0.10 0.00 0.10 0.00 0.00 66.02 63.78 1gbt s SER 130 CO 0.21 -0.35 0.88 0.00 0.98 0.00 0.00 173.24 174.97 1gbt n ALA 132 N -1.85 -0.21 0.00 5.32 0.00 -1.26 -1.33 120.51 121.17 1gbt n ALA 132 Ca -0.04 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1gbt n ALA 132 Cb 0.56 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 18.00 1gbt n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gbt n GLY 133 N 1.36 3.25 3.75 0.00 0.00 0.88 -4.95 105.19 109.48 1gbt n GLY 133 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1gbt n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gbt s THR 134 N -2.23 2.50 0.03 2.61 2.01 -0.44 -4.59 115.64 115.53 1gbt s THR 134 Ca 0.00 0.43 -0.18 0.00 0.31 0.00 0.00 61.69 62.26 1gbt s THR 134 Cb 0.00 -3.28 -0.06 0.00 0.01 0.00 0.00 72.50 69.17 1gbt s THR 134 CO 0.00 0.07 0.50 -1.58 -0.69 0.00 0.00 174.62 172.93 1gbt s GLN 135 N -0.62 4.11 0.26 4.92 2.00 -1.26 0.48 119.66 129.55 1gbt s GLN 135 Ca 0.59 0.59 0.01 0.00 -2.00 0.00 0.00 55.36 54.56 1gbt s GLN 135 Cb -0.43 -3.25 -0.04 0.00 0.80 0.00 0.00 33.01 30.09 1gbt s GLN 135 CO 0.46 0.61 0.14 0.00 -0.50 0.00 0.00 175.29 176.01 1gbt s LEU 137 N -3.28 1.91 -0.18 0.00 2.96 0.23 -0.20 118.68 120.13 1gbt s LEU 137 Ca 0.38 -0.56 -0.08 0.00 -0.22 0.00 0.00 54.13 53.64 1gbt s LEU 137 Cb 0.06 -1.32 -0.04 0.00 0.50 0.00 0.00 46.19 45.38 1gbt s LEU 137 CO 0.15 -0.02 0.10 -0.63 -1.32 0.00 0.00 176.35 174.64 1gbt s ILE 138 N 1.34 5.17 0.06 6.68 1.01 -0.86 0.35 121.20 134.95 1gbt s ILE 138 Ca 0.04 0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.80 1gbt s ILE 138 Cb -0.13 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 38.98 1gbt s ILE 138 CO -0.11 0.48 -0.06 -0.94 0.00 0.00 0.00 174.94 174.31 1gbt s SER 139 N 0.07 0.82 0.00 3.58 1.04 -1.25 -1.13 113.70 116.84 1gbt s SER 139 Ca 0.08 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.79 1gbt s SER 139 Cb -0.12 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1gbt s SER 139 CO -0.00 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.49 1gbt n GLY 140 N 0.90 0.79 1.04 7.32 0.00 -0.67 -4.57 105.19 110.01 1gbt n GLY 140 Ca -0.19 -0.87 0.05 0.00 0.00 0.00 0.00 46.02 45.01 1gbt n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1gbt n TRP 141 N -0.24 1.10 -1.04 1.61 8.01 -1.26 -2.53 117.44 123.08 1gbt n TRP 141 Ca 0.00 -1.06 -0.30 0.00 -1.31 0.00 0.00 57.50 54.83 1gbt n TRP 141 Cb 0.00 -0.39 0.25 0.00 -2.01 0.00 0.00 31.31 29.16 1gbt n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1gbt n GLY 142 N -0.63 -2.78 3.71 6.99 0.00 -1.25 -4.29 105.19 106.94 1gbt n GLY 142 Ca 0.26 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 1gbt n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1gbt n ASN 143 N -4.87 2.80 -0.44 1.61 2.85 0.26 -3.15 115.26 114.32 1gbt n ASN 143 Ca 0.15 1.18 0.10 0.00 -0.11 0.00 0.00 54.58 55.90 1gbt n ASN 143 Cb 0.59 -1.50 -0.01 0.00 1.24 0.00 0.00 39.78 40.10 1gbt n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1gbt n THR 144 N 0.19 0.00 -4.68 -0.44 -2.24 -0.72 -1.34 114.28 105.06 1gbt n THR 144 Ca 0.05 -0.27 -0.33 0.00 -2.27 0.00 0.00 64.05 61.22 1gbt n THR 144 Cb 0.37 1.23 -0.14 0.00 -2.10 0.00 0.00 70.33 69.69 1gbt n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1gbt s LYS 145 N -2.32 3.42 0.12 -0.78 3.01 -1.26 -4.36 119.74 117.57 1gbt s LYS 145 Ca 0.16 -0.66 -0.09 0.00 -1.01 0.00 0.00 55.97 54.38 1gbt s LYS 145 Cb 0.16 -2.69 -0.12 0.00 -1.01 0.00 0.00 37.83 34.18 1gbt s LYS 145 CO 0.53 0.19 1.30 1.03 0.51 0.00 0.00 175.35 178.91 1gbt h SER 146 N 6.79 0.75 -3.78 2.83 0.87 -1.92 -3.38 113.55 115.70 1gbt h SER 146 Ca -0.27 -0.55 -0.62 0.00 -1.23 0.00 0.00 61.79 59.12 1gbt h SER 146 Cb 1.21 -0.23 -0.40 0.00 -0.44 0.00 0.00 62.40 62.54 1gbt h SER 146 CO 0.57 1.34 -0.69 -0.55 -0.53 0.00 0.00 176.83 176.96 1gbt s SER 147 N -7.13 3.93 0.00 6.23 0.15 -1.26 -4.62 113.70 111.00 1gbt s SER 147 Ca -0.08 -2.88 0.00 0.00 0.70 0.00 0.00 55.95 53.69 1gbt s SER 147 Cb 0.09 -1.29 0.00 0.00 -1.71 0.00 0.00 66.02 63.10 1gbt s SER 147 CO 0.89 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.70 1gbt n GLY 148 N 3.24 0.93 2.86 9.45 0.00 -1.26 -5.07 105.19 115.35 1gbt n GLY 148 Ca 0.09 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.87 1gbt n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gbt s THR 149 N -1.87 1.23 -0.28 2.61 2.01 -1.26 -4.71 115.64 113.38 1gbt s THR 149 Ca 0.00 -1.18 -0.01 0.00 0.31 0.00 0.00 61.69 60.80 1gbt s THR 149 Cb 0.00 -1.66 0.13 0.00 0.01 0.00 0.00 72.50 70.98 1gbt s THR 149 CO 0.00 -0.27 0.27 -0.55 -0.69 0.00 0.00 174.62 173.39 1gbt s SER 150 N 1.51 1.73 0.04 3.53 0.15 -1.26 -5.00 113.70 114.40 1gbt s SER 150 Ca -0.01 -0.68 -0.21 0.00 0.70 0.00 0.00 55.95 55.75 1gbt s SER 150 Cb -0.18 0.45 -0.06 0.00 -1.71 0.00 0.00 66.02 64.51 1gbt s SER 150 CO -0.10 -0.38 0.63 -0.31 1.20 0.00 0.00 173.24 174.28 1gbt s TYR 151 N 2.34 3.75 0.57 3.44 2.02 -1.26 -1.75 117.35 126.47 1gbt s TYR 151 Ca 0.09 1.30 -0.06 0.00 -0.37 0.00 0.00 57.07 58.03 1gbt s TYR 151 Cb -0.14 -2.62 -0.00 0.00 -0.40 0.00 0.00 41.96 38.79 1gbt s TYR 151 CO -0.30 0.44 0.89 -1.25 -1.57 0.00 0.00 175.55 173.76 1gbt s PRO 152 N -0.57 3.10 -0.16 -1.71 0.04 -1.26 -5.01 135.00 129.43 1gbt s PRO 152 Ca 0.32 0.11 -0.15 0.00 0.04 0.00 0.00 61.00 61.32 1gbt s PRO 152 Cb -0.19 -2.27 -0.23 0.00 0.04 0.00 0.00 34.50 31.84 1gbt s PRO 152 CO 0.19 -0.59 0.34 -0.44 0.04 0.00 0.00 177.00 176.54 1gbt h ASP 153 N -0.12 0.23 -2.81 6.66 3.32 -1.94 -3.48 116.42 118.29 1gbt h ASP 153 Ca -0.46 -0.74 -0.47 0.00 0.02 0.00 0.00 57.03 55.38 1gbt h ASP 153 Cb 1.24 -0.07 0.02 0.00 0.22 0.00 0.00 39.33 40.73 1gbt h ASP 153 CO 0.61 1.65 -0.14 0.68 -1.72 0.00 0.00 179.24 180.32 1gbt s VAL 154 N -2.46 4.69 0.19 -1.35 -7.23 -1.26 -1.37 120.40 111.61 1gbt s VAL 154 Ca -0.25 -0.44 -0.30 0.00 -1.81 0.00 0.00 61.98 59.18 1gbt s VAL 154 Cb 0.06 -3.72 -0.08 0.00 0.56 0.00 0.00 36.38 33.20 1gbt s VAL 154 CO 0.69 -0.49 1.23 -0.22 -0.31 0.00 0.00 175.10 175.99 1gbt s LEU 155 N -4.42 4.44 0.18 1.32 2.96 -1.23 -4.85 118.68 117.08 1gbt s LEU 155 Ca 0.43 2.28 0.06 0.00 -0.22 0.00 0.00 54.13 56.68 1gbt s LEU 155 Cb -0.10 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1gbt s LEU 155 CO 0.37 -0.41 0.12 -0.54 -1.32 0.00 0.00 176.35 174.57 1gbt s LYS 156 N -0.21 2.82 0.06 1.98 -0.14 -1.05 -1.26 119.74 121.93 1gbt s LYS 156 Ca 0.54 -0.94 0.02 0.00 -1.36 0.00 0.00 55.97 54.22 1gbt s LYS 156 Cb -0.34 -2.58 -0.03 0.00 -1.68 0.00 0.00 37.83 33.20 1gbt s LYS 156 CO 0.37 0.47 -0.07 0.00 -0.76 0.00 0.00 175.35 175.36 1gbt s LEU 158 N -2.15 -0.86 0.09 0.00 2.96 -0.28 -1.63 118.68 116.80 1gbt s LEU 158 Ca -0.02 1.37 -0.23 0.00 -0.22 0.00 0.00 54.13 55.03 1gbt s LEU 158 Cb -0.04 2.05 -0.07 0.00 0.50 0.00 0.00 46.19 48.63 1gbt s LEU 158 CO -0.02 -0.23 0.71 -0.54 -1.32 0.00 0.00 176.35 174.95 1gbt s LYS 159 N 2.26 4.44 -0.26 1.98 1.02 -1.26 -2.03 119.74 125.88 1gbt s LYS 159 Ca -0.07 0.99 -0.24 0.00 0.02 0.00 0.00 55.97 56.67 1gbt s LYS 159 Cb -0.09 -3.29 0.07 0.00 -0.52 0.00 0.00 37.83 33.99 1gbt s LYS 159 CO -0.17 0.49 0.70 0.00 -0.92 0.00 0.00 175.35 175.44 1gbt s ALA 160 N -0.74 -1.74 0.29 5.17 0.00 0.73 -4.94 121.76 120.53 1gbt s ALA 160 Ca 0.34 2.00 -0.09 0.00 0.00 0.00 0.00 51.96 54.21 1gbt s ALA 160 Cb -0.21 -1.16 -0.07 0.00 0.00 0.00 0.00 23.12 21.68 1gbt s ALA 160 CO 0.23 -0.33 0.61 -1.25 0.00 0.00 0.00 175.76 175.02 1gbt s PRO 161 N 0.46 3.78 0.10 0.00 0.04 -1.26 -1.11 135.00 137.01 1gbt s PRO 161 Ca -0.01 0.29 -0.30 0.00 0.04 0.00 0.00 61.00 61.02 1gbt s PRO 161 Cb -0.05 -2.57 -0.06 0.00 0.04 0.00 0.00 34.50 31.86 1gbt s PRO 161 CO -0.01 0.21 1.13 0.42 0.04 0.00 0.00 177.00 178.79 1gbt s ILE 162 N -2.00 4.09 0.50 0.56 1.01 0.18 -1.12 121.20 124.42 1gbt s ILE 162 Ca 0.48 1.61 -0.03 0.00 0.00 0.00 0.00 60.65 62.71 1gbt s ILE 162 Cb -0.11 -4.03 -0.00 0.00 0.01 0.00 0.00 42.46 38.33 1gbt s ILE 162 CO 0.25 0.19 0.77 -0.76 0.00 0.00 0.00 174.94 175.38 1gbt s LEU 163 N 0.49 3.51 0.69 2.97 1.43 -0.30 -0.08 118.68 127.38 1gbt s LEU 163 Ca 0.54 0.54 -0.14 0.00 -1.03 0.00 0.00 54.13 54.04 1gbt s LEU 163 Cb -0.28 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 42.54 1gbt s LEU 163 CO 0.31 -0.80 1.12 -0.94 0.23 0.00 0.00 176.35 176.27 1gbt s SER 164 N -4.23 4.86 0.38 2.29 1.04 -1.26 -4.65 113.70 112.13 1gbt s SER 164 Ca 0.50 2.03 0.17 0.00 0.48 0.00 0.00 55.95 59.12 1gbt s SER 164 Cb -0.10 -2.55 0.74 0.00 0.10 0.00 0.00 66.02 64.21 1gbt s SER 164 CO 0.41 -1.80 1.79 -0.78 0.98 0.00 0.00 173.24 173.84 1gbt h ASP 165 N -0.20 0.00 0.11 7.02 1.82 -1.97 0.18 116.42 123.38 1gbt h ASP 165 Ca -0.46 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.18 1gbt h ASP 165 Cb 1.25 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.25 1gbt h ASP 165 CO 0.53 0.38 -0.13 0.77 -1.61 0.00 0.00 179.24 179.18 1gbt h SER 166 N 0.00 -0.36 0.35 2.28 4.64 -1.99 -0.60 113.55 117.87 1gbt h SER 166 Ca -0.00 0.04 -0.13 0.00 -0.47 0.00 0.00 61.79 61.22 1gbt h SER 166 Cb 0.78 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 1gbt h SER 166 CO 0.05 -0.20 -0.54 0.28 -0.87 0.00 0.00 176.83 175.55 1gbt h SER 167 N -0.28 0.23 -0.50 4.97 0.02 -1.82 -0.54 113.55 115.63 1gbt h SER 167 Ca 0.01 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.79 1gbt h SER 167 Cb 0.28 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1gbt h SER 167 CO -0.05 0.73 0.10 0.00 -1.14 0.00 0.00 176.83 176.47 1gbt h LYS 169 N 0.70 0.38 0.00 0.00 6.56 -1.05 -2.08 116.57 121.09 1gbt h LYS 169 Ca 0.16 -0.29 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 1gbt h LYS 169 Cb 0.37 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 1gbt h LYS 169 CO 0.01 0.92 0.00 -1.13 -2.06 0.00 0.00 179.45 177.19 1gbt n SER 170 N -3.86 0.38 0.06 0.86 3.41 -0.22 -2.50 113.62 111.77 1gbt n SER 170 Ca -0.04 0.57 0.01 0.00 -0.26 0.00 0.00 58.87 59.15 1gbt n SER 170 Cb 0.68 -0.66 -0.05 0.00 -0.26 0.00 0.00 64.21 63.91 1gbt n SER 170 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gbt h ALA 171 N 2.54 0.65 -2.02 7.33 0.00 -0.91 -3.39 119.26 123.45 1gbt h ALA 171 Ca 0.00 -0.72 -0.54 0.00 0.00 0.00 0.00 54.91 53.65 1gbt h ALA 171 Cb 0.44 0.18 -0.40 0.00 0.00 0.00 0.00 17.79 18.02 1gbt h ALA 171 CO 0.00 0.81 -1.08 0.66 0.00 0.00 0.00 179.25 179.64 1gbt n TYR 172 N -2.96 0.25 -1.72 0.00 4.01 -0.83 -4.92 117.16 110.99 1gbt n TYR 172 Ca -0.06 -3.70 -0.43 0.00 -0.16 0.00 0.00 57.90 53.55 1gbt n TYR 172 Cb 0.80 -0.39 -0.02 0.00 -0.31 0.00 0.00 39.34 39.42 1gbt n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1gbt n PRO 173 N 0.98 2.49 -0.48 -0.72 -0.02 -1.04 -1.59 135.00 134.62 1gbt n PRO 173 Ca 0.23 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 1gbt n PRO 173 Cb 0.55 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1gbt n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gbt n GLY 174 N 2.51 1.12 0.41 -1.23 0.00 -1.26 -4.87 105.19 101.87 1gbt n GLY 174 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.19 1gbt n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1gbt n GLN 175 N -2.00 1.36 -3.59 1.61 6.02 -0.62 -4.97 117.38 115.19 1gbt n GLN 175 Ca 0.00 -1.00 -0.38 0.00 -0.01 0.00 0.00 57.00 55.61 1gbt n GLN 175 Cb 0.00 -1.21 -0.10 0.00 1.02 0.00 0.00 30.24 29.95 1gbt n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1gbt s ILE 176 N -1.33 5.31 0.53 5.09 -1.09 -1.24 -5.03 121.20 123.43 1gbt s ILE 176 Ca 0.13 0.21 0.03 0.00 -2.23 0.00 0.00 60.65 58.80 1gbt s ILE 176 Cb 0.11 -3.54 0.03 0.00 -1.58 0.00 0.00 42.46 37.48 1gbt s ILE 176 CO 0.24 0.27 0.73 0.42 -1.23 0.00 0.00 174.94 175.37 1gbt s THR 177 N 1.56 2.71 -2.00 2.92 -4.23 -1.26 -4.98 115.64 110.36 1gbt s THR 177 Ca 0.08 -0.75 0.14 0.00 -1.18 0.00 0.00 61.69 59.98 1gbt s THR 177 Cb -0.15 -2.95 0.40 0.00 1.34 0.00 0.00 72.50 71.14 1gbt s THR 177 CO 0.09 0.00 1.27 -1.54 -0.54 0.00 0.00 174.62 173.90 1gbt n SER 178 N -2.24 0.00 -1.69 3.99 3.41 -1.26 -2.21 113.62 113.62 1gbt n SER 178 Ca 0.09 -0.64 -0.00 0.00 -0.26 0.00 0.00 58.87 58.05 1gbt n SER 178 Cb 0.60 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.85 1gbt n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1gbt n ASN 179 N -0.91 4.63 -4.05 4.04 3.02 -1.26 -4.93 115.26 115.79 1gbt n ASN 179 Ca 0.11 -3.18 -0.07 0.00 -0.03 0.00 0.00 54.58 51.40 1gbt n ASN 179 Cb 0.05 -0.69 -0.10 0.00 -0.61 0.00 0.00 39.78 38.44 1gbt n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1gbt s MET 180 N -2.95 0.62 0.08 3.52 -1.94 -0.94 -0.01 119.30 117.69 1gbt s MET 180 Ca 0.52 -1.14 -0.12 0.00 -1.71 0.00 0.00 55.69 53.24 1gbt s MET 180 Cb 0.41 0.22 0.01 0.00 2.01 0.00 0.00 34.83 37.49 1gbt s MET 180 CO 0.12 -0.13 0.27 -0.59 -0.01 0.00 0.00 175.02 174.68 1gbt s PHE 181 N -3.75 -0.00 0.05 -0.03 -0.12 -0.77 -4.78 117.98 108.58 1gbt s PHE 181 Ca 0.05 -0.31 0.04 0.00 -0.05 0.00 0.00 56.93 56.66 1gbt s PHE 181 Cb 0.06 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.47 1gbt s PHE 181 CO -0.10 -0.56 -0.04 0.00 -0.05 0.00 0.00 175.22 174.47 1gbt s ALA 183 N -1.17 -0.44 0.00 0.00 0.00 -0.99 -1.15 121.76 118.02 1gbt s ALA 183 Ca 0.21 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1gbt s ALA 183 Cb -0.11 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.96 1gbt s ALA 183 CO 0.13 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1gbt n GLY 184 N 1.95 0.55 2.91 0.00 0.00 -0.27 -3.48 105.19 106.84 1gbt n GLY 184 Ca -0.19 -1.47 -0.22 0.00 0.00 0.00 0.00 46.02 44.13 1gbt n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gbt s TYR 184 N -3.64 0.97 -0.11 1.61 1.51 -1.26 -4.41 117.35 112.02 1gbt s TYR 184 Ca 0.00 -0.33 0.30 0.00 -1.01 0.00 0.00 57.07 56.02 1gbt s TYR 184 Cb 0.00 -0.83 1.00 0.00 -0.11 0.00 0.00 41.96 42.01 1gbt s TYR 184 CO 0.00 -0.26 1.85 -0.07 -1.11 0.00 0.00 175.55 175.95 1gbt h LEU 185 N 7.40 0.00 -1.39 -1.29 3.38 -1.95 -2.74 115.31 118.73 1gbt h LEU 185 Ca -0.33 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 1gbt h LEU 185 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1gbt h LEU 185 CO 0.44 0.00 -0.28 -0.33 0.09 0.00 0.00 178.44 178.35 1gbt h GLU 186 N 0.00 0.00 0.00 1.13 3.07 -1.95 0.97 114.58 117.81 1gbt h GLU 186 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1gbt h GLU 186 Cb 0.68 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 1gbt h GLU 186 CO 0.00 0.28 0.00 0.41 -1.40 0.00 0.00 179.01 178.30 1gbt n GLY 187 N -0.36 -2.52 3.04 -3.84 0.00 -1.03 -4.51 105.19 95.97 1gbt n GLY 187 Ca -0.01 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1gbt n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gbt n GLY 188 N -0.22 1.66 2.95 -0.02 0.00 0.14 -4.93 105.19 104.77 1gbt n GLY 188 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1gbt n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gbt s LYS 188 N -0.02 0.24 0.12 1.61 1.02 -1.25 -3.93 119.74 117.54 1gbt s LYS 188 Ca 0.00 0.59 -0.25 0.00 0.02 0.00 0.00 55.97 56.33 1gbt s LYS 188 Cb 0.00 -0.41 0.08 0.00 -0.52 0.00 0.00 37.83 36.99 1gbt s LYS 188 CO 0.00 -0.48 1.09 0.34 -0.92 0.00 0.00 175.35 175.38 1gbt s ASP 189 N 2.46 -0.05 0.78 2.83 -1.08 -0.59 -4.30 116.67 116.72 1gbt s ASP 189 Ca 0.06 -0.47 -0.12 0.00 -0.52 0.00 0.00 52.55 51.50 1gbt s ASP 189 Cb -0.14 0.40 0.06 0.00 -1.46 0.00 0.00 42.92 41.79 1gbt s ASP 189 CO -0.12 -0.78 1.15 -0.94 0.52 0.00 0.00 175.17 175.01 1gbt s SER 190 N -3.28 4.72 0.07 -0.34 1.04 -1.26 0.32 113.70 114.96 1gbt s SER 190 Ca 0.19 0.84 -0.02 0.00 0.48 0.00 0.00 55.95 57.44 1gbt s SER 190 Cb -0.01 -1.41 0.01 0.00 0.10 0.00 0.00 66.02 64.72 1gbt s SER 190 CO 0.02 -1.77 0.13 0.00 0.98 0.00 0.00 173.24 172.60 1gbt n GLN 192 N -0.09 2.07 0.00 0.00 1.13 -1.26 -1.45 117.38 117.78 1gbt n GLN 192 Ca -0.01 0.75 0.00 0.00 -1.94 0.00 0.00 57.00 55.80 1gbt n GLN 192 Cb 0.10 -2.53 0.00 0.00 0.11 0.00 0.00 30.24 27.92 1gbt n GLN 192 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gbt n GLY 193 N 3.58 0.27 0.03 1.08 0.00 -1.26 -0.58 105.19 108.31 1gbt n GLY 193 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 1gbt n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gbt n ASP 194 N 0.00 0.57 -4.76 1.61 8.00 -0.53 -3.79 116.55 117.66 1gbt n ASP 194 Ca 0.00 -0.23 -0.41 0.00 0.71 0.00 0.00 54.79 54.85 1gbt n ASP 194 Cb 0.00 0.98 -0.01 0.00 -0.02 0.00 0.00 41.12 42.07 1gbt n ASP 194 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1gbt s SER 195 N -4.00 6.52 0.00 -2.24 0.01 -1.26 -1.52 113.70 111.22 1gbt s SER 195 Ca 0.02 2.85 0.00 0.00 1.31 0.00 0.00 55.95 60.14 1gbt s SER 195 Cb 0.14 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.73 1gbt s SER 195 CO 0.82 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1gbt n GLY 196 N 1.36 3.10 3.94 3.44 0.00 -0.78 -0.39 105.19 115.86 1gbt n GLY 196 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1gbt n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gbt s GLY 197 N -2.93 1.76 0.32 -0.02 0.00 -0.58 -3.56 107.32 102.30 1gbt s GLY 197 Ca 0.00 -1.25 -0.11 0.00 0.00 0.00 0.00 44.72 43.36 1gbt s GLY 197 CO 0.00 -0.57 0.67 2.56 0.00 0.00 0.00 173.10 175.76 1gbt s PRO 198 N -5.66 3.83 -0.32 2.90 0.04 -1.26 -0.15 135.00 134.37 1gbt s PRO 198 Ca 0.70 0.41 0.03 0.00 0.04 0.00 0.00 61.00 62.19 1gbt s PRO 198 Cb -0.05 -2.50 0.09 0.00 0.04 0.00 0.00 34.50 32.07 1gbt s PRO 198 CO 0.50 0.14 0.01 0.08 0.04 0.00 0.00 177.00 177.78 1gbt s VAL 199 N -2.08 2.15 -0.18 -0.36 1.01 -0.24 -3.78 120.40 116.92 1gbt s VAL 199 Ca 0.50 -2.09 -0.08 0.00 0.00 0.00 0.00 61.98 60.31 1gbt s VAL 199 Cb -0.11 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1gbt s VAL 199 CO 0.24 -0.45 0.10 -0.69 0.00 0.00 0.00 175.10 174.30 1gbt s VAL 200 N 1.00 5.11 -0.14 2.92 1.01 0.16 -1.66 120.40 128.79 1gbt s VAL 200 Ca 0.06 0.08 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 1gbt s VAL 200 Cb -0.19 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 32.91 1gbt s VAL 200 CO -0.08 0.47 -0.09 0.00 0.00 0.00 0.00 175.10 175.40 1gbt n SER 202 N 4.87 -4.48 0.00 0.00 3.41 -1.26 -0.60 113.62 115.56 1gbt n SER 202 Ca -0.13 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.26 1gbt n SER 202 Cb 0.49 -2.06 0.00 0.00 -0.26 0.00 0.00 64.21 62.38 1gbt n SER 202 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gbt n GLY 203 N -1.98 0.44 3.34 5.00 0.00 -1.26 -4.99 105.19 105.74 1gbt n GLY 203 Ca -0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 1gbt n GLY 203 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gbt s LYS 204 N -0.56 1.32 -0.69 1.61 0.00 0.24 -4.10 119.74 117.56 1gbt s LYS 204 Ca 0.00 -1.61 -0.27 0.00 0.00 0.00 0.00 55.97 54.09 1gbt s LYS 204 Cb 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 37.83 36.87 1gbt s LYS 204 CO 0.00 0.11 1.25 -1.17 0.00 0.00 0.00 175.35 175.54 1gbt s LEU 209 N -3.31 3.27 -0.05 2.77 2.96 0.38 -0.46 118.68 124.23 1gbt s LEU 209 Ca 0.23 -0.28 0.21 0.00 -0.22 0.00 0.00 54.13 54.07 1gbt s LEU 209 Cb 0.01 -2.75 -0.30 0.00 0.50 0.00 0.00 46.19 43.65 1gbt s LEU 209 CO 0.07 -1.72 0.43 0.00 -1.32 0.00 0.00 176.35 173.80 1gbt n GLN 210 N 9.06 0.66 -4.01 1.98 1.13 -0.67 -4.13 117.38 121.41 1gbt n GLN 210 Ca 0.05 -0.14 -0.09 0.00 -1.94 0.00 0.00 57.00 54.88 1gbt n GLN 210 Cb 0.49 -1.54 -0.08 0.00 0.11 0.00 0.00 30.24 29.22 1gbt n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1gbt s GLY 211 N -4.72 0.50 -0.09 1.08 0.00 -0.99 -2.29 107.32 100.81 1gbt s GLY 211 Ca -0.08 -1.03 0.03 0.00 0.00 0.00 0.00 44.72 43.64 1gbt s GLY 211 CO 0.89 -1.07 -0.19 -0.42 0.00 0.00 0.00 173.10 172.31 1gbt s ILE 212 N -3.95 1.69 -0.16 0.90 1.01 -1.04 -1.07 121.20 118.58 1gbt s ILE 212 Ca 0.13 -0.80 -0.32 0.00 0.00 0.00 0.00 60.65 59.67 1gbt s ILE 212 Cb 0.06 -1.49 -0.09 0.00 0.01 0.00 0.00 42.46 40.95 1gbt s ILE 212 CO -0.05 0.48 2.08 0.52 0.00 0.00 0.00 174.94 177.97 1gbt n VAL 213 N 3.66 0.46 0.01 2.92 0.31 0.78 -1.66 118.33 124.81 1gbt n VAL 213 Ca -0.20 -0.27 -0.01 0.00 -0.01 0.00 0.00 64.34 63.85 1gbt n VAL 213 Cb 0.52 -2.15 -0.00 0.00 -0.91 0.00 0.00 33.84 31.30 1gbt n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1gbt n SER 214 N 9.21 0.56 -3.05 4.52 2.88 -0.88 -1.86 113.62 125.01 1gbt n SER 214 Ca 0.28 0.08 -0.13 0.00 -1.33 0.00 0.00 58.87 57.78 1gbt n SER 214 Cb 0.36 -0.26 -0.01 0.00 -0.75 0.00 0.00 64.21 63.54 1gbt n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1gbt s TRP 215 N -1.52 0.74 -0.02 0.66 1.48 -0.12 -4.92 118.94 115.24 1gbt s TRP 215 Ca -0.03 -1.14 -0.29 0.00 -1.06 0.00 0.00 56.10 53.58 1gbt s TRP 215 Cb 0.00 0.27 0.10 0.00 -1.16 0.00 0.00 33.47 32.68 1gbt s TRP 215 CO 0.05 -1.33 1.30 0.20 -4.06 0.00 0.00 176.95 173.11 1gbt s GLY 216 N -3.19 -0.18 -0.30 3.67 0.00 -1.26 0.17 107.32 106.23 1gbt s GLY 216 Ca 0.25 0.16 -0.13 0.00 0.00 0.00 0.00 44.72 45.00 1gbt s GLY 216 CO 0.18 4.74 0.29 -0.45 0.00 0.00 0.00 173.10 177.86 1gbt s SER 217 N -3.67 6.12 0.74 1.64 0.15 -1.26 -4.92 113.70 112.50 1gbt s SER 217 Ca 0.27 -0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1gbt s SER 217 Cb 0.01 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 62.15 1gbt s SER 217 CO -0.01 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1gbt n GLY 219 N 4.95 0.47 2.84 9.45 0.00 -1.26 -4.64 105.19 117.00 1gbt n GLY 219 Ca -0.11 -0.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.90 1gbt n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gbt n ALA 221 N 3.71 -0.03 -1.77 0.00 0.00 -1.26 -4.70 120.51 116.45 1gbt n ALA 221 Ca -0.21 0.03 -0.37 0.00 0.00 0.00 0.00 53.44 52.88 1gbt n ALA 221 Cb 0.54 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 1gbt n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1gbt s GLN 221 N -1.61 3.98 0.49 0.00 -1.52 -1.26 0.24 119.66 119.98 1gbt s GLN 221 Ca 0.00 1.73 -0.19 0.00 -1.95 0.00 0.00 55.36 54.95 1gbt s GLN 221 Cb 0.00 -2.55 -0.08 0.00 -0.22 0.00 0.00 33.01 30.16 1gbt s GLN 221 CO 0.00 -0.35 1.01 -1.59 -0.25 0.00 0.00 175.29 174.10 1gbt s LYS 222 N -2.49 3.87 0.00 2.91 -2.85 -1.26 -2.85 119.74 117.07 1gbt s LYS 222 Ca 0.59 1.20 0.00 0.00 -1.00 0.00 0.00 55.97 56.77 1gbt s LYS 222 Cb -0.28 -2.12 0.00 0.00 -2.06 0.00 0.00 37.83 33.38 1gbt s LYS 222 CO 0.34 -0.35 0.00 0.09 0.10 0.00 0.00 175.35 175.53 1gbt n ASN 223 N -1.14 -2.50 -3.67 0.03 4.13 0.34 -4.92 115.26 107.52 1gbt n ASN 223 Ca 0.08 0.00 -0.28 0.00 1.68 0.00 0.00 54.58 56.06 1gbt n ASN 223 Cb 0.53 -2.21 -0.11 0.00 -1.54 0.00 0.00 39.78 36.45 1gbt n ASN 223 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1gbt s LYS 224 N -1.06 1.65 0.99 3.52 -0.14 -1.13 -4.75 119.74 118.81 1gbt s LYS 224 Ca 0.00 -2.62 -0.14 0.00 -1.36 0.00 0.00 55.97 51.84 1gbt s LYS 224 Cb 0.00 -2.46 0.18 0.00 -1.68 0.00 0.00 37.83 33.87 1gbt s LYS 224 CO 0.00 -1.30 1.15 -1.25 -0.76 0.00 0.00 175.35 173.19 1gbt s PRO 225 N -0.54 0.48 0.47 -1.68 0.04 -1.26 -4.50 135.00 128.02 1gbt s PRO 225 Ca 0.26 0.15 -0.20 0.00 0.04 0.00 0.00 61.00 61.25 1gbt s PRO 225 Cb -0.05 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 1gbt s PRO 225 CO -0.15 -2.62 0.99 0.20 0.04 0.00 0.00 177.00 175.47 1gbt s GLY 226 N -4.05 2.35 -0.05 0.56 0.00 -1.23 -4.40 107.32 100.51 1gbt s GLY 226 Ca 0.67 0.42 0.06 0.00 0.00 0.00 0.00 44.72 45.87 1gbt s GLY 226 CO 0.54 0.72 -0.23 0.14 0.00 0.00 0.00 173.10 174.27 1gbt s VAL 227 N -2.22 2.28 -0.02 1.40 1.01 0.13 -2.34 120.40 120.63 1gbt s VAL 227 Ca 0.63 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1gbt s VAL 227 Cb -0.12 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.43 1gbt s VAL 227 CO 0.20 0.57 -0.10 -0.31 0.00 0.00 0.00 175.10 175.47 1gbt s TYR 228 N -0.37 0.97 0.09 5.22 2.02 0.17 -0.94 117.35 124.51 1gbt s TYR 228 Ca 0.03 -0.22 -0.31 0.00 -0.37 0.00 0.00 57.07 56.20 1gbt s TYR 228 Cb -0.12 -0.67 -0.09 0.00 -0.40 0.00 0.00 41.96 40.68 1gbt s TYR 228 CO 0.02 -0.07 1.74 0.99 -1.57 0.00 0.00 175.55 176.66 1gbt s THR 229 N 0.02 2.80 -1.20 -0.71 2.01 -0.66 -1.85 115.64 116.04 1gbt s THR 229 Ca -0.00 0.28 -0.20 0.00 0.31 0.00 0.00 61.69 62.07 1gbt s THR 229 Cb -0.07 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 1gbt s THR 229 CO 0.00 -0.00 1.89 1.17 -0.69 0.00 0.00 174.62 176.99 1gbt n LYS 230 N 5.66 2.31 -0.32 4.92 4.81 0.98 -2.49 118.16 134.04 1gbt n LYS 230 Ca 0.17 -2.71 0.09 0.00 -0.87 0.00 0.00 58.31 54.99 1gbt n LYS 230 Cb 0.39 -3.50 0.19 0.00 0.02 0.00 0.00 35.03 32.14 1gbt n LYS 230 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1gbt n VAL 231 N 6.77 -0.38 0.17 3.15 0.31 -0.97 -1.93 118.33 125.46 1gbt n VAL 231 Ca 0.48 2.05 0.18 0.00 -0.01 0.00 0.00 64.34 67.04 1gbt n VAL 231 Cb 0.45 -2.90 0.80 0.00 -0.91 0.00 0.00 33.84 31.28 1gbt n VAL 231 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gbt n ASN 233 N -3.68 0.16 -0.75 0.00 3.02 -0.81 -3.90 115.26 109.30 1gbt n ASN 233 Ca 0.04 0.30 0.10 0.00 -0.03 0.00 0.00 54.58 54.98 1gbt n ASN 233 Cb 0.44 -0.30 0.07 0.00 -0.61 0.00 0.00 39.78 39.39 1gbt n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1gbt n TYR 234 N -1.53 0.00 -0.21 3.10 4.01 0.32 -4.82 117.16 118.03 1gbt n TYR 234 Ca 0.07 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.82 1gbt n TYR 234 Cb 0.34 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 39.49 1gbt n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1gbt h VAL 235 N 3.70 0.70 -0.51 -0.72 2.07 -1.66 -1.69 116.25 118.14 1gbt h VAL 235 Ca 0.00 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.34 1gbt h VAL 235 Cb 0.80 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1gbt h VAL 235 CO 0.00 0.06 0.08 0.28 0.02 0.00 0.00 177.57 178.02 1gbt h SER 236 N 0.35 0.81 -0.61 0.57 0.02 -1.89 -1.78 113.55 111.02 1gbt h SER 236 Ca 0.33 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1gbt h SER 236 Cb 0.46 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 1gbt h SER 236 CO -0.36 0.86 0.39 -0.25 -1.14 0.00 0.00 176.83 176.33 1gbt h TRP 237 N 0.72 0.78 -0.10 3.45 7.01 -1.70 -1.02 115.95 125.10 1gbt h TRP 237 Ca 0.15 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 1gbt h TRP 237 Cb 0.40 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 27.19 1gbt h TRP 237 CO 0.03 0.51 0.05 0.82 -2.79 0.00 0.00 178.44 177.06 1gbt h ILE 238 N 0.83 1.08 -0.67 2.65 2.04 -1.18 0.87 117.51 123.12 1gbt h ILE 238 Ca 0.22 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1gbt h ILE 238 Cb -0.06 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1gbt h ILE 238 CO -0.05 0.07 0.26 0.11 0.00 0.00 0.00 178.15 178.54 1gbt h LYS 239 N 0.07 0.99 -0.18 2.37 1.57 -1.08 0.24 116.57 120.55 1gbt h LYS 239 Ca 0.03 -0.17 -0.11 0.00 -1.87 0.00 0.00 60.65 58.53 1gbt h LYS 239 Cb 0.07 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.21 1gbt h LYS 239 CO -0.01 0.82 -0.32 1.96 -0.57 0.00 0.00 179.45 181.33 1gbt h GLN 240 N 0.97 0.53 -0.31 3.15 4.20 -0.93 -0.94 115.11 121.78 1gbt h GLN 240 Ca 0.23 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1gbt h GLN 240 Cb 0.20 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1gbt h GLN 240 CO -0.02 0.94 0.16 1.15 -0.67 0.00 0.00 178.83 180.40 1gbt h THR 241 N 0.18 1.14 -0.37 -0.54 2.02 -0.48 -2.38 112.91 112.48 1gbt h THR 241 Ca 0.01 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 1gbt h THR 241 Cb 0.92 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 1gbt h THR 241 CO 0.07 0.14 0.10 0.40 0.37 0.00 0.00 175.52 176.60 1gbt h ILE 242 N 0.38 1.22 0.00 3.11 2.04 -0.56 -2.71 117.51 120.99 1gbt h ILE 242 Ca 0.11 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.22 1gbt h ILE 242 Cb 0.08 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1gbt h ILE 242 CO -0.02 0.26 0.00 0.00 0.00 0.00 0.00 178.15 178.39 1gbt h ALA 243 N 0.94 1.00 -0.20 1.87 0.00 -0.84 -2.40 119.26 119.62 1gbt h ALA 243 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gbt h ALA 243 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1gbt h ALA 243 CO -0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 1gbt n SER 244 N -2.81 2.71 -0.11 0.00 3.41 -0.92 -5.09 113.62 110.80 1gbt n SER 244 Ca -0.02 -1.79 0.01 0.00 -0.26 0.00 0.00 58.87 56.81 1gbt n SER 244 Cb 0.10 -0.13 0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1gbt n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47