#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c1r s VAL 17 N 0.00 3.56 -0.99 1.39 1.01 -0.13 -4.00 120.40 121.24 1c1r s VAL 17 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1c1r s VAL 17 Cb 0.00 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.89 1c1r s VAL 17 CO 0.00 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1c1r n GLY 18 N 2.89 0.23 0.00 4.51 0.00 -1.23 -2.08 105.19 109.51 1c1r n GLY 18 Ca -0.18 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1c1r n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1r n GLY 19 N -1.16 3.16 3.22 -0.02 0.00 -1.26 -4.85 105.19 104.28 1c1r n GLY 19 Ca -0.13 -2.10 -0.13 0.00 0.00 0.00 0.00 46.02 43.67 1c1r n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c1r s TYR 20 N 1.05 1.16 -0.10 1.61 -0.85 -0.06 -4.93 117.35 115.24 1c1r s TYR 20 Ca 0.00 -1.14 -0.30 0.00 -0.52 0.00 0.00 57.07 55.12 1c1r s TYR 20 Cb 0.00 -0.66 -0.03 0.00 0.38 0.00 0.00 41.96 41.65 1c1r s TYR 20 CO 0.00 -0.35 1.27 0.99 -1.52 0.00 0.00 175.55 175.93 1c1r s THR 21 N -3.83 4.18 0.10 -3.49 2.01 -1.26 -0.17 115.64 113.17 1c1r s THR 21 Ca 0.28 1.47 -0.25 0.00 0.31 0.00 0.00 61.69 63.50 1c1r s THR 21 Cb 0.07 -3.95 -0.13 0.00 0.01 0.00 0.00 72.50 68.50 1c1r s THR 21 CO 0.06 -0.06 1.69 0.00 -0.69 0.00 0.00 174.62 175.62 1c1r n GLY 23 N -1.24 3.44 3.68 0.00 0.00 -1.26 -4.83 105.19 104.97 1c1r n GLY 23 Ca -0.08 -1.70 -0.46 0.00 0.00 0.00 0.00 46.02 43.79 1c1r n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1r n ALA 24 N -0.81 1.50 -3.59 4.61 0.00 -1.26 -2.50 120.51 118.46 1c1r n ALA 24 Ca 0.00 0.39 -0.27 0.00 0.00 0.00 0.00 53.44 53.56 1c1r n ALA 24 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.02 1c1r n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1c1r n ASN 25 N 4.50 -4.07 -0.13 0.00 4.13 -1.26 -4.87 115.26 113.57 1c1r n ASN 25 Ca 0.18 -0.56 0.12 0.00 1.68 0.00 0.00 54.58 56.01 1c1r n ASN 25 Cb 0.31 -3.32 0.31 0.00 -1.54 0.00 0.00 39.78 35.54 1c1r n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1c1r n THR 26 N -4.20 0.00 -3.38 3.41 -2.24 -1.04 -4.19 114.28 102.64 1c1r n THR 26 Ca 0.01 -0.07 -0.26 0.00 -2.27 0.00 0.00 64.05 61.46 1c1r n THR 26 Cb 0.53 0.33 -0.08 0.00 -2.10 0.00 0.00 70.33 69.02 1c1r n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1c1r n VAL 27 N -1.06 0.97 0.26 2.28 0.31 -1.26 -4.98 118.33 114.84 1c1r n VAL 27 Ca 0.09 -4.64 0.13 0.00 -0.01 0.00 0.00 64.34 59.91 1c1r n VAL 27 Cb 0.34 -2.03 0.66 0.00 -0.91 0.00 0.00 33.84 31.90 1c1r n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1c1r h PRO 28 N 4.31 0.00 -0.02 5.55 0.13 -1.79 -1.86 132.00 138.32 1c1r h PRO 28 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1c1r h PRO 28 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1c1r h PRO 28 CO 0.66 0.00 -0.15 2.48 -0.23 0.00 0.00 178.00 180.76 1c1r n TYR 29 N -2.43 0.00 -2.64 1.56 0.18 -1.20 -2.08 117.16 110.54 1c1r n TYR 29 Ca -0.01 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.36 1c1r n TYR 29 Cb 0.12 -0.03 -0.04 0.00 -0.38 0.00 0.00 39.34 39.01 1c1r n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1c1r s GLN 30 N -2.21 4.61 0.22 -3.48 2.00 -0.70 -1.17 119.66 118.93 1c1r s GLN 30 Ca 0.29 1.54 0.11 0.00 -2.00 0.00 0.00 55.36 55.30 1c1r s GLN 30 Cb 0.20 -3.37 -0.05 0.00 0.80 0.00 0.00 33.01 30.59 1c1r s GLN 30 CO 0.41 0.07 -0.20 0.14 -0.50 0.00 0.00 175.29 175.21 1c1r s VAL 31 N 0.29 2.22 -0.10 1.34 -7.23 -0.31 -4.47 120.40 112.14 1c1r s VAL 31 Ca 0.50 -2.19 0.04 0.00 -1.81 0.00 0.00 61.98 58.52 1c1r s VAL 31 Cb -0.25 -2.13 -0.00 0.00 0.56 0.00 0.00 36.38 34.56 1c1r s VAL 31 CO 0.30 -0.33 -0.24 -0.55 -0.31 0.00 0.00 175.10 173.97 1c1r s SER 32 N -3.09 3.06 -0.20 4.85 0.15 -0.75 -1.97 113.70 115.74 1c1r s SER 32 Ca 0.24 -0.55 -0.12 0.00 0.70 0.00 0.00 55.95 56.21 1c1r s SER 32 Cb -0.05 -1.38 -0.05 0.00 -1.71 0.00 0.00 66.02 62.83 1c1r s SER 32 CO 0.11 0.16 0.22 -0.76 1.20 0.00 0.00 173.24 174.17 1c1r s LEU 33 N 0.33 4.18 -0.07 3.45 1.43 0.33 -0.98 118.68 127.34 1c1r s LEU 33 Ca -0.18 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.25 1c1r s LEU 33 Cb -0.18 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.82 1c1r s LEU 33 CO 0.09 0.09 -0.20 0.21 0.23 0.00 0.00 176.35 176.76 1c1r s ASN 34 N 0.72 2.61 -0.34 2.29 3.84 0.20 -1.69 114.94 122.56 1c1r s ASN 34 Ca 0.11 -0.45 0.13 0.00 0.21 0.00 0.00 52.86 52.86 1c1r s ASN 34 Cb -0.13 -1.03 0.46 0.00 -0.55 0.00 0.00 41.25 39.99 1c1r s ASN 34 CO 0.03 0.14 1.06 -1.54 -2.79 0.00 0.00 177.10 174.00 1c1r n SER 37 N 3.43 2.98 0.00 -4.21 3.41 -1.26 -1.63 113.62 116.34 1c1r n SER 37 Ca -0.19 -3.05 0.00 0.00 -0.26 0.00 0.00 58.87 55.36 1c1r n SER 37 Cb 0.53 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1c1r n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c1r n GLY 38 N -0.38 1.10 3.51 5.00 0.00 -1.26 -5.00 105.19 108.16 1c1r n GLY 38 Ca 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.17 1c1r n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c1r s TYR 39 N -2.12 -0.33 0.11 1.61 1.13 -1.26 -5.15 117.35 111.34 1c1r s TYR 39 Ca 0.00 0.22 -0.30 0.00 -1.41 0.00 0.00 57.07 55.57 1c1r s TYR 39 Cb 0.00 0.53 -0.07 0.00 -1.10 0.00 0.00 41.96 41.33 1c1r s TYR 39 CO 0.00 -0.51 1.21 -1.58 -2.51 0.00 0.00 175.55 172.17 1c1r s HIS 40 N -2.98 3.42 0.00 -3.49 5.65 -1.26 -4.30 115.29 112.34 1c1r s HIS 40 Ca 0.05 1.31 0.00 0.00 0.25 0.00 0.00 55.06 56.67 1c1r s HIS 40 Cb -0.01 -3.44 0.00 0.00 -1.18 0.00 0.00 32.58 27.95 1c1r s HIS 40 CO -0.08 -1.34 0.00 1.97 -0.65 0.00 0.00 174.74 174.63 1c1r n PHE 41 N 3.44 0.00 -3.65 3.88 1.16 -0.68 -4.97 117.46 116.64 1c1r n PHE 41 Ca 0.08 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.56 1c1r n PHE 41 Cb 0.45 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.30 1c1r n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1c1r s GLY 43 N -2.84 2.20 0.12 0.00 0.00 0.20 -0.51 107.32 106.49 1c1r s GLY 43 Ca 0.06 -1.45 -0.25 0.00 0.00 0.00 0.00 44.72 43.09 1c1r s GLY 43 CO -0.03 -1.89 1.09 -0.32 0.00 0.00 0.00 173.10 171.95 1c1r s GLY 44 N -4.43 -0.06 -0.05 0.20 0.00 -0.83 -3.70 107.32 98.44 1c1r s GLY 44 Ca 0.41 -0.05 0.04 0.00 0.00 0.00 0.00 44.72 45.11 1c1r s GLY 44 CO 0.26 2.08 -0.16 -0.56 0.00 0.00 0.00 173.10 174.72 1c1r s SER 45 N -3.31 2.05 -0.19 1.64 0.01 -0.32 -1.16 113.70 112.41 1c1r s SER 45 Ca 0.20 -0.34 -0.25 0.00 1.31 0.00 0.00 55.95 56.87 1c1r s SER 45 Cb -0.01 -0.68 -0.01 0.00 0.21 0.00 0.00 66.02 65.53 1c1r s SER 45 CO 0.03 0.12 0.82 -0.22 0.41 0.00 0.00 173.24 174.39 1c1r s LEU 46 N 0.21 4.15 -0.02 2.44 2.96 -0.32 -1.00 118.68 127.10 1c1r s LEU 46 Ca -0.07 1.12 0.20 0.00 -0.22 0.00 0.00 54.13 55.15 1c1r s LEU 46 Cb -0.13 -3.20 -0.27 0.00 0.50 0.00 0.00 46.19 43.09 1c1r s LEU 46 CO 0.03 -0.42 0.59 2.30 -1.32 0.00 0.00 176.35 177.53 1c1r n ILE 47 N 4.85 0.00 -3.67 6.68 -5.35 -0.31 -0.71 119.36 120.85 1c1r n ILE 47 Ca 0.04 -0.29 -0.00 0.00 -0.27 0.00 0.00 62.75 62.23 1c1r n ILE 47 Cb 0.49 0.43 -0.01 0.00 -1.74 0.00 0.00 39.64 38.80 1c1r n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1c1r s ASN 48 N -3.70 -0.10 0.61 7.28 6.03 -1.22 -4.53 114.94 119.31 1c1r s ASN 48 Ca -0.01 -0.23 0.27 0.00 -1.03 0.00 0.00 52.86 51.86 1c1r s ASN 48 Cb 0.13 0.28 1.38 0.00 -3.03 0.00 0.00 41.25 40.02 1c1r s ASN 48 CO 0.81 -0.52 1.79 0.77 -2.03 0.00 0.00 177.10 177.92 1c1r h SER 49 N 2.00 0.00 -0.00 3.54 4.64 -1.96 -2.83 113.55 118.94 1c1r h SER 49 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1c1r h SER 49 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1c1r h SER 49 CO 0.27 0.00 -0.24 0.00 -0.87 0.00 0.00 176.83 175.99 1c1r n GLN 50 N -3.42 3.20 -4.36 4.77 6.02 -1.26 -0.48 117.38 121.85 1c1r n GLN 50 Ca 0.07 -0.31 -0.20 0.00 -0.01 0.00 0.00 57.00 56.56 1c1r n GLN 50 Cb 0.72 -0.94 -0.13 0.00 1.02 0.00 0.00 30.24 30.90 1c1r n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1c1r s TRP 51 N -1.38 1.18 0.03 1.08 0.52 -1.07 -1.02 118.94 118.27 1c1r s TRP 51 Ca 0.05 -0.34 0.06 0.00 0.02 0.00 0.00 56.10 55.89 1c1r s TRP 51 Cb 0.06 -0.71 -0.02 0.00 -1.15 0.00 0.00 33.47 31.65 1c1r s TRP 51 CO 0.24 0.02 -0.19 0.08 0.02 0.00 0.00 176.95 177.13 1c1r s VAL 52 N -0.80 1.48 -0.07 4.03 1.01 -0.09 -1.16 120.40 124.80 1c1r s VAL 52 Ca 0.01 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.98 1c1r s VAL 52 Cb -0.08 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 1c1r s VAL 52 CO 0.01 0.21 -0.16 0.68 0.00 0.00 0.00 175.10 175.84 1c1r s VAL 53 N -0.71 2.88 0.00 2.92 -7.23 -0.17 -0.89 120.40 117.19 1c1r s VAL 53 Ca 0.06 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.46 1c1r s VAL 53 Cb -0.08 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.73 1c1r s VAL 53 CO 0.01 0.57 0.00 -0.24 -0.31 0.00 0.00 175.10 175.13 1c1r n SER 54 N 2.69 0.00 -4.89 4.85 2.88 0.05 -1.18 113.62 118.02 1c1r n SER 54 Ca -0.17 -0.51 -0.35 0.00 -1.33 0.00 0.00 58.87 56.50 1c1r n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1c1r n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1c1r s ALA 55 N -1.83 3.91 0.40 -1.46 0.00 -1.26 -0.99 121.76 120.54 1c1r s ALA 55 Ca 0.00 -0.69 0.19 0.00 0.00 0.00 0.00 51.96 51.47 1c1r s ALA 55 Cb 0.00 -1.95 1.10 0.00 0.00 0.00 0.00 23.12 22.28 1c1r s ALA 55 CO 0.00 0.68 1.98 0.00 0.00 0.00 0.00 175.76 178.42 1c1r h ALA 56 N 4.31 1.43 0.00 0.00 0.00 -1.70 -1.76 119.26 121.54 1c1r h ALA 56 Ca -0.51 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1c1r h ALA 56 Cb 1.21 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1c1r h ALA 56 CO 0.64 0.26 0.00 -2.39 0.00 0.00 0.00 179.25 177.76 1c1r n HIS 57 N -3.96 0.00 0.81 0.00 1.44 -1.26 -1.40 115.22 110.84 1c1r n HIS 57 Ca -0.02 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.81 1c1r n HIS 57 Cb 0.29 -0.06 0.19 0.00 0.12 0.00 0.00 29.99 30.53 1c1r n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1c1r n TYR 59 N 1.26 2.70 -3.59 0.00 4.19 -0.50 -4.98 117.16 116.24 1c1r n TYR 59 Ca 0.16 0.29 -0.11 0.00 3.31 0.00 0.00 57.90 61.56 1c1r n TYR 59 Cb 0.57 -2.57 -0.03 0.00 0.49 0.00 0.00 39.34 37.80 1c1r n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1c1r s LYS 60 N -0.47 1.29 -0.04 2.98 1.02 -1.26 -5.14 119.74 118.12 1c1r s LYS 60 Ca 0.65 -0.68 -0.02 0.00 0.02 0.00 0.00 55.97 55.94 1c1r s LYS 60 Cb -0.53 0.54 -0.04 0.00 -0.52 0.00 0.00 37.83 37.28 1c1r s LYS 60 CO 0.49 -0.55 0.11 -1.54 -0.92 0.00 0.00 175.35 172.94 1c1r s SER 61 N -2.81 5.95 0.00 2.83 1.04 -1.26 -4.63 113.70 114.82 1c1r s SER 61 Ca 0.04 0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.74 1c1r s SER 61 Cb -0.01 -1.80 0.00 0.00 0.10 0.00 0.00 66.02 64.32 1c1r s SER 61 CO -0.09 0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.05 1c1r n GLY 62 N 1.38 0.56 3.84 7.32 0.00 -1.26 -5.07 105.19 111.96 1c1r n GLY 62 Ca -0.14 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 1c1r n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c1r s ILE 63 N -2.57 5.43 -0.06 -0.61 1.01 -1.26 -4.54 121.20 118.59 1c1r s ILE 63 Ca 0.00 0.18 0.06 0.00 0.00 0.00 0.00 60.65 60.89 1c1r s ILE 63 Cb 0.00 -3.38 -0.01 0.00 0.01 0.00 0.00 42.46 39.08 1c1r s ILE 63 CO 0.00 0.59 -0.24 -1.58 0.00 0.00 0.00 174.94 173.70 1c1r s GLN 64 N -0.78 2.59 -0.18 2.79 0.74 -0.64 -2.04 119.66 122.14 1c1r s GLN 64 Ca 0.14 -0.88 -0.09 0.00 0.05 0.00 0.00 55.36 54.57 1c1r s GLN 64 Cb -0.12 -2.15 -0.05 0.00 1.10 0.00 0.00 33.01 31.80 1c1r s GLN 64 CO 0.03 0.34 0.13 0.08 -0.55 0.00 0.00 175.29 175.32 1c1r s VAL 65 N -0.07 5.43 -0.20 1.34 1.01 0.42 -0.63 120.40 127.70 1c1r s VAL 65 Ca -0.06 0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1c1r s VAL 65 Cb -0.14 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 32.82 1c1r s VAL 65 CO 0.04 0.49 -0.16 -0.13 0.00 0.00 0.00 175.10 175.34 1c1r s ARG 66 N -0.01 2.68 0.26 2.72 0.52 -0.15 -0.84 118.95 124.13 1c1r s ARG 66 Ca 0.10 -0.98 0.07 0.00 -0.52 0.00 0.00 55.73 54.40 1c1r s ARG 66 Cb -0.11 -2.64 -0.03 0.00 0.52 0.00 0.00 34.95 32.69 1c1r s ARG 66 CO -0.00 -0.33 0.25 -0.51 0.02 0.00 0.00 175.30 174.72 1c1r s LEU 67 N 1.25 3.92 -1.40 2.53 1.02 0.50 -1.81 118.68 124.69 1c1r s LEU 67 Ca 0.00 -0.19 0.00 0.00 0.02 0.00 0.00 54.13 53.96 1c1r s LEU 67 Cb -0.15 -2.47 0.00 0.00 0.02 0.00 0.00 46.19 43.59 1c1r s LEU 67 CO -0.10 -0.08 0.00 0.61 0.02 0.00 0.00 176.35 176.80 1c1r n GLY 69 N -1.26 0.25 3.89 -3.19 0.00 -1.26 -1.70 105.19 101.92 1c1r n GLY 69 Ca -0.07 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 1c1r n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c1r s GLU 70 N -4.35 3.73 0.00 1.61 0.41 -1.26 -3.80 118.70 115.03 1c1r s GLU 70 Ca 0.00 0.20 0.00 0.00 -0.41 0.00 0.00 54.97 54.76 1c1r s GLU 70 Cb 0.00 -2.60 0.00 0.00 -1.78 0.00 0.00 34.13 29.75 1c1r s GLU 70 CO 0.00 0.20 0.00 -3.47 -0.49 0.00 0.00 175.26 171.50 1c1r n ASP 71 N -0.71 0.00 -4.61 -0.19 2.03 -1.26 -4.54 116.55 107.27 1c1r n ASP 71 Ca -0.00 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.89 1c1r n ASP 71 Cb 0.53 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.88 1c1r n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1c1r s ASN 72 N -1.59 6.64 0.00 1.67 3.84 -1.25 -3.08 114.94 121.17 1c1r s ASN 72 Ca 0.00 0.62 0.31 0.00 0.21 0.00 0.00 52.86 54.01 1c1r s ASN 72 Cb 0.00 -2.40 1.76 0.00 -0.55 0.00 0.00 41.25 40.06 1c1r s ASN 72 CO 0.00 -0.62 2.16 2.30 -2.79 0.00 0.00 177.10 178.15 1c1r n ILE 73 N 5.55 0.00 0.52 -5.21 -5.35 0.34 -3.17 119.36 112.04 1c1r n ILE 73 Ca 0.03 -0.01 0.07 0.00 -0.27 0.00 0.00 62.75 62.58 1c1r n ILE 73 Cb 0.48 -0.47 0.07 0.00 -1.74 0.00 0.00 39.64 37.98 1c1r n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1c1r n ASN 74 N -1.06 2.22 -3.95 7.28 3.02 -1.26 -4.95 115.26 116.56 1c1r n ASN 74 Ca 0.21 -1.60 -0.21 0.00 -0.03 0.00 0.00 54.58 52.94 1c1r n ASN 74 Cb 0.16 -0.02 -0.16 0.00 -0.61 0.00 0.00 39.78 39.15 1c1r n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1c1r s VAL 75 N -1.14 0.74 -0.55 2.41 1.01 -1.19 -5.09 120.40 116.59 1c1r s VAL 75 Ca 0.17 -0.27 -0.26 0.00 0.00 0.00 0.00 61.98 61.62 1c1r s VAL 75 Cb 0.12 -0.70 0.03 0.00 0.00 0.00 0.00 36.38 35.83 1c1r s VAL 75 CO 0.17 0.26 1.07 -0.69 0.00 0.00 0.00 175.10 175.91 1c1r s VAL 76 N 0.65 4.21 -1.77 2.92 1.01 -1.26 -4.69 120.40 121.47 1c1r s VAL 76 Ca -0.10 0.68 0.25 0.00 0.00 0.00 0.00 61.98 62.81 1c1r s VAL 76 Cb -0.13 -4.62 0.13 0.00 0.00 0.00 0.00 36.38 31.75 1c1r s VAL 76 CO 0.01 -1.18 1.35 -0.62 0.00 0.00 0.00 175.10 174.66 1c1r n GLU 77 N 7.91 0.88 0.00 2.72 1.02 -1.26 -4.97 120.64 126.94 1c1r n GLU 77 Ca 0.06 -0.62 0.00 0.00 -0.02 0.00 0.00 57.16 56.58 1c1r n GLU 77 Cb 0.48 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 1c1r n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c1r n GLY 78 N 1.39 2.12 1.64 0.62 0.00 -1.26 -4.96 105.19 104.73 1c1r n GLY 78 Ca 0.10 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.20 1c1r n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c1r n ASN 79 N 0.00 5.18 -4.90 1.61 5.03 -1.26 -4.99 115.26 115.93 1c1r n ASN 79 Ca 0.00 -2.83 -0.29 0.00 0.87 0.00 0.00 54.58 52.33 1c1r n ASN 79 Cb 0.00 -0.63 -0.03 0.00 -1.02 0.00 0.00 39.78 38.10 1c1r n ASN 79 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1c1r s GLU 80 N -2.56 3.66 -0.05 3.52 8.01 -1.25 -4.13 118.70 125.91 1c1r s GLU 80 Ca 0.51 0.10 -0.00 0.00 0.01 0.00 0.00 54.97 55.59 1c1r s GLU 80 Cb 0.38 -2.58 0.03 0.00 -4.31 0.00 0.00 34.13 27.64 1c1r s GLU 80 CO 0.17 0.15 0.00 -0.65 0.01 0.00 0.00 175.26 174.93 1c1r s GLN 81 N -3.67 0.45 -0.25 1.61 -0.21 -0.69 -4.97 119.66 111.93 1c1r s GLN 81 Ca 0.45 0.09 -0.03 0.00 0.02 0.00 0.00 55.36 55.90 1c1r s GLN 81 Cb -0.11 -0.71 0.02 0.00 1.00 0.00 0.00 33.01 33.21 1c1r s GLN 81 CO 0.31 -0.21 -0.03 -0.06 -2.12 0.00 0.00 175.29 173.18 1c1r s PHE 82 N 1.47 3.07 -0.03 0.91 2.99 -1.26 -0.37 117.98 124.75 1c1r s PHE 82 Ca -0.03 -1.39 0.02 0.00 0.00 0.00 0.00 56.93 55.53 1c1r s PHE 82 Cb -0.13 -2.10 0.01 0.00 0.00 0.00 0.00 43.02 40.80 1c1r s PHE 82 CO -0.03 -0.68 -0.09 0.42 -0.00 0.00 0.00 175.22 174.84 1c1r s ILE 83 N 1.37 0.83 0.61 0.64 1.01 -0.02 -4.97 121.20 120.67 1c1r s ILE 83 Ca 0.01 -0.36 -0.11 0.00 0.00 0.00 0.00 60.65 60.19 1c1r s ILE 83 Cb -0.16 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 1c1r s ILE 83 CO -0.03 0.27 1.02 -0.44 0.00 0.00 0.00 174.94 175.75 1c1r s SER 84 N 0.35 6.23 0.18 3.58 0.01 -1.26 -0.44 113.70 122.36 1c1r s SER 84 Ca -0.06 1.39 -0.19 0.00 1.31 0.00 0.00 55.95 58.40 1c1r s SER 84 Cb -0.11 -2.46 -0.08 0.00 0.21 0.00 0.00 66.02 63.59 1c1r s SER 84 CO 0.01 -0.85 0.68 0.00 0.41 0.00 0.00 173.24 173.49 1c1r s ALA 85 N -3.15 3.47 -0.17 1.44 0.00 -0.86 -0.69 121.76 121.79 1c1r s ALA 85 Ca 0.55 0.13 0.11 0.00 0.00 0.00 0.00 51.96 52.75 1c1r s ALA 85 Cb -0.11 -2.77 -0.23 0.00 0.00 0.00 0.00 23.12 20.01 1c1r s ALA 85 CO 0.53 0.35 0.16 -1.13 0.00 0.00 0.00 175.76 175.68 1c1r n SER 86 N 0.97 0.78 -3.58 0.00 3.41 0.60 -4.70 113.62 111.09 1c1r n SER 86 Ca -0.04 0.08 -0.16 0.00 -0.26 0.00 0.00 58.87 58.49 1c1r n SER 86 Cb 0.51 0.32 -0.06 0.00 -0.26 0.00 0.00 64.21 64.72 1c1r n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1c1r s LYS 87 N -2.53 0.98 -0.00 4.33 2.20 -1.23 -5.01 119.74 118.48 1c1r s LYS 87 Ca -0.15 -0.02 0.05 0.00 -0.36 0.00 0.00 55.97 55.50 1c1r s LYS 87 Cb 0.07 0.45 -0.01 0.00 -1.51 0.00 0.00 37.83 36.83 1c1r s LYS 87 CO 0.78 -0.32 -0.16 -1.12 -0.36 0.00 0.00 175.35 174.16 1c1r s SER 88 N -1.52 1.91 -0.20 1.43 0.01 -1.26 -0.80 113.70 113.26 1c1r s SER 88 Ca -0.09 -0.33 -0.02 0.00 1.31 0.00 0.00 55.95 56.83 1c1r s SER 88 Cb -0.01 -0.20 0.06 0.00 0.21 0.00 0.00 66.02 66.08 1c1r s SER 88 CO 0.04 0.18 0.00 -0.63 0.41 0.00 0.00 173.24 173.24 1c1r s ILE 89 N -0.46 0.88 0.22 1.44 1.01 0.54 -4.99 121.20 119.84 1c1r s ILE 89 Ca 0.06 -0.77 -0.17 0.00 0.00 0.00 0.00 60.65 59.77 1c1r s ILE 89 Cb -0.07 -1.28 -0.08 0.00 0.01 0.00 0.00 42.46 41.04 1c1r s ILE 89 CO -0.00 -0.15 0.68 -0.69 0.00 0.00 0.00 174.94 174.78 1c1r s VAL 90 N 1.70 4.66 0.23 2.92 1.01 -1.26 -1.16 120.40 128.49 1c1r s VAL 90 Ca -0.02 1.10 -0.31 0.00 0.00 0.00 0.00 61.98 62.75 1c1r s VAL 90 Cb -0.17 -3.78 -0.14 0.00 0.00 0.00 0.00 36.38 32.28 1c1r s VAL 90 CO -0.07 0.14 1.22 1.57 0.00 0.00 0.00 175.10 177.96 1c1r n HIS 91 N 0.54 1.64 0.12 5.22 -0.00 -0.84 -4.84 115.22 117.07 1c1r n HIS 91 Ca -0.02 0.59 0.18 0.00 0.46 0.00 0.00 57.72 58.93 1c1r n HIS 91 Cb 0.52 -2.34 0.76 0.00 -0.12 0.00 0.00 29.99 28.80 1c1r n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1c1r h PRO 92 N 3.34 0.00 -0.29 1.57 0.13 -1.93 -2.33 132.00 132.49 1c1r h PRO 92 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1c1r h PRO 92 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1c1r h PRO 92 CO 0.70 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.90 1c1r n SER 93 N -4.02 4.05 -4.73 1.44 7.64 -1.26 -5.01 113.62 111.73 1c1r n SER 93 Ca 0.05 -3.00 -0.42 0.00 1.01 0.00 0.00 58.87 56.51 1c1r n SER 93 Cb 0.45 -0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 63.07 1c1r n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1c1r s TYR 94 N -2.80 2.95 -0.31 1.43 6.14 -0.88 -4.68 117.35 119.20 1c1r s TYR 94 Ca 0.43 0.66 -0.01 0.00 0.64 0.00 0.00 57.07 58.79 1c1r s TYR 94 Cb 0.35 -3.99 0.06 0.00 0.42 0.00 0.00 41.96 38.80 1c1r s TYR 94 CO 0.10 -3.53 0.01 1.21 0.64 0.00 0.00 175.55 173.98 1c1r s ASN 95 N 0.88 4.90 0.37 4.32 3.84 -0.76 -4.98 114.94 123.50 1c1r s ASN 95 Ca 0.68 -1.38 0.27 0.00 0.21 0.00 0.00 52.86 52.65 1c1r s ASN 95 Cb -0.46 -1.71 1.20 0.00 -0.55 0.00 0.00 41.25 39.73 1c1r s ASN 95 CO 0.37 -0.29 1.82 0.77 -2.79 0.00 0.00 177.10 176.98 1c1r h SER 96 N 7.98 0.00 0.45 -4.21 4.64 -1.93 0.24 113.55 120.71 1c1r h SER 96 Ca -0.20 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 60.82 1c1r h SER 96 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1c1r h SER 96 CO 0.54 0.00 -1.52 0.78 -0.87 0.00 0.00 176.83 175.77 1c1r h ASN 97 N 0.00 0.42 0.00 4.97 -0.26 -1.97 -3.37 115.58 115.37 1c1r h ASN 97 Ca 0.00 -0.57 0.00 0.00 -0.56 0.00 0.00 56.30 55.17 1c1r h ASN 97 Cb 0.33 -0.14 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 1c1r h ASN 97 CO 0.00 1.47 -1.17 0.35 -1.06 0.00 0.00 177.43 177.02 1c1r n THR 98 N -3.48 0.00 -1.53 2.81 -2.24 -1.11 -4.97 114.28 103.76 1c1r n THR 98 Ca -0.16 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.27 1c1r n THR 98 Cb 1.05 0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 69.85 1c1r n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1c1r n LEU 99 N -1.67 -0.94 -4.75 3.22 4.77 0.81 -4.99 117.00 113.45 1c1r n LEU 99 Ca 0.00 0.19 -0.41 0.00 -0.03 0.00 0.00 56.01 55.77 1c1r n LEU 99 Cb 0.31 -1.69 -0.04 0.00 -2.33 0.00 0.00 43.42 39.68 1c1r n LEU 99 CO 0.32 -0.43 0.80 0.21 -1.33 0.00 0.00 177.39 176.95 1c1r s ASN 100 N -2.80 7.26 -0.93 -1.43 2.47 -1.20 -3.23 114.94 115.07 1c1r s ASN 100 Ca 0.00 2.22 -0.02 0.00 0.42 0.00 0.00 52.86 55.48 1c1r s ASN 100 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1c1r s ASN 100 CO 0.00 -0.18 0.79 0.59 -3.72 0.00 0.00 177.10 174.58 1c1r n ASN 101 N 1.61 -2.85 -4.18 -4.21 3.02 -1.26 -1.83 115.26 105.56 1c1r n ASN 101 Ca 0.00 -0.45 -0.43 0.00 -0.03 0.00 0.00 54.58 53.67 1c1r n ASN 101 Cb 0.45 -3.95 0.00 0.00 -0.61 0.00 0.00 39.78 35.67 1c1r n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1c1r n ASP 102 N -2.42 4.79 -3.80 6.41 2.03 -1.20 -4.27 116.55 118.09 1c1r n ASP 102 Ca -0.16 -2.96 -0.12 0.00 0.52 0.00 0.00 54.79 52.06 1c1r n ASP 102 Cb 0.61 -1.62 -0.10 0.00 -0.72 0.00 0.00 41.12 39.29 1c1r n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1c1r s ILE 103 N 2.42 0.05 0.00 5.18 2.07 -1.26 -3.88 121.20 125.77 1c1r s ILE 103 Ca 0.46 -0.42 -0.11 0.00 -1.41 0.00 0.00 60.65 59.18 1c1r s ILE 103 Cb 0.06 -0.48 0.01 0.00 0.13 0.00 0.00 42.46 42.18 1c1r s ILE 103 CO 0.00 -0.23 0.22 -0.32 -1.91 0.00 0.00 174.94 172.70 1c1r s MET 104 N -0.94 0.59 -0.04 3.50 -2.45 -0.16 -1.99 119.30 117.81 1c1r s MET 104 Ca -0.10 -0.34 0.05 0.00 -1.25 0.00 0.00 55.69 54.04 1c1r s MET 104 Cb -0.05 0.25 -0.02 0.00 1.25 0.00 0.00 34.83 36.26 1c1r s MET 104 CO 0.02 -0.16 -0.18 -0.51 1.05 0.00 0.00 175.02 175.25 1c1r s LEU 105 N -1.45 2.53 -0.08 4.11 1.43 -0.31 -0.77 118.68 124.14 1c1r s LEU 105 Ca -0.13 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1c1r s LEU 105 Cb -0.06 -1.49 0.01 0.00 0.03 0.00 0.00 46.19 44.68 1c1r s LEU 105 CO 0.02 0.34 -0.14 -0.63 0.23 0.00 0.00 176.35 176.17 1c1r s ILE 106 N -0.70 1.30 -0.11 -0.59 1.01 -0.07 -0.34 121.20 121.70 1c1r s ILE 106 Ca 0.11 -0.56 -0.06 0.00 0.00 0.00 0.00 60.65 60.15 1c1r s ILE 106 Cb -0.10 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.14 1c1r s ILE 106 CO 0.00 0.40 0.10 -0.75 0.00 0.00 0.00 174.94 174.69 1c1r s LYS 107 N 0.77 3.33 0.19 2.79 2.20 0.02 -0.91 119.74 128.12 1c1r s LYS 107 Ca -0.12 -0.21 -0.15 0.00 -0.36 0.00 0.00 55.97 55.12 1c1r s LYS 107 Cb -0.16 -3.08 -0.07 0.00 -1.51 0.00 0.00 37.83 33.01 1c1r s LYS 107 CO 0.02 0.74 0.61 -0.51 -0.36 0.00 0.00 175.35 175.86 1c1r s LEU 108 N -0.95 4.30 0.33 5.43 1.43 -0.19 -0.29 118.68 128.74 1c1r s LEU 108 Ca 0.14 1.17 0.05 0.00 -1.03 0.00 0.00 54.13 54.47 1c1r s LEU 108 Cb -0.12 -3.47 0.58 0.00 0.03 0.00 0.00 46.19 43.22 1c1r s LEU 108 CO 0.03 0.04 1.83 0.11 0.23 0.00 0.00 176.35 178.59 1c1r h LYS 109 N 3.31 0.43 -4.94 1.70 1.57 -1.18 -3.42 116.57 114.04 1c1r h LYS 109 Ca -0.48 -0.12 -0.31 0.00 -1.87 0.00 0.00 60.65 57.87 1c1r h LYS 109 Cb 1.19 -0.05 -0.17 0.00 0.08 0.00 0.00 32.23 33.28 1c1r h LYS 109 CO 0.66 0.56 -0.73 0.45 -0.57 0.00 0.00 179.45 179.82 1c1r s SER 110 N -6.80 1.45 0.35 0.86 0.15 -1.26 -5.00 113.70 103.45 1c1r s SER 110 Ca -0.07 -0.86 -0.26 0.00 0.70 0.00 0.00 55.95 55.47 1c1r s SER 110 Cb 0.15 0.02 -0.09 0.00 -1.71 0.00 0.00 66.02 64.38 1c1r s SER 110 CO 0.76 -0.29 1.00 0.00 1.20 0.00 0.00 173.24 175.92 1c1r s ALA 111 N -2.68 3.18 0.64 5.45 0.00 -1.26 -4.85 121.76 122.23 1c1r s ALA 111 Ca 0.07 0.64 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1c1r s ALA 111 Cb -0.01 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 1c1r s ALA 111 CO -0.00 -0.02 1.04 0.00 0.00 0.00 0.00 175.76 176.78 1c1r s ALA 112 N -1.58 3.05 -0.28 0.00 0.00 0.36 -4.99 121.76 118.32 1c1r s ALA 112 Ca 0.52 -0.14 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 1c1r s ALA 112 Cb -0.22 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 1c1r s ALA 112 CO 0.27 -0.79 0.27 -1.12 0.00 0.00 0.00 175.76 174.39 1c1r s SER 113 N -4.21 6.12 0.10 0.00 0.01 -1.26 -4.84 113.70 109.61 1c1r s SER 113 Ca 0.56 0.09 -0.20 0.00 1.31 0.00 0.00 55.95 57.71 1c1r s SER 113 Cb -0.11 -2.16 -0.07 0.00 0.21 0.00 0.00 66.02 63.89 1c1r s SER 113 CO 0.54 -0.11 0.61 -0.76 0.41 0.00 0.00 173.24 173.93 1c1r s LEU 114 N 1.89 4.54 0.00 2.44 1.43 -1.26 -4.81 118.68 122.91 1c1r s LEU 114 Ca 0.10 1.34 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 1c1r s LEU 114 Cb -0.16 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 43.07 1c1r s LEU 114 CO 0.11 0.26 0.00 -0.46 0.23 0.00 0.00 176.35 176.48 1c1r n ASN 115 N 1.67 0.00 -0.06 2.29 0.23 0.65 -4.97 115.26 115.07 1c1r n ASN 115 Ca -0.09 -0.40 0.01 0.00 -0.53 0.00 0.00 54.58 53.57 1c1r n ASN 115 Cb 0.50 0.00 0.32 0.00 -2.08 0.00 0.00 39.78 38.53 1c1r n ASN 115 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1c1r h SER 116 N 0.00 0.59 1.23 0.53 0.02 -2.00 -2.91 113.55 111.01 1c1r h SER 116 Ca 0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1c1r h SER 116 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1c1r h SER 116 CO 0.00 0.51 -0.67 0.03 -1.14 0.00 0.00 176.83 175.56 1c1r h ARG 117 N 0.66 0.00 -3.84 3.45 3.08 -1.92 -3.43 114.38 112.37 1c1r h ARG 117 Ca 0.16 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.66 1c1r h ARG 117 Cb 0.09 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 29.74 1c1r h ARG 117 CO -0.02 0.00 -0.77 0.08 -1.07 0.00 0.00 179.97 178.19 1c1r s VAL 118 N -3.29 0.94 0.13 2.04 1.01 -1.10 -4.38 120.40 115.75 1c1r s VAL 118 Ca 0.03 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1c1r s VAL 118 Cb 0.09 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1c1r s VAL 118 CO 0.74 -0.23 -0.01 0.00 0.00 0.00 0.00 175.10 175.60 1c1r s ALA 119 N 1.66 1.03 0.38 5.51 0.00 -0.89 -0.25 121.76 129.20 1c1r s ALA 119 Ca -0.01 -1.45 0.05 0.00 0.00 0.00 0.00 51.96 50.55 1c1r s ALA 119 Cb -0.18 0.47 -0.00 0.00 0.00 0.00 0.00 23.12 23.41 1c1r s ALA 119 CO -0.09 -0.34 0.54 -1.54 0.00 0.00 0.00 175.76 174.33 1c1r s SER 120 N -3.08 5.85 0.12 0.00 1.04 -1.26 -3.25 113.70 113.12 1c1r s SER 120 Ca 0.18 -0.13 0.07 0.00 0.48 0.00 0.00 55.95 56.55 1c1r s SER 120 Cb 0.06 -1.16 -0.04 0.00 0.10 0.00 0.00 66.02 64.98 1c1r s SER 120 CO -0.01 -0.58 -0.06 -0.51 0.98 0.00 0.00 173.24 173.05 1c1r s ILE 121 N -2.31 3.52 0.28 -1.02 1.10 0.11 -4.86 121.20 118.02 1c1r s ILE 121 Ca 0.48 -1.29 -0.15 0.00 -0.51 0.00 0.00 60.65 59.18 1c1r s ILE 121 Cb -0.10 -2.69 -0.08 0.00 0.15 0.00 0.00 42.46 39.74 1c1r s ILE 121 CO 0.33 0.05 0.69 -0.44 -2.11 0.00 0.00 174.94 173.46 1c1r s SER 122 N -2.43 6.81 0.34 4.50 0.01 -1.26 -4.61 113.70 117.06 1c1r s SER 122 Ca 0.24 1.24 -0.13 0.00 1.31 0.00 0.00 55.95 58.60 1c1r s SER 122 Cb -0.11 -2.35 -0.08 0.00 0.21 0.00 0.00 66.02 63.69 1c1r s SER 122 CO 0.16 -0.12 0.73 -0.76 0.41 0.00 0.00 173.24 173.66 1c1r s LEU 123 N -2.68 4.01 0.52 2.44 1.43 -1.26 -1.04 118.68 122.09 1c1r s LEU 123 Ca 0.50 1.22 -0.18 0.00 -1.03 0.00 0.00 54.13 54.64 1c1r s LEU 123 Cb -0.12 -4.04 -0.07 0.00 0.03 0.00 0.00 46.19 41.99 1c1r s LEU 123 CO 0.19 -0.25 1.01 -2.16 0.23 0.00 0.00 176.35 175.37 1c1r s PRO 124 N -3.20 3.80 -0.03 1.29 0.04 -1.26 -4.81 135.00 130.82 1c1r s PRO 124 Ca 0.53 1.11 0.18 0.00 0.04 0.00 0.00 61.00 62.87 1c1r s PRO 124 Cb -0.10 -2.11 -0.21 0.00 0.04 0.00 0.00 34.50 32.12 1c1r s PRO 124 CO 0.21 -0.40 0.53 0.25 0.04 0.00 0.00 177.00 177.63 1c1r n THR 125 N -1.45 0.98 -4.09 1.26 -2.24 -1.26 -4.96 114.28 102.52 1c1r n THR 125 Ca 0.08 -0.70 -0.11 0.00 -2.27 0.00 0.00 64.05 61.05 1c1r n THR 125 Cb 0.53 -0.49 -0.07 0.00 -2.10 0.00 0.00 70.33 68.21 1c1r n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1c1r s SER 127 N -5.41 0.19 0.45 3.42 1.04 -1.26 -5.16 113.70 106.96 1c1r s SER 127 Ca -0.06 -1.19 -0.08 0.00 0.48 0.00 0.00 55.95 55.10 1c1r s SER 127 Cb 0.09 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.69 1c1r s SER 127 CO 0.84 -1.07 0.79 0.00 0.98 0.00 0.00 173.24 174.78 1c1r s ALA 129 N -2.56 3.59 0.37 0.00 0.00 -1.26 -5.08 121.76 116.82 1c1r s ALA 129 Ca 0.50 -0.51 -0.12 0.00 0.00 0.00 0.00 51.96 51.83 1c1r s ALA 129 Cb -0.10 -2.34 -0.07 0.00 0.00 0.00 0.00 23.12 20.60 1c1r s ALA 129 CO 0.38 0.23 0.74 -1.12 0.00 0.00 0.00 175.76 175.99 1c1r s SER 130 N -3.13 6.62 0.53 0.00 0.01 -1.26 -5.02 113.70 111.44 1c1r s SER 130 Ca 0.45 1.17 -0.22 0.00 1.31 0.00 0.00 55.95 58.65 1c1r s SER 130 Cb -0.11 -2.33 -0.05 0.00 0.21 0.00 0.00 66.02 63.74 1c1r s SER 130 CO 0.30 -0.31 1.35 0.00 0.41 0.00 0.00 173.24 174.99 1c1r s ALA 132 N -2.20 2.88 0.00 1.44 0.00 -1.26 -1.89 121.76 120.73 1c1r s ALA 132 Ca 0.52 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.80 1c1r s ALA 132 Cb -0.10 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1c1r s ALA 132 CO 0.26 -1.31 0.00 0.41 0.00 0.00 0.00 175.76 175.12 1c1r n GLY 133 N 0.69 2.88 3.75 0.00 0.00 0.27 -4.94 105.19 107.84 1c1r n GLY 133 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1c1r n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c1r s THR 134 N -2.77 2.91 0.08 2.61 2.01 -0.79 -4.67 115.64 115.02 1c1r s THR 134 Ca 0.00 0.79 -0.21 0.00 0.31 0.00 0.00 61.69 62.58 1c1r s THR 134 Cb 0.00 -3.50 -0.07 0.00 0.01 0.00 0.00 72.50 68.94 1c1r s THR 134 CO 0.00 0.14 0.61 -1.10 -0.69 0.00 0.00 174.62 173.58 1c1r s GLN 135 N -0.58 4.29 0.27 4.92 -1.52 -1.26 -1.15 119.66 124.62 1c1r s GLN 135 Ca 0.56 0.82 0.03 0.00 -1.95 0.00 0.00 55.36 54.83 1c1r s GLN 135 Cb -0.39 -3.25 -0.06 0.00 -0.22 0.00 0.00 33.01 29.09 1c1r s GLN 135 CO 0.43 0.60 0.03 0.00 -0.25 0.00 0.00 175.29 176.10 1c1r s LEU 137 N -3.37 2.41 -0.04 0.00 2.96 0.82 -1.19 118.68 120.27 1c1r s LEU 137 Ca 0.33 -0.48 0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1c1r s LEU 137 Cb 0.07 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 45.21 1c1r s LEU 137 CO 0.12 0.11 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.37 1c1r s ILE 138 N 0.69 2.06 0.05 6.68 1.01 -0.04 -0.95 121.20 130.70 1c1r s ILE 138 Ca -0.08 -1.09 -0.03 0.00 0.00 0.00 0.00 60.65 59.46 1c1r s ILE 138 Cb -0.16 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 1c1r s ILE 138 CO 0.02 0.58 0.02 -0.94 0.00 0.00 0.00 174.94 174.61 1c1r s SER 139 N -0.40 0.38 0.00 3.58 1.04 -1.24 -0.65 113.70 116.42 1c1r s SER 139 Ca 0.03 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1c1r s SER 139 Cb -0.12 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.22 1c1r s SER 139 CO 0.01 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1c1r n GLY 140 N 0.26 0.76 1.46 7.32 0.00 -0.46 -4.50 105.19 110.04 1c1r n GLY 140 Ca -0.15 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.72 1c1r n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c1r n TRP 141 N -0.60 1.64 -2.06 1.61 8.01 -1.26 -2.18 117.44 122.60 1c1r n TRP 141 Ca 0.00 -1.67 -0.28 0.00 -1.31 0.00 0.00 57.50 54.24 1c1r n TRP 141 Cb 0.00 -0.62 0.16 0.00 -2.01 0.00 0.00 31.31 28.84 1c1r n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1c1r s GLY 142 N -2.19 1.75 0.35 6.99 0.00 -1.25 -4.44 107.32 108.54 1c1r s GLY 142 Ca 0.48 -1.23 -0.26 0.00 0.00 0.00 0.00 44.72 43.72 1c1r s GLY 142 CO 0.03 -0.54 0.95 -2.01 0.00 0.00 0.00 173.10 171.53 1c1r n ASN 143 N -3.52 0.99 -0.54 1.64 5.15 -0.51 -2.84 115.26 115.63 1c1r n ASN 143 Ca 0.14 1.09 0.05 0.00 -0.60 0.00 0.00 54.58 55.26 1c1r n ASN 143 Cb 0.60 -1.29 0.12 0.00 -0.53 0.00 0.00 39.78 38.68 1c1r n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1c1r n THR 144 N -0.19 0.83 -5.25 -0.44 -2.24 -0.26 0.16 114.28 106.88 1c1r n THR 144 Ca 0.10 -0.91 -0.31 0.00 -2.27 0.00 0.00 64.05 60.65 1c1r n THR 144 Cb 0.36 0.62 -0.16 0.00 -2.10 0.00 0.00 70.33 69.04 1c1r n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1c1r s LYS 145 N -0.97 2.38 0.01 -0.78 -0.14 -1.26 -4.50 119.74 114.48 1c1r s LYS 145 Ca 0.19 -0.89 -0.20 0.00 -1.36 0.00 0.00 55.97 53.71 1c1r s LYS 145 Cb 0.10 -2.09 -0.23 0.00 -1.68 0.00 0.00 37.83 33.94 1c1r s LYS 145 CO 0.14 0.42 1.11 0.77 -0.76 0.00 0.00 175.35 177.03 1c1r h SER 146 N 5.92 0.54 -3.59 2.83 0.02 -1.94 -3.37 113.55 113.95 1c1r h SER 146 Ca -0.35 -0.75 -0.66 0.00 -0.84 0.00 0.00 61.79 59.19 1c1r h SER 146 Cb 1.16 -0.16 -0.39 0.00 0.14 0.00 0.00 62.40 63.15 1c1r h SER 146 CO 0.47 1.21 -0.41 -0.44 -1.14 0.00 0.00 176.83 176.52 1c1r s SER 147 N -6.74 5.14 0.00 3.07 0.01 -1.26 -4.61 113.70 109.31 1c1r s SER 147 Ca -0.13 -3.50 0.00 0.00 1.31 0.00 0.00 55.95 53.63 1c1r s SER 147 Cb 0.04 -1.75 0.00 0.00 0.21 0.00 0.00 66.02 64.51 1c1r s SER 147 CO 0.82 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.89 1c1r n GLY 148 N 2.54 -0.31 2.76 3.44 0.00 -1.26 -5.09 105.19 107.26 1c1r n GLY 148 Ca 0.15 -1.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.30 1c1r n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c1r s THR 149 N -1.91 0.27 -0.23 2.61 2.01 -1.26 -4.60 115.64 112.53 1c1r s THR 149 Ca 0.00 0.17 -0.04 0.00 0.31 0.00 0.00 61.69 62.13 1c1r s THR 149 Cb 0.00 -0.44 0.12 0.00 0.01 0.00 0.00 72.50 72.19 1c1r s THR 149 CO 0.00 0.23 0.39 -0.55 -0.69 0.00 0.00 174.62 174.00 1c1r s SER 150 N 1.90 0.08 -0.17 3.53 0.15 -1.26 -4.97 113.70 112.95 1c1r s SER 150 Ca 0.03 0.47 -0.05 0.00 0.70 0.00 0.00 55.95 57.11 1c1r s SER 150 Cb -0.12 1.18 -0.03 0.00 -1.71 0.00 0.00 66.02 65.34 1c1r s SER 150 CO -0.04 -0.28 -0.00 -0.31 1.20 0.00 0.00 173.24 173.81 1c1r s TYR 151 N 2.56 3.08 0.55 3.44 2.02 -1.26 -1.11 117.35 126.64 1c1r s TYR 151 Ca 0.08 -0.25 -0.08 0.00 -0.37 0.00 0.00 57.07 56.46 1c1r s TYR 151 Cb -0.14 -2.02 -0.03 0.00 -0.40 0.00 0.00 41.96 39.36 1c1r s TYR 151 CO -0.15 -0.04 0.91 -1.25 -1.57 0.00 0.00 175.55 173.45 1c1r s PRO 152 N 0.53 3.51 -0.05 -1.71 0.04 -1.26 -5.01 135.00 131.05 1c1r s PRO 152 Ca -0.01 0.43 0.20 0.00 0.04 0.00 0.00 61.00 61.67 1c1r s PRO 152 Cb -0.14 -2.23 -0.31 0.00 0.04 0.00 0.00 34.50 31.86 1c1r s PRO 152 CO 0.02 -0.41 0.41 -0.25 0.04 0.00 0.00 177.00 176.80 1c1r n ASP 153 N -2.51 0.29 -4.71 6.66 8.00 -1.26 -4.91 116.55 118.12 1c1r n ASP 153 Ca 0.03 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.30 1c1r n ASP 153 Cb 0.55 1.83 -0.06 0.00 -0.02 0.00 0.00 41.12 43.41 1c1r n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1c1r s VAL 154 N -3.32 3.84 0.22 2.53 -7.23 -1.26 -0.51 120.40 114.68 1c1r s VAL 154 Ca -0.08 -1.61 -0.30 0.00 -1.81 0.00 0.00 61.98 58.18 1c1r s VAL 154 Cb 0.12 -3.03 -0.10 0.00 0.56 0.00 0.00 36.38 33.94 1c1r s VAL 154 CO 0.85 -0.29 1.41 -0.22 -0.31 0.00 0.00 175.10 176.54 1c1r s LEU 155 N -3.51 4.39 0.05 1.32 2.96 -1.18 -4.82 118.68 117.89 1c1r s LEU 155 Ca 0.31 2.57 0.05 0.00 -0.22 0.00 0.00 54.13 56.84 1c1r s LEU 155 Cb -0.08 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1c1r s LEU 155 CO 0.21 -0.66 -0.08 -0.54 -1.32 0.00 0.00 176.35 173.97 1c1r s LYS 156 N -0.09 2.39 0.18 1.98 -0.14 -0.93 -1.75 119.74 121.38 1c1r s LYS 156 Ca 0.60 -0.85 0.10 0.00 -1.36 0.00 0.00 55.97 54.45 1c1r s LYS 156 Cb -0.40 -2.42 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 1c1r s LYS 156 CO 0.40 0.56 -0.20 0.00 -0.76 0.00 0.00 175.35 175.35 1c1r s LEU 158 N -2.75 -0.12 -0.19 0.00 2.96 0.18 -0.88 118.68 117.88 1c1r s LEU 158 Ca 0.18 0.91 -0.09 0.00 -0.22 0.00 0.00 54.13 54.91 1c1r s LEU 158 Cb -0.06 1.37 -0.05 0.00 0.50 0.00 0.00 46.19 47.95 1c1r s LEU 158 CO 0.08 -0.19 0.12 -0.54 -1.32 0.00 0.00 176.35 174.49 1c1r s LYS 159 N 1.42 4.06 -0.05 1.98 1.02 -1.26 -0.86 119.74 126.05 1c1r s LYS 159 Ca -0.10 -0.24 -0.13 0.00 0.02 0.00 0.00 55.97 55.53 1c1r s LYS 159 Cb -0.08 -3.35 0.02 0.00 -0.52 0.00 0.00 37.83 33.90 1c1r s LYS 159 CO -0.13 0.35 0.30 0.00 -0.92 0.00 0.00 175.35 174.95 1c1r s ALA 160 N 0.21 -0.75 0.35 5.17 0.00 -0.33 -4.95 121.76 121.46 1c1r s ALA 160 Ca 0.08 0.49 -0.03 0.00 0.00 0.00 0.00 51.96 52.50 1c1r s ALA 160 Cb -0.11 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1c1r s ALA 160 CO -0.01 -0.22 0.60 -1.25 0.00 0.00 0.00 175.76 174.88 1c1r s PRO 161 N -0.80 3.57 0.22 0.00 0.04 -1.26 -0.34 135.00 136.42 1c1r s PRO 161 Ca -0.09 -0.08 -0.30 0.00 0.04 0.00 0.00 61.00 60.58 1c1r s PRO 161 Cb -0.04 -2.60 -0.08 0.00 0.04 0.00 0.00 34.50 31.81 1c1r s PRO 161 CO 0.03 0.11 1.02 0.42 0.04 0.00 0.00 177.00 178.62 1c1r s ILE 162 N -2.29 3.92 0.31 0.56 1.01 -0.30 -1.75 121.20 122.66 1c1r s ILE 162 Ca 0.43 1.81 0.05 0.00 0.00 0.00 0.00 60.65 62.95 1c1r s ILE 162 Cb -0.10 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 1c1r s ILE 162 CO 0.35 0.38 0.45 -0.76 0.00 0.00 0.00 174.94 175.36 1c1r s LEU 163 N -0.90 4.07 0.64 2.97 1.43 -0.44 -0.57 118.68 125.88 1c1r s LEU 163 Ca 0.45 -0.02 -0.16 0.00 -1.03 0.00 0.00 54.13 53.36 1c1r s LEU 163 Cb -0.28 -2.85 -0.01 0.00 0.03 0.00 0.00 46.19 43.07 1c1r s LEU 163 CO 0.35 -0.32 1.14 -0.94 0.23 0.00 0.00 176.35 176.81 1c1r s SER 164 N -4.10 5.11 0.42 2.29 1.04 -1.26 -4.64 113.70 112.55 1c1r s SER 164 Ca 0.41 2.13 0.13 0.00 0.48 0.00 0.00 55.95 59.09 1c1r s SER 164 Cb -0.09 -2.57 0.90 0.00 0.10 0.00 0.00 66.02 64.36 1c1r s SER 164 CO 0.31 -1.63 1.95 0.44 0.98 0.00 0.00 173.24 175.29 1c1r h ASP 165 N 0.31 0.08 -0.52 7.02 3.32 -1.97 -2.49 116.42 122.17 1c1r h ASP 165 Ca -0.48 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.55 1c1r h ASP 165 Cb 1.26 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 1c1r h ASP 165 CO 0.54 0.27 0.29 0.77 -1.72 0.00 0.00 179.24 179.38 1c1r h SER 166 N 0.08 0.65 0.83 6.45 4.64 -1.99 0.75 113.55 124.96 1c1r h SER 166 Ca 0.02 -0.09 -0.11 0.00 -0.47 0.00 0.00 61.79 61.14 1c1r h SER 166 Cb 0.36 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 1c1r h SER 166 CO 0.02 0.55 -0.52 0.77 -0.87 0.00 0.00 176.83 176.79 1c1r h SER 167 N 0.70 0.00 -0.02 4.97 4.64 -1.87 -1.53 113.55 120.43 1c1r h SER 167 Ca 0.18 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 1c1r h SER 167 Cb 0.05 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1c1r h SER 167 CO -0.03 0.52 -0.02 0.00 -0.87 0.00 0.00 176.83 176.43 1c1r h LYS 169 N -0.40 0.09 -0.10 0.00 1.57 -0.79 -2.30 116.57 114.63 1c1r h LYS 169 Ca 0.00 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 1c1r h LYS 169 Cb 0.50 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1c1r h LYS 169 CO 0.01 0.45 -0.52 0.77 -0.57 0.00 0.00 179.45 179.58 1c1r h SER 170 N 0.08 0.31 0.10 0.86 0.02 -1.30 -2.64 113.55 110.98 1c1r h SER 170 Ca 0.01 -0.16 -0.18 0.00 -0.84 0.00 0.00 61.79 60.62 1c1r h SER 170 Cb 0.69 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 1c1r h SER 170 CO 0.05 0.78 -0.64 0.00 -1.14 0.00 0.00 176.83 175.87 1c1r h ALA 171 N 1.23 0.62 -2.19 3.77 0.00 -1.20 -3.37 119.26 118.12 1c1r h ALA 171 Ca 0.01 -0.56 -0.59 0.00 0.00 0.00 0.00 54.91 53.77 1c1r h ALA 171 Cb 1.00 -0.07 -0.41 0.00 0.00 0.00 0.00 17.79 18.31 1c1r h ALA 171 CO 0.08 0.72 -0.74 0.66 0.00 0.00 0.00 179.25 179.97 1c1r n TYR 172 N -3.91 2.41 -1.67 0.00 4.02 -0.90 -4.99 117.16 112.12 1c1r n TYR 172 Ca -0.04 -3.98 -0.46 0.00 -0.01 0.00 0.00 57.90 53.41 1c1r n TYR 172 Cb 0.66 -0.48 -0.04 0.00 -0.02 0.00 0.00 39.34 39.46 1c1r n TYR 172 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1c1r n PRO 173 N 1.11 2.08 -1.01 -0.72 -0.02 -1.00 -1.75 135.00 133.68 1c1r n PRO 173 Ca 0.27 0.75 -0.00 0.00 -2.02 0.00 0.00 63.50 62.49 1c1r n PRO 173 Cb 0.44 -2.47 -0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1c1r n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1c1r n GLY 174 N 2.94 0.19 0.00 -1.23 0.00 -1.26 -4.84 105.19 101.00 1c1r n GLY 174 Ca 0.15 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.20 1c1r n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1c1r n GLN 175 N -0.31 3.45 -3.56 1.61 6.02 -0.72 -5.00 117.38 118.87 1c1r n GLN 175 Ca -0.00 -0.02 -0.37 0.00 -0.01 0.00 0.00 57.00 56.60 1c1r n GLN 175 Cb 0.35 -0.93 -0.07 0.00 1.02 0.00 0.00 30.24 30.61 1c1r n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1c1r s ILE 176 N -1.90 5.30 0.56 5.09 -1.09 -1.25 -5.02 121.20 122.88 1c1r s ILE 176 Ca 0.01 0.55 0.05 0.00 -2.23 0.00 0.00 60.65 59.03 1c1r s ILE 176 Cb 0.05 -3.62 0.04 0.00 -1.58 0.00 0.00 42.46 37.35 1c1r s ILE 176 CO 0.30 0.42 0.40 0.42 -1.23 0.00 0.00 174.94 175.24 1c1r s THR 177 N 0.24 1.54 -1.38 2.92 -4.23 -1.26 -5.00 115.64 108.47 1c1r s THR 177 Ca 0.17 -1.52 0.19 0.00 -1.18 0.00 0.00 61.69 59.36 1c1r s THR 177 Cb -0.13 -2.06 0.31 0.00 1.34 0.00 0.00 72.50 71.97 1c1r s THR 177 CO 0.05 0.00 1.60 -1.54 -0.54 0.00 0.00 174.62 174.18 1c1r n SER 178 N -1.78 0.00 -1.39 3.99 3.41 -1.26 -2.59 113.62 114.01 1c1r n SER 178 Ca -0.03 0.07 0.09 0.00 -0.26 0.00 0.00 58.87 58.75 1c1r n SER 178 Cb 0.64 -0.31 0.32 0.00 -0.26 0.00 0.00 64.21 64.60 1c1r n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c1r n ASN 179 N -1.31 4.07 -4.15 4.04 3.02 -1.26 -4.91 115.26 114.76 1c1r n ASN 179 Ca 0.09 -2.25 -0.11 0.00 -0.03 0.00 0.00 54.58 52.27 1c1r n ASN 179 Cb 0.16 -0.51 -0.10 0.00 -0.61 0.00 0.00 39.78 38.72 1c1r n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1c1r s MET 180 N -1.55 0.77 0.07 3.52 -1.94 -1.07 -1.02 119.30 118.08 1c1r s MET 180 Ca 0.46 -1.20 -0.13 0.00 -1.71 0.00 0.00 55.69 53.11 1c1r s MET 180 Cb 0.27 -0.25 0.02 0.00 2.01 0.00 0.00 34.83 36.88 1c1r s MET 180 CO 0.25 0.01 0.29 -0.59 -0.01 0.00 0.00 175.02 174.97 1c1r s PHE 181 N -3.04 -0.07 0.10 -0.03 -0.12 -0.62 -4.79 117.98 109.42 1c1r s PHE 181 Ca 0.07 -0.16 0.05 0.00 -0.05 0.00 0.00 56.93 56.83 1c1r s PHE 181 Cb 0.01 0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.45 1c1r s PHE 181 CO -0.03 -0.54 0.02 0.00 -0.05 0.00 0.00 175.22 174.61 1c1r s ALA 183 N -1.39 -0.50 0.00 0.00 0.00 -0.93 -1.33 121.76 117.61 1c1r s ALA 183 Ca 0.27 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1c1r s ALA 183 Cb -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.00 1c1r s ALA 183 CO 0.19 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1c1r n GLY 184 N 1.75 0.71 2.81 0.00 0.00 -0.72 -2.67 105.19 107.07 1c1r n GLY 184 Ca -0.20 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 43.95 1c1r n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c1r s TYR 184 N -3.82 1.20 0.49 1.61 1.51 -1.26 -4.36 117.35 112.73 1c1r s TYR 184 Ca 0.00 -0.74 0.29 0.00 -1.01 0.00 0.00 57.07 55.61 1c1r s TYR 184 Cb 0.00 -1.08 1.64 0.00 -0.11 0.00 0.00 41.96 42.41 1c1r s TYR 184 CO 0.00 -0.53 2.16 -0.07 -1.11 0.00 0.00 175.55 176.00 1c1r h LEU 185 N 8.22 0.00 -1.85 -1.29 3.38 -1.95 -0.84 115.31 120.98 1c1r h LEU 185 Ca -0.21 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1c1r h LEU 185 Cb 1.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1c1r h LEU 185 CO 0.34 0.06 -0.11 1.05 0.09 0.00 0.00 178.44 179.88 1c1r h GLU 186 N 0.00 0.00 0.00 1.13 9.09 -1.95 0.26 114.58 123.11 1c1r h GLU 186 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1c1r h GLU 186 Cb 0.19 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.29 1c1r h GLU 186 CO 0.01 0.11 0.00 0.41 0.05 0.00 0.00 179.01 179.59 1c1r n GLY 187 N -0.53 -2.72 1.31 1.06 0.00 -0.32 -4.35 105.19 99.64 1c1r n GLY 187 Ca -0.01 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1c1r n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1r n GLY 188 N -0.06 2.55 3.01 -0.02 0.00 0.04 -4.88 105.19 105.82 1c1r n GLY 188 Ca 0.00 -0.42 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 1c1r n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1r s LYS 188 N 0.00 1.71 0.06 1.61 1.02 -1.26 -3.55 119.74 119.33 1c1r s LYS 188 Ca 0.00 -0.40 -0.28 0.00 0.02 0.00 0.00 55.97 55.31 1c1r s LYS 188 Cb 0.00 -1.46 0.09 0.00 -0.52 0.00 0.00 37.83 35.94 1c1r s LYS 188 CO 0.00 -0.02 1.15 0.34 -0.92 0.00 0.00 175.35 175.90 1c1r s ASP 189 N 0.83 -0.09 0.69 2.83 3.68 -0.88 -4.27 116.67 119.46 1c1r s ASP 189 Ca -0.11 -0.29 0.01 0.00 2.13 0.00 0.00 52.55 54.29 1c1r s ASP 189 Cb -0.15 0.31 0.12 0.00 -1.45 0.00 0.00 42.92 41.74 1c1r s ASP 189 CO 0.02 -0.58 0.95 -0.94 0.13 0.00 0.00 175.17 174.75 1c1r s SER 190 N -3.07 4.51 0.39 -0.34 1.04 -1.26 -0.96 113.70 114.01 1c1r s SER 190 Ca 0.15 -0.43 -0.15 0.00 0.48 0.00 0.00 55.95 56.01 1c1r s SER 190 Cb 0.02 -0.01 0.05 0.00 0.10 0.00 0.00 66.02 66.18 1c1r s SER 190 CO -0.01 -1.75 0.78 0.00 0.98 0.00 0.00 173.24 173.24 1c1r n GLN 192 N -0.53 2.59 0.00 0.00 10.64 -1.26 -1.00 117.38 127.81 1c1r n GLN 192 Ca -0.08 0.92 0.00 0.00 -1.83 0.00 0.00 57.00 56.01 1c1r n GLN 192 Cb 0.60 -2.67 0.00 0.00 -0.86 0.00 0.00 30.24 27.31 1c1r n GLN 192 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1c1r n GLY 193 N 1.95 2.12 0.14 2.61 0.00 -1.26 -1.42 105.19 109.32 1c1r n GLY 193 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1c1r n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1c1r h ASP 194 N 0.66 0.00 -0.77 1.61 3.45 -1.38 -3.34 116.42 116.66 1c1r h ASP 194 Ca 0.00 -0.04 -0.60 0.00 0.43 0.00 0.00 57.03 56.81 1c1r h ASP 194 Cb 0.00 0.00 0.04 0.00 -0.56 0.00 0.00 39.33 38.81 1c1r h ASP 194 CO 0.00 0.02 0.04 -1.20 -1.57 0.00 0.00 179.24 176.53 1c1r n SER 195 N -2.64 -0.03 0.00 6.45 7.64 -1.24 -0.60 113.62 123.20 1c1r n SER 195 Ca 0.03 0.89 0.00 0.00 1.01 0.00 0.00 58.87 60.80 1c1r n SER 195 Cb 0.50 -0.71 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 1c1r n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1r n GLY 196 N 1.16 2.91 3.66 0.23 0.00 -0.09 -0.63 105.19 112.42 1c1r n GLY 196 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1c1r n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c1r s GLY 197 N -1.75 1.56 0.41 -0.02 0.00 0.23 -3.65 107.32 104.10 1c1r s GLY 197 Ca 0.00 -0.38 -0.19 0.00 0.00 0.00 0.00 44.72 44.14 1c1r s GLY 197 CO 0.00 0.25 0.90 2.56 0.00 0.00 0.00 173.10 176.81 1c1r s PRO 198 N -4.94 4.17 -0.23 2.90 0.04 -1.26 -0.93 135.00 134.74 1c1r s PRO 198 Ca 0.66 1.01 -0.01 0.00 0.04 0.00 0.00 61.00 62.69 1c1r s PRO 198 Cb -0.19 -2.24 0.07 0.00 0.04 0.00 0.00 34.50 32.18 1c1r s PRO 198 CO 0.58 0.01 0.03 0.08 0.04 0.00 0.00 177.00 177.74 1c1r s VAL 199 N -2.15 0.87 -0.14 -0.36 1.01 -0.73 -3.60 120.40 115.30 1c1r s VAL 199 Ca 0.60 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 1c1r s VAL 199 Cb -0.09 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 1c1r s VAL 199 CO 0.15 -0.30 -0.10 -0.69 0.00 0.00 0.00 175.10 174.16 1c1r s VAL 200 N 1.68 3.36 -0.06 2.92 1.01 -0.13 -0.98 120.40 128.19 1c1r s VAL 200 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1c1r s VAL 200 Cb -0.18 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.79 1c1r s VAL 200 CO -0.12 0.51 -0.04 0.00 0.00 0.00 0.00 175.10 175.46 1c1r n SER 202 N 4.43 -5.31 0.00 0.00 7.64 -1.26 -2.31 113.62 116.81 1c1r n SER 202 Ca -0.19 -0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.51 1c1r n SER 202 Cb 0.51 -4.36 0.00 0.00 -1.01 0.00 0.00 64.21 59.35 1c1r n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1r n GLY 203 N -1.25 0.72 3.28 0.23 0.00 -1.26 -5.04 105.19 101.87 1c1r n GLY 203 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.66 1c1r n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1r s LYS 204 N -0.22 1.11 -0.49 1.61 -0.14 -0.98 -4.23 119.74 116.41 1c1r s LYS 204 Ca 0.00 -1.16 -0.28 0.00 -1.36 0.00 0.00 55.97 53.17 1c1r s LYS 204 Cb 0.00 -1.36 0.03 0.00 -1.68 0.00 0.00 37.83 34.81 1c1r s LYS 204 CO 0.00 0.32 1.10 -1.17 -0.76 0.00 0.00 175.35 174.84 1c1r s LEU 209 N -1.92 3.69 -0.05 3.17 2.96 -0.21 -1.64 118.68 124.68 1c1r s LEU 209 Ca 0.06 0.37 0.15 0.00 -0.22 0.00 0.00 54.13 54.49 1c1r s LEU 209 Cb -0.10 -3.45 -0.23 0.00 0.50 0.00 0.00 46.19 42.90 1c1r s LEU 209 CO 0.04 -1.24 0.28 0.00 -1.32 0.00 0.00 176.35 174.11 1c1r n GLN 210 N 7.78 0.76 -4.08 1.98 1.13 -0.16 -4.17 117.38 120.62 1c1r n GLN 210 Ca 0.11 -0.11 -0.10 0.00 -1.94 0.00 0.00 57.00 54.95 1c1r n GLN 210 Cb 0.49 -1.38 -0.08 0.00 0.11 0.00 0.00 30.24 29.37 1c1r n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1c1r s GLY 211 N -4.10 0.89 -0.05 1.08 0.00 -0.92 -2.06 107.32 102.15 1c1r s GLY 211 Ca -0.06 -1.25 0.02 0.00 0.00 0.00 0.00 44.72 43.43 1c1r s GLY 211 CO 0.66 -1.07 -0.11 -0.42 0.00 0.00 0.00 173.10 172.15 1c1r s ILE 212 N -4.05 1.04 -0.07 0.90 1.01 -1.10 -1.78 121.20 117.15 1c1r s ILE 212 Ca 0.26 -0.45 -0.29 0.00 0.00 0.00 0.00 60.65 60.17 1c1r s ILE 212 Cb 0.04 -0.95 -0.07 0.00 0.01 0.00 0.00 42.46 41.50 1c1r s ILE 212 CO 0.06 0.33 1.94 -0.69 0.00 0.00 0.00 174.94 176.58 1c1r s VAL 213 N 0.50 3.17 0.00 2.92 1.01 -0.11 -1.73 120.40 126.17 1c1r s VAL 213 Ca -0.11 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 1c1r s VAL 213 Cb -0.14 -3.16 -0.00 0.00 0.00 0.00 0.00 36.38 33.08 1c1r s VAL 213 CO 0.03 -0.05 -0.01 -0.24 0.00 0.00 0.00 175.10 174.83 1c1r n SER 214 N 8.59 0.13 -2.20 3.32 2.88 -1.10 -0.91 113.62 124.33 1c1r n SER 214 Ca 0.22 0.02 -0.08 0.00 -1.33 0.00 0.00 58.87 57.70 1c1r n SER 214 Cb 0.43 -0.18 -0.01 0.00 -0.75 0.00 0.00 64.21 63.70 1c1r n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1c1r n TRP 215 N -2.62 -1.37 -2.96 0.66 4.27 -0.81 -4.94 117.44 109.67 1c1r n TRP 215 Ca -0.00 -1.36 0.00 0.00 -3.89 0.00 0.00 57.50 52.25 1c1r n TRP 215 Cb 0.02 0.44 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 1c1r n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1c1r n GLY 216 N -0.35 -1.24 3.14 -1.67 0.00 -1.26 -0.58 105.19 103.24 1c1r n GLY 216 Ca -0.02 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 1c1r n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1c1r s SER 217 N -3.92 5.03 0.95 1.61 0.15 -1.26 -5.00 113.70 111.26 1c1r s SER 217 Ca 0.00 -1.62 0.00 0.00 0.70 0.00 0.00 55.95 55.03 1c1r s SER 217 Cb 0.00 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 1c1r s SER 217 CO 0.00 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.67 1c1r n GLY 219 N 4.59 0.93 2.90 9.45 0.00 -1.26 -4.59 105.19 117.21 1c1r n GLY 219 Ca -0.08 -0.68 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 1c1r n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1r n ALA 221 N 3.42 -0.63 -2.12 0.00 0.00 -1.26 -4.56 120.51 115.36 1c1r n ALA 221 Ca -0.17 0.16 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1c1r n ALA 221 Cb 0.57 -1.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.06 1c1r n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1c1r s GLN 221 N -4.85 3.80 0.34 0.00 -1.52 -1.26 -0.78 119.66 115.39 1c1r s GLN 221 Ca 0.00 0.55 -0.28 0.00 -1.95 0.00 0.00 55.36 53.68 1c1r s GLN 221 Cb 0.00 -2.34 -0.10 0.00 -0.22 0.00 0.00 33.01 30.35 1c1r s GLN 221 CO 0.00 -0.09 1.27 0.21 -0.25 0.00 0.00 175.29 176.43 1c1r s LYS 222 N -3.94 4.34 -1.55 2.91 2.20 -1.26 -2.72 119.74 119.72 1c1r s LYS 222 Ca 0.53 2.13 0.00 0.00 -0.36 0.00 0.00 55.97 58.26 1c1r s LYS 222 Cb -0.10 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 1c1r s LYS 222 CO 0.32 -0.17 0.00 0.09 -0.36 0.00 0.00 175.35 175.23 1c1r n ASN 223 N 0.73 -4.27 -3.35 1.43 3.02 0.92 -4.89 115.26 108.86 1c1r n ASN 223 Ca 0.00 0.30 -0.26 0.00 -0.03 0.00 0.00 54.58 54.60 1c1r n ASN 223 Cb 0.43 -3.80 -0.08 0.00 -0.61 0.00 0.00 39.78 35.72 1c1r n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1c1r n LYS 224 N -2.29 1.12 -0.97 3.52 4.76 -1.10 -4.74 118.16 118.46 1c1r n LYS 224 Ca -0.16 -3.66 -0.29 0.00 -2.87 0.00 0.00 58.31 51.33 1c1r n LYS 224 Cb 0.55 -1.65 0.19 0.00 -1.84 0.00 0.00 35.03 32.29 1c1r n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1c1r s PRO 225 N -1.25 0.14 0.47 1.97 0.04 -1.26 -4.35 135.00 130.77 1c1r s PRO 225 Ca 0.35 0.69 -0.19 0.00 0.04 0.00 0.00 61.00 61.88 1c1r s PRO 225 Cb 0.12 -1.69 -0.09 0.00 0.04 0.00 0.00 34.50 32.87 1c1r s PRO 225 CO -0.11 -2.97 0.97 0.20 0.04 0.00 0.00 177.00 175.13 1c1r s GLY 226 N -3.15 2.27 -0.09 0.56 0.00 -1.09 -4.58 107.32 101.25 1c1r s GLY 226 Ca 0.66 0.34 0.03 0.00 0.00 0.00 0.00 44.72 45.75 1c1r s GLY 226 CO 0.60 0.62 -0.17 0.14 0.00 0.00 0.00 173.10 174.29 1c1r s VAL 227 N -2.33 2.77 0.09 1.40 1.01 0.26 -2.19 120.40 121.40 1c1r s VAL 227 Ca 0.61 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.89 1c1r s VAL 227 Cb -0.10 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 1c1r s VAL 227 CO 0.21 0.56 -0.22 -0.31 0.00 0.00 0.00 175.10 175.34 1c1r s TYR 228 N -0.10 1.91 0.15 5.22 2.02 0.47 -1.92 117.35 125.09 1c1r s TYR 228 Ca -0.03 -0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 55.97 1c1r s TYR 228 Cb -0.14 -1.07 -0.07 0.00 -0.40 0.00 0.00 41.96 40.28 1c1r s TYR 228 CO 0.04 0.20 1.17 0.99 -1.57 0.00 0.00 175.55 176.38 1c1r s THR 229 N -1.04 3.77 -1.04 -0.71 2.01 -0.71 -1.58 115.64 116.34 1c1r s THR 229 Ca 0.08 1.43 -0.18 0.00 0.31 0.00 0.00 61.69 63.33 1c1r s THR 229 Cb -0.10 -3.92 0.12 0.00 0.01 0.00 0.00 72.50 68.62 1c1r s THR 229 CO 0.04 0.20 1.30 -0.75 -0.69 0.00 0.00 174.62 174.72 1c1r s LYS 230 N 0.08 3.74 0.44 4.92 2.20 -0.19 -2.71 119.74 128.22 1c1r s LYS 230 Ca 0.53 -1.84 0.19 0.00 -0.36 0.00 0.00 55.97 54.50 1c1r s LYS 230 Cb -0.31 -5.08 1.15 0.00 -1.51 0.00 0.00 37.83 32.08 1c1r s LYS 230 CO 0.34 -1.89 1.89 0.28 -0.36 0.00 0.00 175.35 175.61 1c1r h VAL 231 N 5.73 0.70 -0.01 4.02 2.07 -1.73 -2.18 116.25 124.85 1c1r h VAL 231 Ca 0.22 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1c1r h VAL 231 Cb 0.98 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1c1r h VAL 231 CO 1.22 0.06 0.07 0.00 0.02 0.00 0.00 177.57 178.95 1c1r n ASN 233 N -3.13 0.22 -0.37 0.00 3.02 -0.82 -3.99 115.26 110.20 1c1r n ASN 233 Ca -0.03 0.09 0.03 0.00 -0.03 0.00 0.00 54.58 54.64 1c1r n ASN 233 Cb 0.14 -0.20 0.08 0.00 -0.61 0.00 0.00 39.78 39.19 1c1r n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1c1r n TYR 234 N -1.41 0.24 -0.21 3.10 4.01 0.11 -4.76 117.16 118.24 1c1r n TYR 234 Ca 0.08 -0.43 -0.04 0.00 -0.16 0.00 0.00 57.90 57.35 1c1r n TYR 234 Cb 0.32 -0.03 0.06 0.00 -0.31 0.00 0.00 39.34 39.38 1c1r n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1c1r h VAL 235 N 1.24 1.07 -0.57 -0.72 2.07 -1.68 0.90 116.25 118.56 1c1r h VAL 235 Ca 0.00 -0.25 -0.08 0.00 0.82 0.00 0.00 66.70 67.19 1c1r h VAL 235 Cb 0.59 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1c1r h VAL 235 CO 0.00 0.13 0.02 0.77 0.02 0.00 0.00 177.57 178.52 1c1r h SER 236 N 0.73 0.94 -0.13 0.57 4.64 -1.90 -0.66 113.55 117.76 1c1r h SER 236 Ca 0.25 -0.24 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1c1r h SER 236 Cb 0.03 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.86 1c1r h SER 236 CO -0.11 0.99 0.06 -0.25 -0.87 0.00 0.00 176.83 176.65 1c1r h TRP 237 N 0.90 0.18 0.10 4.77 7.01 -1.78 -0.06 115.95 127.08 1c1r h TRP 237 Ca 0.17 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.16 1c1r h TRP 237 Cb 0.49 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.49 1c1r h TRP 237 CO 0.03 0.23 -0.09 0.82 -2.79 0.00 0.00 178.44 176.64 1c1r h ILE 238 N 0.08 0.79 -0.80 2.65 2.04 -0.53 -0.44 117.51 121.29 1c1r h ILE 238 Ca 0.04 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.94 1c1r h ILE 238 Cb 0.11 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 36.93 1c1r h ILE 238 CO -0.01 0.00 0.51 0.11 0.00 0.00 0.00 178.15 178.76 1c1r h LYS 239 N -0.21 0.95 -0.34 2.37 1.57 -1.00 -0.82 116.57 119.09 1c1r h LYS 239 Ca 0.00 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 1c1r h LYS 239 Cb 0.20 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1c1r h LYS 239 CO -0.02 0.63 -0.13 1.96 -0.57 0.00 0.00 179.45 181.32 1c1r h GLN 240 N 0.98 0.69 -0.27 3.15 4.20 -0.84 -2.52 115.11 120.50 1c1r h GLN 240 Ca 0.32 -0.29 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 1c1r h GLN 240 Cb 0.03 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1c1r h GLN 240 CO -0.12 0.88 -0.02 1.15 -0.67 0.00 0.00 178.83 180.04 1c1r h THR 241 N 0.47 1.27 -0.07 -0.54 2.02 -0.79 -2.69 112.91 112.58 1c1r h THR 241 Ca 0.08 -0.98 -0.10 0.00 0.77 0.00 0.00 66.41 66.18 1c1r h THR 241 Cb 0.65 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1c1r h THR 241 CO 0.04 0.31 -0.43 0.16 0.37 0.00 0.00 175.52 175.97 1c1r h ILE 242 N 0.25 1.32 0.00 3.11 3.07 -1.20 -2.45 117.51 121.62 1c1r h ILE 242 Ca 0.07 -1.54 0.00 0.00 1.55 0.00 0.00 64.86 64.94 1c1r h ILE 242 Cb 0.46 1.74 0.00 0.00 -0.27 0.00 0.00 36.82 38.76 1c1r h ILE 242 CO 0.02 0.45 0.00 0.00 -1.05 0.00 0.00 178.15 177.57 1c1r h ALA 243 N 1.43 1.00 -0.39 0.16 0.00 -1.38 -3.05 119.26 117.03 1c1r h ALA 243 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1c1r h ALA 243 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1c1r h ALA 243 CO 0.06 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.74 1c1r n SER 244 N -2.75 3.72 0.00 0.00 7.64 -0.95 -5.10 113.62 116.18 1c1r n SER 244 Ca 0.02 -2.46 0.00 0.00 1.01 0.00 0.00 58.87 57.44 1c1r n SER 244 Cb 0.34 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 1c1r n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62