#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c1s s VAL 17 N 0.00 3.18 -0.51 1.39 1.01 -0.38 -3.98 120.40 121.11 1c1s s VAL 17 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1c1s s VAL 17 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 34.03 1c1s s VAL 17 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1c1s n GLY 18 N 3.56 0.68 0.00 4.51 0.00 -1.25 -1.87 105.19 110.82 1c1s n GLY 18 Ca -0.18 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1c1s n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1s n GLY 19 N -2.20 2.38 3.39 -0.02 0.00 -1.26 -4.87 105.19 102.60 1c1s n GLY 19 Ca -0.05 -2.10 -0.19 0.00 0.00 0.00 0.00 46.02 43.68 1c1s n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c1s s TYR 20 N 1.18 1.76 -0.12 1.61 -0.85 0.45 -4.91 117.35 116.47 1c1s s TYR 20 Ca 0.00 -1.07 -0.30 0.00 -0.52 0.00 0.00 57.07 55.18 1c1s s TYR 20 Cb 0.00 -1.10 -0.01 0.00 0.38 0.00 0.00 41.96 41.23 1c1s s TYR 20 CO 0.00 -0.17 1.11 0.99 -1.52 0.00 0.00 175.55 175.96 1c1s s THR 21 N -3.52 4.54 0.10 -3.49 2.01 -1.26 -0.67 115.64 113.34 1c1s s THR 21 Ca 0.37 1.84 -0.25 0.00 0.31 0.00 0.00 61.69 63.96 1c1s s THR 21 Cb 0.08 -4.18 -0.12 0.00 0.01 0.00 0.00 72.50 68.29 1c1s s THR 21 CO 0.15 -0.05 1.69 0.00 -0.69 0.00 0.00 174.62 175.72 1c1s n GLY 23 N -1.25 3.60 3.70 0.00 0.00 -1.26 -4.84 105.19 105.14 1c1s n GLY 23 Ca -0.07 -1.59 -0.44 0.00 0.00 0.00 0.00 46.02 43.92 1c1s n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1s n ALA 24 N -0.66 1.96 -4.24 4.61 0.00 -1.26 -2.50 120.51 118.42 1c1s n ALA 24 Ca 0.00 0.40 -0.36 0.00 0.00 0.00 0.00 53.44 53.48 1c1s n ALA 24 Cb 0.00 -2.40 -0.03 0.00 0.00 0.00 0.00 19.45 17.02 1c1s n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1c1s n ASN 25 N 2.76 -3.18 0.01 0.00 4.13 -1.26 -4.86 115.26 112.86 1c1s n ASN 25 Ca 0.13 -1.02 0.11 0.00 1.68 0.00 0.00 54.58 55.47 1c1s n ASN 25 Cb 0.33 -2.71 0.08 0.00 -1.54 0.00 0.00 39.78 35.95 1c1s n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1c1s n THR 26 N -4.37 0.08 -3.64 3.41 -2.24 -1.04 -4.34 114.28 102.14 1c1s n THR 26 Ca 0.07 -0.10 -0.27 0.00 -2.27 0.00 0.00 64.05 61.47 1c1s n THR 26 Cb 0.49 0.38 -0.10 0.00 -2.10 0.00 0.00 70.33 69.00 1c1s n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1c1s n VAL 27 N -1.70 1.88 0.38 2.28 0.31 -1.26 -4.96 118.33 115.25 1c1s n VAL 27 Ca 0.04 -4.99 0.13 0.00 -0.01 0.00 0.00 64.34 59.51 1c1s n VAL 27 Cb 0.38 -2.13 0.53 0.00 -0.91 0.00 0.00 33.84 31.71 1c1s n VAL 27 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1c1s h PRO 28 N 4.77 0.00 -0.02 5.55 0.11 -1.81 -2.43 132.00 138.16 1c1s h PRO 28 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1c1s h PRO 28 Cb 0.71 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1c1s h PRO 28 CO 0.76 0.00 -0.08 2.48 -0.21 0.00 0.00 178.00 180.95 1c1s n TYR 29 N -2.42 0.00 -2.75 0.65 0.18 -1.20 -2.17 117.16 109.45 1c1s n TYR 29 Ca 0.02 0.00 -0.40 0.00 1.88 0.00 0.00 57.90 59.40 1c1s n TYR 29 Cb 0.25 -0.02 -0.06 0.00 -0.38 0.00 0.00 39.34 39.13 1c1s n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1c1s s GLN 30 N -2.12 4.81 0.21 -3.48 2.00 -0.92 -0.70 119.66 119.46 1c1s s GLN 30 Ca 0.32 1.47 0.06 0.00 -2.00 0.00 0.00 55.36 55.21 1c1s s GLN 30 Cb 0.20 -3.30 -0.05 0.00 0.80 0.00 0.00 33.01 30.66 1c1s s GLN 30 CO 0.38 0.45 -0.10 0.08 -0.50 0.00 0.00 175.29 175.60 1c1s s VAL 31 N -0.89 1.48 -0.11 1.34 1.01 -0.12 -4.51 120.40 118.60 1c1s s VAL 31 Ca 0.42 -2.13 0.03 0.00 0.00 0.00 0.00 61.98 60.30 1c1s s VAL 31 Cb -0.25 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.01 1c1s s VAL 31 CO 0.31 -0.54 -0.22 -0.55 0.00 0.00 0.00 175.10 174.11 1c1s s SER 32 N -3.30 2.93 -0.19 3.32 0.15 -0.83 -2.01 113.70 113.76 1c1s s SER 32 Ca 0.23 -0.54 -0.11 0.00 0.70 0.00 0.00 55.95 56.23 1c1s s SER 32 Cb 0.02 -1.35 -0.05 0.00 -1.71 0.00 0.00 66.02 62.93 1c1s s SER 32 CO 0.07 0.11 0.17 -0.76 1.20 0.00 0.00 173.24 174.02 1c1s s LEU 33 N 0.59 4.21 -0.06 3.45 1.43 0.07 -0.80 118.68 127.57 1c1s s LEU 33 Ca -0.13 0.28 0.04 0.00 -1.03 0.00 0.00 54.13 53.28 1c1s s LEU 33 Cb -0.17 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.90 1c1s s LEU 33 CO 0.04 0.15 -0.17 0.21 0.23 0.00 0.00 176.35 176.81 1c1s s ASN 34 N 0.43 2.21 -0.38 2.29 3.84 0.10 -1.56 114.94 121.87 1c1s s ASN 34 Ca 0.10 -0.38 0.12 0.00 0.21 0.00 0.00 52.86 52.91 1c1s s ASN 34 Cb -0.12 -0.84 0.43 0.00 -0.55 0.00 0.00 41.25 40.17 1c1s s ASN 34 CO -0.00 0.11 1.01 -1.54 -2.79 0.00 0.00 177.10 173.88 1c1s n SER 37 N 3.46 2.92 0.00 -4.21 3.41 -1.26 -1.95 113.62 115.99 1c1s n SER 37 Ca -0.20 -3.19 0.00 0.00 -0.26 0.00 0.00 58.87 55.22 1c1s n SER 37 Cb 0.52 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1c1s n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c1s n GLY 38 N -0.23 0.43 3.61 5.00 0.00 -1.26 -4.99 105.19 107.75 1c1s n GLY 38 Ca 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.18 1c1s n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c1s s TYR 39 N -2.05 -0.30 -0.04 1.61 1.13 -1.26 -5.14 117.35 111.30 1c1s s TYR 39 Ca 0.00 0.05 -0.30 0.00 -1.41 0.00 0.00 57.07 55.41 1c1s s TYR 39 Cb 0.00 0.60 -0.03 0.00 -1.10 0.00 0.00 41.96 41.43 1c1s s TYR 39 CO 0.00 -0.80 1.03 -1.58 -2.51 0.00 0.00 175.55 171.69 1c1s s HIS 40 N -3.43 3.54 0.00 -3.49 5.65 -1.26 -4.22 115.29 112.07 1c1s s HIS 40 Ca 0.07 1.57 0.00 0.00 0.25 0.00 0.00 55.06 56.95 1c1s s HIS 40 Cb -0.02 -3.21 0.00 0.00 -1.18 0.00 0.00 32.58 28.17 1c1s s HIS 40 CO -0.04 -0.35 0.00 1.97 -0.65 0.00 0.00 174.74 175.67 1c1s n PHE 41 N 4.43 0.00 -3.80 3.88 1.16 -0.60 -4.99 117.46 117.55 1c1s n PHE 41 Ca 0.08 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.57 1c1s n PHE 41 Cb 0.49 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.33 1c1s n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1c1s s GLY 43 N -2.90 2.32 0.11 0.00 0.00 0.27 -0.75 107.32 106.37 1c1s s GLY 43 Ca 0.11 -1.25 -0.25 0.00 0.00 0.00 0.00 44.72 43.33 1c1s s GLY 43 CO 0.02 -1.94 1.11 -0.32 0.00 0.00 0.00 173.10 171.96 1c1s s GLY 44 N -4.36 -0.10 -0.04 0.20 0.00 -0.85 -3.67 107.32 98.49 1c1s s GLY 44 Ca 0.35 0.02 0.03 0.00 0.00 0.00 0.00 44.72 45.13 1c1s s GLY 44 CO 0.22 1.93 -0.14 -0.56 0.00 0.00 0.00 173.10 174.55 1c1s s SER 45 N -3.28 1.83 -0.12 1.64 0.01 -0.75 -0.95 113.70 112.08 1c1s s SER 45 Ca 0.19 -0.30 -0.28 0.00 1.31 0.00 0.00 55.95 56.88 1c1s s SER 45 Cb -0.01 -0.56 -0.01 0.00 0.21 0.00 0.00 66.02 65.65 1c1s s SER 45 CO 0.02 0.11 0.93 -0.22 0.41 0.00 0.00 173.24 174.49 1c1s s LEU 46 N 0.19 4.23 -0.00 2.44 2.96 0.13 -1.70 118.68 126.93 1c1s s LEU 46 Ca -0.06 1.40 0.18 0.00 -0.22 0.00 0.00 54.13 55.43 1c1s s LEU 46 Cb -0.11 -3.43 -0.20 0.00 0.50 0.00 0.00 46.19 42.95 1c1s s LEU 46 CO 0.02 -0.40 0.70 2.30 -1.32 0.00 0.00 176.35 177.65 1c1s n ILE 47 N 4.53 0.00 -3.62 6.68 -5.35 -0.33 -0.98 119.36 120.29 1c1s n ILE 47 Ca 0.07 -0.13 0.02 0.00 -0.27 0.00 0.00 62.75 62.44 1c1s n ILE 47 Cb 0.49 0.88 -0.00 0.00 -1.74 0.00 0.00 39.64 39.27 1c1s n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1c1s s ASN 48 N -2.85 -0.03 0.58 7.28 6.03 -1.22 -4.61 114.94 120.11 1c1s s ASN 48 Ca 0.05 -0.09 0.30 0.00 -1.03 0.00 0.00 52.86 52.09 1c1s s ASN 48 Cb 0.13 0.11 1.40 0.00 -3.03 0.00 0.00 41.25 39.86 1c1s s ASN 48 CO 0.73 -0.20 1.78 0.77 -2.03 0.00 0.00 177.10 178.14 1c1s h SER 49 N 2.00 0.00 0.00 3.54 4.64 -1.96 -3.03 113.55 118.74 1c1s h SER 49 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1c1s h SER 49 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1c1s h SER 49 CO 0.29 0.00 -0.33 0.00 -0.87 0.00 0.00 176.83 175.93 1c1s n GLN 50 N -3.75 4.87 -4.77 4.77 6.02 -1.26 -0.32 117.38 122.94 1c1s n GLN 50 Ca 0.15 -0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.85 1c1s n GLN 50 Cb 0.95 -0.77 -0.14 0.00 1.02 0.00 0.00 30.24 31.29 1c1s n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1c1s s TRP 51 N -1.56 2.11 0.03 1.08 0.52 -1.15 -0.76 118.94 119.21 1c1s s TRP 51 Ca 0.02 -0.40 0.05 0.00 0.02 0.00 0.00 56.10 55.79 1c1s s TRP 51 Cb 0.04 -1.26 -0.02 0.00 -1.15 0.00 0.00 33.47 31.08 1c1s s TRP 51 CO 0.21 0.12 -0.15 0.08 0.02 0.00 0.00 176.95 177.23 1c1s s VAL 52 N -0.82 1.19 0.05 4.03 1.01 -0.59 -1.19 120.40 124.08 1c1s s VAL 52 Ca 0.10 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.21 1c1s s VAL 52 Cb -0.10 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1c1s s VAL 52 CO 0.02 0.11 -0.12 0.68 0.00 0.00 0.00 175.10 175.79 1c1s s VAL 53 N -0.71 3.24 0.00 2.92 -7.23 -0.69 -0.89 120.40 117.04 1c1s s VAL 53 Ca 0.03 -1.09 0.00 0.00 -1.81 0.00 0.00 61.98 59.12 1c1s s VAL 53 Cb -0.07 -2.43 0.00 0.00 0.56 0.00 0.00 36.38 34.44 1c1s s VAL 53 CO 0.01 0.28 0.00 -0.24 -0.31 0.00 0.00 175.10 174.84 1c1s n SER 54 N 1.27 0.00 -4.87 4.85 2.88 -0.12 -1.80 113.62 115.83 1c1s n SER 54 Ca -0.15 -0.96 -0.33 0.00 -1.33 0.00 0.00 58.87 56.10 1c1s n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1c1s n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1c1s s ALA 55 N -1.35 3.60 0.32 -1.46 0.00 -1.26 -1.23 121.76 120.38 1c1s s ALA 55 Ca 0.00 -0.28 0.14 0.00 0.00 0.00 0.00 51.96 51.81 1c1s s ALA 55 Cb 0.00 -2.41 0.67 0.00 0.00 0.00 0.00 23.12 21.38 1c1s s ALA 55 CO 0.00 0.52 1.77 0.00 0.00 0.00 0.00 175.76 178.05 1c1s h ALA 56 N 2.85 1.22 0.00 0.00 0.00 -1.70 -2.39 119.26 119.23 1c1s h ALA 56 Ca -0.47 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1c1s h ALA 56 Cb 1.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1c1s h ALA 56 CO 0.69 0.53 0.00 -2.39 0.00 0.00 0.00 179.25 178.07 1c1s n HIS 57 N -3.91 0.00 1.06 0.00 1.44 -1.26 -1.02 115.22 111.53 1c1s n HIS 57 Ca -0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.82 1c1s n HIS 57 Cb 0.46 0.00 0.15 0.00 0.12 0.00 0.00 29.99 30.72 1c1s n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1c1s n TYR 59 N 1.21 2.08 -3.45 0.00 4.19 -0.18 -4.99 117.16 116.02 1c1s n TYR 59 Ca 0.15 0.52 -0.12 0.00 3.31 0.00 0.00 57.90 61.76 1c1s n TYR 59 Cb 0.57 -2.41 -0.02 0.00 0.49 0.00 0.00 39.34 37.97 1c1s n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1c1s s LYS 60 N -1.17 1.28 0.02 2.98 1.02 -1.26 -5.15 119.74 117.46 1c1s s LYS 60 Ca 0.62 -0.51 -0.00 0.00 0.02 0.00 0.00 55.97 56.10 1c1s s LYS 60 Cb -0.63 0.58 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 1c1s s LYS 60 CO 0.56 -0.56 0.13 -1.54 -0.92 0.00 0.00 175.35 173.03 1c1s s SER 61 N -2.76 5.95 -0.13 2.83 1.04 -1.26 -4.62 113.70 114.75 1c1s s SER 61 Ca 0.02 0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.63 1c1s s SER 61 Cb -0.01 -1.76 -0.01 0.00 0.10 0.00 0.00 66.02 64.35 1c1s s SER 61 CO -0.12 0.23 0.12 0.61 0.98 0.00 0.00 173.24 175.06 1c1s n GLY 62 N 0.83 0.52 3.63 7.32 0.00 -1.26 -5.06 105.19 111.16 1c1s n GLY 62 Ca -0.10 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 1c1s n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c1s s ILE 63 N -3.04 3.89 -0.09 -0.61 1.01 -1.26 -4.60 121.20 116.50 1c1s s ILE 63 Ca 0.05 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.18 1c1s s ILE 63 Cb -0.01 -2.67 0.00 0.00 0.01 0.00 0.00 42.46 39.80 1c1s s ILE 63 CO 0.10 0.48 -0.20 -1.58 0.00 0.00 0.00 174.94 173.74 1c1s s GLN 64 N -1.19 2.62 -0.17 2.79 0.74 -0.82 -2.10 119.66 121.52 1c1s s GLN 64 Ca 0.16 -0.73 -0.12 0.00 0.05 0.00 0.00 55.36 54.71 1c1s s GLN 64 Cb -0.11 -2.02 -0.05 0.00 1.10 0.00 0.00 33.01 31.93 1c1s s GLN 64 CO 0.06 0.12 0.23 0.08 -0.55 0.00 0.00 175.29 175.23 1c1s s VAL 65 N 0.46 5.34 -0.19 1.34 1.01 0.98 -0.72 120.40 128.62 1c1s s VAL 65 Ca -0.17 0.42 -0.01 0.00 0.00 0.00 0.00 61.98 62.22 1c1s s VAL 65 Cb -0.17 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.65 1c1s s VAL 65 CO 0.07 0.41 -0.15 -0.13 0.00 0.00 0.00 175.10 175.31 1c1s s ARG 66 N 0.38 3.12 0.20 2.72 0.52 0.02 -1.02 118.95 124.89 1c1s s ARG 66 Ca 0.14 -0.76 0.07 0.00 -0.52 0.00 0.00 55.73 54.65 1c1s s ARG 66 Cb -0.12 -2.72 -0.04 0.00 0.52 0.00 0.00 34.95 32.59 1c1s s ARG 66 CO 0.02 -0.20 0.11 -0.51 0.02 0.00 0.00 175.30 174.74 1c1s s LEU 67 N 1.34 3.63 -1.16 2.53 1.02 0.33 -1.97 118.68 124.39 1c1s s LEU 67 Ca 0.05 -0.28 0.00 0.00 0.02 0.00 0.00 54.13 53.92 1c1s s LEU 67 Cb -0.13 -2.22 0.00 0.00 0.02 0.00 0.00 46.19 43.86 1c1s s LEU 67 CO -0.09 0.04 0.00 0.61 0.02 0.00 0.00 176.35 176.92 1c1s n GLY 69 N -0.57 -0.09 3.88 -3.19 0.00 -1.26 -1.32 105.19 102.64 1c1s n GLY 69 Ca -0.08 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 1c1s n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c1s s GLU 70 N -4.58 3.71 0.00 1.61 0.41 -1.26 -3.91 118.70 114.68 1c1s s GLU 70 Ca 0.00 0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.66 1c1s s GLU 70 Cb 0.00 -2.79 0.00 0.00 -1.78 0.00 0.00 34.13 29.56 1c1s s GLU 70 CO 0.00 0.42 0.00 -3.47 -0.49 0.00 0.00 175.26 171.72 1c1s n ASP 71 N 0.11 0.00 -4.46 -0.19 2.03 -1.26 -4.68 116.55 108.09 1c1s n ASP 71 Ca -0.02 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.86 1c1s n ASP 71 Cb 0.52 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.86 1c1s n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1c1s s ASN 72 N -3.71 6.25 0.00 1.67 3.84 -1.25 -3.06 114.94 118.68 1c1s s ASN 72 Ca 0.00 -0.77 0.10 0.00 0.21 0.00 0.00 52.86 52.40 1c1s s ASN 72 Cb 0.00 -2.31 0.60 0.00 -0.55 0.00 0.00 41.25 38.98 1c1s s ASN 72 CO 0.00 -0.92 1.09 2.30 -2.79 0.00 0.00 177.10 176.78 1c1s n ILE 73 N 5.72 0.15 0.65 -5.21 -5.35 0.11 -2.63 119.36 112.81 1c1s n ILE 73 Ca -0.05 0.04 0.07 0.00 -0.27 0.00 0.00 62.75 62.54 1c1s n ILE 73 Cb 0.46 -0.88 -0.09 0.00 -1.74 0.00 0.00 39.64 37.40 1c1s n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1c1s n ASN 74 N -1.06 0.76 -4.08 7.28 3.02 -1.26 -4.96 115.26 114.96 1c1s n ASN 74 Ca 0.07 -0.79 -0.29 0.00 -0.03 0.00 0.00 54.58 53.54 1c1s n ASN 74 Cb 0.04 1.05 -0.17 0.00 -0.61 0.00 0.00 39.78 40.10 1c1s n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1c1s s VAL 75 N -2.45 1.56 -0.17 2.41 1.01 -1.08 -5.09 120.40 116.59 1c1s s VAL 75 Ca 0.05 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 1c1s s VAL 75 Cb 0.11 -1.41 -0.00 0.00 0.00 0.00 0.00 36.38 35.09 1c1s s VAL 75 CO 0.61 0.45 1.04 -0.69 0.00 0.00 0.00 175.10 176.52 1c1s s VAL 76 N 0.82 4.69 -2.46 2.92 1.01 -1.26 -4.71 120.40 121.41 1c1s s VAL 76 Ca -0.10 2.00 0.21 0.00 0.00 0.00 0.00 61.98 64.09 1c1s s VAL 76 Cb -0.16 -4.29 0.12 0.00 0.00 0.00 0.00 36.38 32.06 1c1s s VAL 76 CO 0.01 -0.10 1.13 -0.62 0.00 0.00 0.00 175.10 175.52 1c1s n GLU 77 N 5.76 1.82 0.00 2.72 1.02 -1.26 -4.99 120.64 125.70 1c1s n GLU 77 Ca 0.11 -1.55 0.00 0.00 -0.02 0.00 0.00 57.16 55.69 1c1s n GLU 77 Cb 0.47 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 1c1s n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c1s n GLY 78 N 1.24 1.48 1.87 0.62 0.00 -1.26 -4.96 105.19 104.18 1c1s n GLY 78 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.11 1c1s n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c1s n ASN 79 N 0.00 4.84 -4.92 1.61 4.13 -1.26 -4.99 115.26 114.66 1c1s n ASN 79 Ca 0.00 -3.03 -0.28 0.00 1.68 0.00 0.00 54.58 52.96 1c1s n ASN 79 Cb 0.00 -0.71 -0.03 0.00 -1.54 0.00 0.00 39.78 37.50 1c1s n ASN 79 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1c1s s GLU 80 N -2.71 3.54 -0.04 3.52 8.01 -1.25 -4.27 118.70 125.48 1c1s s GLU 80 Ca 0.50 -0.28 0.01 0.00 0.01 0.00 0.00 54.97 55.21 1c1s s GLU 80 Cb 0.39 -2.80 0.02 0.00 -4.31 0.00 0.00 34.13 27.43 1c1s s GLU 80 CO 0.13 0.37 -0.03 -0.65 0.01 0.00 0.00 175.26 175.09 1c1s s GLN 81 N -3.36 0.66 -0.21 1.61 -0.21 -0.44 -4.98 119.66 112.74 1c1s s GLN 81 Ca 0.39 -0.03 -0.02 0.00 0.02 0.00 0.00 55.36 55.73 1c1s s GLN 81 Cb -0.11 -0.76 0.01 0.00 1.00 0.00 0.00 33.01 33.15 1c1s s GLN 81 CO 0.29 -0.12 -0.11 -0.06 -2.12 0.00 0.00 175.29 173.17 1c1s s PHE 82 N 1.07 2.90 -0.01 0.91 2.99 -1.26 -0.52 117.98 124.07 1c1s s PHE 82 Ca -0.09 -1.31 0.03 0.00 0.00 0.00 0.00 56.93 55.57 1c1s s PHE 82 Cb -0.14 -2.02 -0.01 0.00 0.00 0.00 0.00 43.02 40.85 1c1s s PHE 82 CO -0.01 -0.68 -0.11 0.42 -0.00 0.00 0.00 175.22 174.85 1c1s s ILE 83 N 1.38 0.85 0.44 0.64 1.01 -0.19 -4.96 121.20 120.36 1c1s s ILE 83 Ca 0.05 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.16 1c1s s ILE 83 Cb -0.14 -0.72 -0.05 0.00 0.01 0.00 0.00 42.46 41.56 1c1s s ILE 83 CO -0.07 0.24 0.78 -0.44 0.00 0.00 0.00 174.94 175.45 1c1s s SER 84 N -0.18 6.42 0.14 3.58 0.01 -1.26 -0.01 113.70 122.39 1c1s s SER 84 Ca 0.03 1.07 -0.23 0.00 1.31 0.00 0.00 55.95 58.12 1c1s s SER 84 Cb -0.05 -2.30 -0.08 0.00 0.21 0.00 0.00 66.02 63.81 1c1s s SER 84 CO -0.00 -0.48 0.71 0.00 0.41 0.00 0.00 173.24 173.88 1c1s s ALA 85 N -2.53 3.49 -0.17 1.44 0.00 -0.89 -0.38 121.76 122.72 1c1s s ALA 85 Ca 0.50 0.25 0.17 0.00 0.00 0.00 0.00 51.96 52.88 1c1s s ALA 85 Cb -0.10 -2.85 -0.25 0.00 0.00 0.00 0.00 23.12 19.92 1c1s s ALA 85 CO 0.37 0.33 0.18 -1.13 0.00 0.00 0.00 175.76 175.51 1c1s n SER 86 N 1.60 0.16 -3.55 0.00 3.41 0.42 -4.74 113.62 110.93 1c1s n SER 86 Ca -0.07 0.08 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1c1s n SER 86 Cb 0.49 0.81 -0.05 0.00 -0.26 0.00 0.00 64.21 65.20 1c1s n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1c1s s LYS 87 N -2.52 1.04 -0.03 4.33 2.20 -1.23 -5.00 119.74 118.54 1c1s s LYS 87 Ca -0.09 -0.05 0.04 0.00 -0.36 0.00 0.00 55.97 55.51 1c1s s LYS 87 Cb 0.06 0.48 -0.01 0.00 -1.51 0.00 0.00 37.83 36.86 1c1s s LYS 87 CO 0.83 -0.36 -0.16 -1.12 -0.36 0.00 0.00 175.35 174.18 1c1s s SER 88 N -1.68 1.96 -0.18 1.43 0.01 -1.26 -0.58 113.70 113.40 1c1s s SER 88 Ca -0.08 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 56.87 1c1s s SER 88 Cb -0.01 -0.43 0.04 0.00 0.21 0.00 0.00 66.02 65.83 1c1s s SER 88 CO 0.02 0.16 -0.08 -0.63 0.41 0.00 0.00 173.24 173.12 1c1s s ILE 89 N -0.09 1.39 0.04 1.44 1.01 0.04 -4.99 121.20 120.05 1c1s s ILE 89 Ca -0.00 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.71 1c1s s ILE 89 Cb -0.09 -1.50 -0.06 0.00 0.01 0.00 0.00 42.46 40.82 1c1s s ILE 89 CO 0.01 0.18 0.43 -0.69 0.00 0.00 0.00 174.94 174.87 1c1s s VAL 90 N 1.51 5.01 0.15 2.92 1.01 -1.26 -1.41 120.40 128.33 1c1s s VAL 90 Ca 0.00 0.76 -0.34 0.00 0.00 0.00 0.00 61.98 62.40 1c1s s VAL 90 Cb -0.15 -3.71 -0.15 0.00 0.00 0.00 0.00 36.38 32.36 1c1s s VAL 90 CO -0.08 0.47 1.34 1.57 0.00 0.00 0.00 175.10 178.40 1c1s n HIS 91 N 1.47 1.68 0.02 5.22 -0.00 -0.86 -4.83 115.22 117.91 1c1s n HIS 91 Ca -0.11 0.55 0.22 0.00 0.46 0.00 0.00 57.72 58.84 1c1s n HIS 91 Cb 0.52 -2.37 0.72 0.00 -0.12 0.00 0.00 29.99 28.74 1c1s n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1c1s h PRO 92 N 4.41 0.00 -0.37 1.57 0.13 -1.95 -1.52 132.00 134.27 1c1s h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1c1s h PRO 92 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1c1s h PRO 92 CO 0.77 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.97 1c1s n SER 93 N -3.86 4.20 -4.73 1.44 7.64 -1.26 -5.01 113.62 112.03 1c1s n SER 93 Ca 0.10 -2.82 -0.42 0.00 1.01 0.00 0.00 58.87 56.74 1c1s n SER 93 Cb 0.73 -0.54 -0.03 0.00 -1.01 0.00 0.00 64.21 63.37 1c1s n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1c1s s TYR 94 N -2.50 3.06 -0.29 1.43 6.14 -0.58 -4.69 117.35 119.93 1c1s s TYR 94 Ca 0.43 0.89 0.00 0.00 0.64 0.00 0.00 57.07 59.03 1c1s s TYR 94 Cb 0.33 -3.83 0.06 0.00 0.42 0.00 0.00 41.96 38.93 1c1s s TYR 94 CO 0.12 -2.86 -0.03 1.21 0.64 0.00 0.00 175.55 174.63 1c1s s ASN 95 N 0.70 4.74 0.00 4.32 3.84 -0.95 -4.99 114.94 122.59 1c1s s ASN 95 Ca 0.63 -1.37 0.22 0.00 0.21 0.00 0.00 52.86 52.55 1c1s s ASN 95 Cb -0.42 -1.65 1.08 0.00 -0.55 0.00 0.00 41.25 39.71 1c1s s ASN 95 CO 0.38 -0.25 1.70 -1.54 -2.79 0.00 0.00 177.10 174.60 1c1s n SER 96 N 4.54 0.00 -0.03 -4.21 3.41 -1.26 -0.86 113.62 115.20 1c1s n SER 96 Ca -0.13 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.27 1c1s n SER 96 Cb 0.43 -0.30 -0.13 0.00 -0.26 0.00 0.00 64.21 63.95 1c1s n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c1s n ASN 97 N -1.30 2.04 0.02 4.04 5.03 -1.26 -4.39 115.26 119.44 1c1s n ASN 97 Ca 0.10 0.29 0.11 0.00 0.87 0.00 0.00 54.58 55.95 1c1s n ASN 97 Cb 0.18 -0.91 -0.12 0.00 -1.02 0.00 0.00 39.78 37.91 1c1s n ASN 97 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1c1s n THR 98 N -3.82 0.18 -2.15 3.41 -2.24 -1.21 -4.96 114.28 103.49 1c1s n THR 98 Ca -0.32 -0.51 -0.07 0.00 -2.27 0.00 0.00 64.05 60.87 1c1s n THR 98 Cb 0.92 -0.10 -0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1c1s n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1c1s n LEU 99 N -2.38 -1.36 -4.74 3.22 4.77 -0.04 -5.01 117.00 111.46 1c1s n LEU 99 Ca -0.03 -0.01 -0.40 0.00 -0.03 0.00 0.00 56.01 55.54 1c1s n LEU 99 Cb 0.56 -1.36 -0.05 0.00 -2.33 0.00 0.00 43.42 40.25 1c1s n LEU 99 CO 0.44 -0.07 0.70 0.21 -1.33 0.00 0.00 177.39 177.35 1c1s s ASN 100 N -2.68 7.49 -0.81 -1.43 2.47 -1.19 -3.23 114.94 115.55 1c1s s ASN 100 Ca 0.00 2.00 -0.03 0.00 0.42 0.00 0.00 52.86 55.25 1c1s s ASN 100 Cb -0.00 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 1c1s s ASN 100 CO 0.00 -0.00 0.70 0.59 -3.72 0.00 0.00 177.10 174.67 1c1s n ASN 101 N 1.86 -3.49 -4.09 -4.21 3.02 -1.26 -2.24 115.26 104.85 1c1s n ASN 101 Ca -0.00 -0.36 -0.41 0.00 -0.03 0.00 0.00 54.58 53.77 1c1s n ASN 101 Cb 0.47 -3.39 -0.01 0.00 -0.61 0.00 0.00 39.78 36.23 1c1s n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1c1s n ASP 102 N -1.82 4.03 -3.81 6.41 2.03 -1.20 -4.44 116.55 117.75 1c1s n ASP 102 Ca -0.08 -2.84 -0.12 0.00 0.52 0.00 0.00 54.79 52.27 1c1s n ASP 102 Cb 0.57 -1.64 -0.10 0.00 -0.72 0.00 0.00 41.12 39.24 1c1s n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1c1s s ILE 103 N 4.42 0.06 0.05 5.18 2.07 -1.26 -3.61 121.20 128.10 1c1s s ILE 103 Ca 0.52 -0.50 -0.14 0.00 -1.41 0.00 0.00 60.65 59.13 1c1s s ILE 103 Cb 0.09 -0.50 0.02 0.00 0.13 0.00 0.00 42.46 42.20 1c1s s ILE 103 CO 0.01 -0.28 0.30 0.00 -1.91 0.00 0.00 174.94 173.07 1c1s s MET 104 N -1.15 0.82 0.01 3.50 0.23 -0.36 -2.03 119.30 120.32 1c1s s MET 104 Ca -0.12 -0.52 0.07 0.00 -1.03 0.00 0.00 55.69 54.09 1c1s s MET 104 Cb -0.06 0.35 -0.03 0.00 -1.53 0.00 0.00 34.83 33.57 1c1s s MET 104 CO 0.03 -0.26 -0.20 -0.51 -2.03 0.00 0.00 175.02 172.04 1c1s s LEU 105 N -2.10 2.48 -0.07 0.18 1.43 -0.50 -0.95 118.68 119.15 1c1s s LEU 105 Ca -0.05 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 1c1s s LEU 105 Cb -0.01 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 44.76 1c1s s LEU 105 CO -0.04 0.29 -0.16 -0.63 0.23 0.00 0.00 176.35 176.04 1c1s s ILE 106 N -0.81 1.44 -0.14 -0.59 1.01 -0.07 -0.78 121.20 121.27 1c1s s ILE 106 Ca 0.13 -0.67 -0.07 0.00 0.00 0.00 0.00 60.65 60.04 1c1s s ILE 106 Cb -0.10 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 1c1s s ILE 106 CO 0.03 0.42 0.10 -0.75 0.00 0.00 0.00 174.94 174.73 1c1s s LYS 107 N 0.46 3.56 0.27 2.79 2.20 0.25 -1.54 119.74 127.73 1c1s s LYS 107 Ca -0.14 -0.23 -0.17 0.00 -0.36 0.00 0.00 55.97 55.07 1c1s s LYS 107 Cb -0.16 -3.15 -0.08 0.00 -1.51 0.00 0.00 37.83 32.93 1c1s s LYS 107 CO 0.05 0.61 0.72 -0.51 -0.36 0.00 0.00 175.35 175.85 1c1s s LEU 108 N -0.55 4.20 0.36 5.43 1.43 0.06 -0.43 118.68 129.17 1c1s s LEU 108 Ca 0.12 1.32 0.06 0.00 -1.03 0.00 0.00 54.13 54.60 1c1s s LEU 108 Cb -0.12 -3.82 0.67 0.00 0.03 0.00 0.00 46.19 42.96 1c1s s LEU 108 CO 0.02 -0.08 1.90 0.11 0.23 0.00 0.00 176.35 178.53 1c1s h LYS 109 N 2.83 0.46 -4.96 1.70 1.57 -1.00 -3.42 116.57 113.74 1c1s h LYS 109 Ca -0.48 -0.09 -0.30 0.00 -1.87 0.00 0.00 60.65 57.91 1c1s h LYS 109 Cb 1.18 -0.07 -0.15 0.00 0.08 0.00 0.00 32.23 33.28 1c1s h LYS 109 CO 0.65 0.49 -0.71 0.45 -0.57 0.00 0.00 179.45 179.77 1c1s s SER 110 N -6.77 1.62 0.29 0.86 0.15 -1.26 -5.00 113.70 103.58 1c1s s SER 110 Ca -0.07 -1.02 -0.27 0.00 0.70 0.00 0.00 55.95 55.29 1c1s s SER 110 Cb 0.16 0.02 -0.09 0.00 -1.71 0.00 0.00 66.02 64.39 1c1s s SER 110 CO 0.75 -0.38 0.93 0.00 1.20 0.00 0.00 173.24 175.74 1c1s s ALA 111 N -3.41 3.27 0.56 5.45 0.00 -1.26 -4.83 121.76 121.54 1c1s s ALA 111 Ca 0.16 0.53 -0.16 0.00 0.00 0.00 0.00 51.96 52.49 1c1s s ALA 111 Cb 0.03 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 19.93 1c1s s ALA 111 CO -0.00 0.20 1.02 0.00 0.00 0.00 0.00 175.76 176.97 1c1s s ALA 112 N -1.46 2.92 -0.26 0.00 0.00 0.56 -5.00 121.76 118.52 1c1s s ALA 112 Ca 0.46 0.25 -0.13 0.00 0.00 0.00 0.00 51.96 52.54 1c1s s ALA 112 Cb -0.21 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1c1s s ALA 112 CO 0.26 -0.52 0.29 -1.12 0.00 0.00 0.00 175.76 174.67 1c1s s SER 113 N -3.03 6.17 0.18 0.00 0.01 -1.26 -4.82 113.70 110.94 1c1s s SER 113 Ca 0.61 0.18 -0.17 0.00 1.31 0.00 0.00 55.95 57.88 1c1s s SER 113 Cb -0.13 -2.17 -0.08 0.00 0.21 0.00 0.00 66.02 63.86 1c1s s SER 113 CO 0.35 -0.10 0.63 -0.76 0.41 0.00 0.00 173.24 173.78 1c1s s LEU 114 N 1.78 4.35 0.00 2.44 1.43 -1.26 -4.83 118.68 122.59 1c1s s LEU 114 Ca 0.12 1.25 0.00 0.00 -1.03 0.00 0.00 54.13 54.47 1c1s s LEU 114 Cb -0.16 -3.40 0.00 0.00 0.03 0.00 0.00 46.19 42.67 1c1s s LEU 114 CO 0.09 0.08 0.00 -0.46 0.23 0.00 0.00 176.35 176.30 1c1s n ASN 115 N 0.82 0.00 -0.35 2.29 0.23 0.85 -4.96 115.26 114.14 1c1s n ASN 115 Ca -0.04 -0.96 0.14 0.00 -0.53 0.00 0.00 54.58 53.19 1c1s n ASN 115 Cb 0.51 0.00 0.34 0.00 -2.08 0.00 0.00 39.78 38.56 1c1s n ASN 115 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1c1s h SER 116 N 0.00 0.75 0.63 0.53 0.02 -2.01 -2.21 113.55 111.26 1c1s h SER 116 Ca 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1c1s h SER 116 Cb 0.00 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1c1s h SER 116 CO 0.00 0.26 -0.60 0.54 -1.14 0.00 0.00 176.83 175.88 1c1s n ARG 117 N -4.75 0.14 -3.72 3.45 1.74 -1.26 -4.74 116.66 107.51 1c1s n ARG 117 Ca 0.23 0.03 -0.26 0.00 -0.77 0.00 0.00 57.85 57.09 1c1s n ARG 117 Cb 0.60 -1.58 -0.17 0.00 -1.02 0.00 0.00 32.46 30.29 1c1s n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1c1s s VAL 118 N -3.08 0.33 0.07 1.55 1.01 -0.83 -4.37 120.40 115.08 1c1s s VAL 118 Ca 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 1c1s s VAL 118 Cb 0.16 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 1c1s s VAL 118 CO 0.72 -0.06 -0.02 0.00 0.00 0.00 0.00 175.10 175.74 1c1s s ALA 119 N 1.96 0.61 0.41 5.51 0.00 -0.92 -0.11 121.76 129.22 1c1s s ALA 119 Ca 0.02 -1.26 0.05 0.00 0.00 0.00 0.00 51.96 50.77 1c1s s ALA 119 Cb -0.15 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1c1s s ALA 119 CO -0.07 -0.37 0.58 -1.54 0.00 0.00 0.00 175.76 174.36 1c1s s SER 120 N -2.95 5.74 0.14 0.00 1.04 -1.26 -3.20 113.70 113.20 1c1s s SER 120 Ca 0.10 -0.16 0.06 0.00 0.48 0.00 0.00 55.95 56.43 1c1s s SER 120 Cb 0.08 -1.04 -0.04 0.00 0.10 0.00 0.00 66.02 65.12 1c1s s SER 120 CO -0.08 -0.69 0.00 -0.51 0.98 0.00 0.00 173.24 172.94 1c1s s ILE 121 N -2.38 3.85 0.25 -1.02 1.10 -0.15 -4.86 121.20 117.99 1c1s s ILE 121 Ca 0.51 -1.23 -0.14 0.00 -0.51 0.00 0.00 60.65 59.28 1c1s s ILE 121 Cb -0.10 -2.89 -0.08 0.00 0.15 0.00 0.00 42.46 39.54 1c1s s ILE 121 CO 0.34 -0.01 0.65 -0.44 -2.11 0.00 0.00 174.94 173.37 1c1s s SER 122 N -2.67 6.77 0.46 4.50 0.01 -1.26 -4.64 113.70 116.86 1c1s s SER 122 Ca 0.27 1.15 -0.11 0.00 1.31 0.00 0.00 55.95 58.57 1c1s s SER 122 Cb -0.10 -2.32 -0.06 0.00 0.21 0.00 0.00 66.02 63.75 1c1s s SER 122 CO 0.18 -0.09 0.84 -0.76 0.41 0.00 0.00 173.24 173.83 1c1s s LEU 123 N -2.65 3.71 0.57 2.44 1.43 -1.26 -1.25 118.68 121.67 1c1s s LEU 123 Ca 0.48 1.22 -0.14 0.00 -1.03 0.00 0.00 54.13 54.66 1c1s s LEU 123 Cb -0.12 -4.14 -0.06 0.00 0.03 0.00 0.00 46.19 41.90 1c1s s LEU 123 CO 0.19 -0.50 1.01 -2.16 0.23 0.00 0.00 176.35 175.12 1c1s s PRO 124 N -4.13 3.69 -0.02 1.29 0.04 -1.26 -4.78 135.00 129.83 1c1s s PRO 124 Ca 0.53 0.93 0.20 0.00 0.04 0.00 0.00 61.00 62.69 1c1s s PRO 124 Cb -0.10 -2.10 -0.27 0.00 0.04 0.00 0.00 34.50 32.07 1c1s s PRO 124 CO 0.35 -0.49 0.62 0.25 0.04 0.00 0.00 177.00 177.77 1c1s n THR 125 N -2.09 0.00 -3.98 1.26 -2.24 -1.26 -4.98 114.28 101.00 1c1s n THR 125 Ca 0.07 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.48 1c1s n THR 125 Cb 0.54 0.47 -0.04 0.00 -2.10 0.00 0.00 70.33 69.20 1c1s n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1c1s s SER 127 N -3.65 0.07 0.33 3.42 1.04 -1.26 -5.17 113.70 108.48 1c1s s SER 127 Ca -0.01 -1.01 -0.08 0.00 0.48 0.00 0.00 55.95 55.33 1c1s s SER 127 Cb 0.14 0.65 -0.06 0.00 0.10 0.00 0.00 66.02 66.85 1c1s s SER 127 CO 0.82 -1.26 0.64 0.00 0.98 0.00 0.00 173.24 174.42 1c1s s ALA 129 N -2.16 3.47 0.30 0.00 0.00 -1.26 -5.09 121.76 117.03 1c1s s ALA 129 Ca 0.47 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.75 1c1s s ALA 129 Cb -0.11 -2.47 -0.05 0.00 0.00 0.00 0.00 23.12 20.49 1c1s s ALA 129 CO 0.29 -0.33 0.56 -1.54 0.00 0.00 0.00 175.76 174.74 1c1s s SER 130 N -4.12 6.42 0.52 0.00 1.04 -1.26 -5.03 113.70 111.27 1c1s s SER 130 Ca 0.47 0.69 -0.22 0.00 0.48 0.00 0.00 55.95 57.37 1c1s s SER 130 Cb -0.10 -2.13 -0.06 0.00 0.10 0.00 0.00 66.02 63.83 1c1s s SER 130 CO 0.43 -0.22 1.31 0.00 0.98 0.00 0.00 173.24 175.74 1c1s s ALA 132 N -2.13 2.88 0.00 5.32 0.00 -1.26 -1.55 121.76 125.01 1c1s s ALA 132 Ca 0.44 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.63 1c1s s ALA 132 Cb -0.11 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1c1s s ALA 132 CO 0.31 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 175.30 1c1s n GLY 133 N 0.65 2.99 3.77 0.00 0.00 0.12 -4.94 105.19 107.79 1c1s n GLY 133 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1c1s n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c1s s THR 134 N -2.91 2.33 -0.04 2.61 2.01 -0.60 -4.62 115.64 114.42 1c1s s THR 134 Ca 0.00 0.33 -0.10 0.00 0.31 0.00 0.00 61.69 62.23 1c1s s THR 134 Cb 0.00 -3.21 -0.05 0.00 0.01 0.00 0.00 72.50 69.25 1c1s s THR 134 CO 0.00 0.08 0.29 -1.10 -0.69 0.00 0.00 174.62 173.19 1c1s s GLN 135 N -2.00 3.68 0.34 4.92 -1.52 -1.26 -1.59 119.66 122.23 1c1s s GLN 135 Ca 0.52 0.13 0.04 0.00 -1.95 0.00 0.00 55.36 54.10 1c1s s GLN 135 Cb -0.43 -3.18 -0.07 0.00 -0.22 0.00 0.00 33.01 29.11 1c1s s GLN 135 CO 0.59 0.71 0.05 0.00 -0.25 0.00 0.00 175.29 176.39 1c1s s LEU 137 N -3.51 2.14 -0.06 0.00 2.96 0.21 -2.11 118.68 118.30 1c1s s LEU 137 Ca 0.36 -0.60 0.05 0.00 -0.22 0.00 0.00 54.13 53.73 1c1s s LEU 137 Cb 0.09 -1.45 -0.02 0.00 0.50 0.00 0.00 46.19 45.31 1c1s s LEU 137 CO 0.16 0.08 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.43 1c1s s ILE 138 N 0.82 2.44 0.09 6.68 1.01 0.10 -1.74 121.20 130.60 1c1s s ILE 138 Ca -0.07 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.64 1c1s s ILE 138 Cb -0.15 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1c1s s ILE 138 CO -0.02 0.57 0.02 -0.94 0.00 0.00 0.00 174.94 174.58 1c1s s SER 139 N -0.28 0.38 0.00 3.58 1.04 -1.24 -0.73 113.70 116.46 1c1s s SER 139 Ca 0.01 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.36 1c1s s SER 139 Cb -0.13 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1c1s s SER 139 CO 0.03 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1c1s n GLY 140 N 0.00 1.92 2.02 7.32 0.00 -0.50 -4.55 105.19 111.40 1c1s n GLY 140 Ca -0.10 -1.02 -0.23 0.00 0.00 0.00 0.00 46.02 44.67 1c1s n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c1s n TRP 141 N -0.83 2.68 -2.69 1.61 8.01 -1.26 -2.82 117.44 122.14 1c1s n TRP 141 Ca 0.00 -2.19 -0.22 0.00 -1.31 0.00 0.00 57.50 53.78 1c1s n TRP 141 Cb 0.00 -0.95 0.08 0.00 -2.01 0.00 0.00 31.31 28.43 1c1s n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1c1s s GLY 142 N -1.92 1.77 0.27 6.99 0.00 -1.25 -4.59 107.32 108.60 1c1s s GLY 142 Ca 0.56 -1.72 -0.26 0.00 0.00 0.00 0.00 44.72 43.29 1c1s s GLY 142 CO 0.04 -1.24 0.55 -2.01 0.00 0.00 0.00 173.10 170.44 1c1s n ASN 143 N -2.60 -0.98 -0.55 1.64 5.15 -0.71 -2.77 115.26 114.43 1c1s n ASN 143 Ca 0.14 1.07 0.06 0.00 -0.60 0.00 0.00 54.58 55.25 1c1s n ASN 143 Cb 0.61 -1.02 0.16 0.00 -0.53 0.00 0.00 39.78 39.00 1c1s n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1c1s n THR 144 N -0.19 1.48 -5.14 -0.44 -2.24 0.42 -0.32 114.28 107.84 1c1s n THR 144 Ca 0.15 -1.40 -0.29 0.00 -2.27 0.00 0.00 64.05 60.24 1c1s n THR 144 Cb 0.30 0.20 -0.16 0.00 -2.10 0.00 0.00 70.33 68.56 1c1s n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1c1s s LYS 145 N -1.74 2.10 0.10 -0.78 -0.14 -1.26 -4.48 119.74 113.54 1c1s s LYS 145 Ca 0.26 -0.82 -0.13 0.00 -1.36 0.00 0.00 55.97 53.92 1c1s s LYS 145 Cb 0.18 -1.90 -0.14 0.00 -1.68 0.00 0.00 37.83 34.29 1c1s s LYS 145 CO 0.10 0.42 1.32 0.77 -0.76 0.00 0.00 175.35 177.20 1c1s h SER 146 N 5.85 0.93 -3.45 2.83 0.02 -1.94 -3.37 113.55 114.42 1c1s h SER 146 Ca -0.36 -0.60 -0.61 0.00 -0.84 0.00 0.00 61.79 59.37 1c1s h SER 146 Cb 1.15 -0.27 -0.40 0.00 0.14 0.00 0.00 62.40 63.02 1c1s h SER 146 CO 0.47 1.38 -0.72 -0.44 -1.14 0.00 0.00 176.83 176.39 1c1s s SER 147 N -7.03 3.73 0.00 3.07 0.01 -1.26 -4.50 113.70 107.72 1c1s s SER 147 Ca -0.11 -2.95 0.00 0.00 1.31 0.00 0.00 55.95 54.20 1c1s s SER 147 Cb 0.09 -1.17 0.00 0.00 0.21 0.00 0.00 66.02 65.14 1c1s s SER 147 CO 0.90 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.94 1c1s n GLY 148 N 3.12 0.96 2.96 3.44 0.00 -1.26 -5.10 105.19 109.31 1c1s n GLY 148 Ca 0.12 -1.63 -0.27 0.00 0.00 0.00 0.00 46.02 44.25 1c1s n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c1s s THR 149 N -1.59 1.15 -0.21 2.61 2.01 -1.26 -4.53 115.64 113.83 1c1s s THR 149 Ca 0.00 -0.41 -0.05 0.00 0.31 0.00 0.00 61.69 61.55 1c1s s THR 149 Cb 0.00 -1.11 0.10 0.00 0.01 0.00 0.00 72.50 71.50 1c1s s THR 149 CO 0.00 0.38 0.37 -0.55 -0.69 0.00 0.00 174.62 174.13 1c1s s SER 150 N 1.32 0.11 -0.17 3.53 0.15 -1.26 -4.97 113.70 112.41 1c1s s SER 150 Ca -0.02 0.56 -0.04 0.00 0.70 0.00 0.00 55.95 57.16 1c1s s SER 150 Cb -0.14 1.12 -0.03 0.00 -1.71 0.00 0.00 66.02 65.27 1c1s s SER 150 CO -0.05 -0.27 -0.03 -0.31 1.20 0.00 0.00 173.24 173.79 1c1s s TYR 151 N 2.55 3.02 0.87 3.44 2.02 -1.26 -0.44 117.35 127.55 1c1s s TYR 151 Ca 0.05 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.24 1c1s s TYR 151 Cb -0.14 -2.00 0.15 0.00 -0.40 0.00 0.00 41.96 39.57 1c1s s TYR 151 CO -0.13 -0.13 1.22 -1.25 -1.57 0.00 0.00 175.55 173.68 1c1s s PRO 152 N 0.62 1.21 -0.01 -1.71 0.04 -1.26 -5.01 135.00 128.87 1c1s s PRO 152 Ca -0.02 -0.39 0.04 0.00 0.04 0.00 0.00 61.00 60.67 1c1s s PRO 152 Cb -0.14 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 1c1s s PRO 152 CO 0.02 -1.99 0.09 -0.25 0.04 0.00 0.00 177.00 174.91 1c1s n ASP 153 N -3.46 4.01 -4.73 6.66 8.00 -1.26 -4.93 116.55 120.84 1c1s n ASP 153 Ca 0.13 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.38 1c1s n ASP 153 Cb 0.60 1.14 -0.06 0.00 -0.02 0.00 0.00 41.12 42.78 1c1s n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1c1s s VAL 154 N -2.28 4.04 0.30 2.53 -7.23 -1.26 -0.71 120.40 115.79 1c1s s VAL 154 Ca -0.02 -1.43 -0.29 0.00 -1.81 0.00 0.00 61.98 58.43 1c1s s VAL 154 Cb 0.03 -3.10 -0.10 0.00 0.56 0.00 0.00 36.38 33.76 1c1s s VAL 154 CO 0.18 -0.22 1.36 -0.22 -0.31 0.00 0.00 175.10 175.88 1c1s s LEU 155 N -3.35 4.41 0.11 1.32 2.96 -1.17 -4.83 118.68 118.12 1c1s s LEU 155 Ca 0.30 2.68 0.09 0.00 -0.22 0.00 0.00 54.13 56.98 1c1s s LEU 155 Cb -0.09 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1c1s s LEU 155 CO 0.22 -0.60 -0.17 -0.54 -1.32 0.00 0.00 176.35 173.94 1c1s s LYS 156 N -1.26 1.85 0.15 1.98 -0.14 -1.13 -2.24 119.74 118.96 1c1s s LYS 156 Ca 0.53 -1.15 0.08 0.00 -1.36 0.00 0.00 55.97 54.07 1c1s s LYS 156 Cb -0.40 -2.15 -0.04 0.00 -1.68 0.00 0.00 37.83 33.56 1c1s s LYS 156 CO 0.49 0.49 -0.17 0.00 -0.76 0.00 0.00 175.35 175.40 1c1s s LEU 158 N -2.63 0.30 -0.15 0.00 2.96 0.09 -0.41 118.68 118.85 1c1s s LEU 158 Ca 0.14 0.83 -0.05 0.00 -0.22 0.00 0.00 54.13 54.82 1c1s s LEU 158 Cb -0.05 1.35 -0.03 0.00 0.50 0.00 0.00 46.19 47.96 1c1s s LEU 158 CO 0.05 -0.16 0.02 -0.54 -1.32 0.00 0.00 176.35 174.41 1c1s s LYS 159 N 0.58 3.65 -0.02 1.98 1.02 -1.26 -0.72 119.74 124.97 1c1s s LYS 159 Ca -0.03 -0.40 -0.15 0.00 0.02 0.00 0.00 55.97 55.41 1c1s s LYS 159 Cb -0.05 -3.03 0.03 0.00 -0.52 0.00 0.00 37.83 34.26 1c1s s LYS 159 CO -0.04 0.38 0.32 0.00 -0.92 0.00 0.00 175.35 175.10 1c1s s ALA 160 N 0.04 -0.82 0.58 5.17 0.00 -0.90 -4.96 121.76 120.87 1c1s s ALA 160 Ca 0.03 0.41 -0.06 0.00 0.00 0.00 0.00 51.96 52.34 1c1s s ALA 160 Cb -0.13 0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 1c1s s ALA 160 CO 0.02 -0.26 0.90 -1.25 0.00 0.00 0.00 175.76 175.17 1c1s s PRO 161 N -1.20 3.08 0.12 0.00 0.04 -1.26 -0.97 135.00 134.81 1c1s s PRO 161 Ca -0.12 0.11 -0.25 0.00 0.04 0.00 0.00 61.00 60.77 1c1s s PRO 161 Cb -0.05 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 1c1s s PRO 161 CO 0.04 -0.62 0.78 0.42 0.04 0.00 0.00 177.00 177.66 1c1s s ILE 162 N -2.98 4.50 0.28 0.56 1.01 -0.62 -1.61 121.20 122.34 1c1s s ILE 162 Ca 0.53 1.69 0.03 0.00 0.00 0.00 0.00 60.65 62.89 1c1s s ILE 162 Cb -0.11 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 1c1s s ILE 162 CO 0.46 0.46 0.44 -0.76 0.00 0.00 0.00 174.94 175.54 1c1s s LEU 163 N -0.74 4.19 0.54 2.97 1.43 -0.15 -0.70 118.68 126.21 1c1s s LEU 163 Ca 0.37 0.25 -0.21 0.00 -1.03 0.00 0.00 54.13 53.51 1c1s s LEU 163 Cb -0.22 -3.07 -0.05 0.00 0.03 0.00 0.00 46.19 42.88 1c1s s LEU 163 CO 0.25 -0.16 1.23 -0.94 0.23 0.00 0.00 176.35 176.96 1c1s s SER 164 N -3.95 5.53 0.52 2.29 1.04 -1.26 -4.65 113.70 113.20 1c1s s SER 164 Ca 0.37 2.45 0.18 0.00 0.48 0.00 0.00 55.95 59.42 1c1s s SER 164 Cb -0.09 -2.61 1.29 0.00 0.10 0.00 0.00 66.02 64.71 1c1s s SER 164 CO 0.32 -1.37 2.13 0.44 0.98 0.00 0.00 173.24 175.75 1c1s h ASP 165 N 1.39 0.00 -0.59 7.02 3.32 -1.97 -2.53 116.42 123.05 1c1s h ASP 165 Ca -0.50 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.60 1c1s h ASP 165 Cb 1.28 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.78 1c1s h ASP 165 CO 0.57 0.03 0.32 0.77 -1.72 0.00 0.00 179.24 179.22 1c1s h SER 166 N 0.00 0.48 0.47 6.45 4.64 -1.99 0.14 113.55 123.74 1c1s h SER 166 Ca -0.00 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.21 1c1s h SER 166 Cb 0.06 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 1c1s h SER 166 CO 0.00 0.32 -0.58 0.77 -0.87 0.00 0.00 176.83 176.48 1c1s h SER 167 N 0.61 0.13 0.62 4.97 4.64 -1.83 -1.53 113.55 121.16 1c1s h SER 167 Ca 0.26 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.48 1c1s h SER 167 Cb 0.14 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1c1s h SER 167 CO -0.16 0.68 -0.30 0.00 -0.87 0.00 0.00 176.83 176.18 1c1s h LYS 169 N -1.14 0.08 0.00 0.00 1.57 -1.01 -0.51 116.57 115.57 1c1s h LYS 169 Ca -0.09 -0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.52 1c1s h LYS 169 Cb 0.68 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 1c1s h LYS 169 CO 0.14 0.05 -0.79 0.77 -0.57 0.00 0.00 179.45 179.05 1c1s h SER 170 N 0.08 0.00 0.03 0.86 0.02 -1.21 -2.76 113.55 110.57 1c1s h SER 170 Ca 0.17 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.89 1c1s h SER 170 Cb 0.55 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.10 1c1s h SER 170 CO -0.01 0.79 -0.84 0.00 -1.14 0.00 0.00 176.83 175.62 1c1s h ALA 171 N 1.21 0.34 -2.33 3.77 0.00 -0.58 -3.38 119.26 118.28 1c1s h ALA 171 Ca -0.01 -0.64 -0.60 0.00 0.00 0.00 0.00 54.91 53.67 1c1s h ALA 171 Cb 1.44 -0.01 -0.42 0.00 0.00 0.00 0.00 17.79 18.80 1c1s h ALA 171 CO 0.10 0.72 -0.65 0.66 0.00 0.00 0.00 179.25 180.08 1c1s n TYR 172 N -3.87 3.04 -1.71 0.00 4.02 -0.57 -5.02 117.16 113.05 1c1s n TYR 172 Ca -0.07 -4.10 -0.43 0.00 -0.01 0.00 0.00 57.90 53.29 1c1s n TYR 172 Cb 0.78 -0.53 -0.02 0.00 -0.02 0.00 0.00 39.34 39.55 1c1s n TYR 172 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1c1s n PRO 173 N 1.15 2.46 -0.30 -0.72 -0.02 -1.05 -2.02 135.00 134.50 1c1s n PRO 173 Ca 0.27 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.63 1c1s n PRO 173 Cb 0.41 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 1c1s n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1c1s n GLY 174 N 2.46 1.48 0.01 -1.23 0.00 -1.26 -4.83 105.19 101.81 1c1s n GLY 174 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.22 1c1s n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1c1s n GLN 175 N -2.00 0.78 -3.30 1.61 6.02 -0.86 -4.98 117.38 114.66 1c1s n GLN 175 Ca 0.00 -0.10 -0.38 0.00 -0.01 0.00 0.00 57.00 56.50 1c1s n GLN 175 Cb 0.00 -1.40 -0.06 0.00 1.02 0.00 0.00 30.24 29.81 1c1s n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1c1s s ILE 176 N -3.04 5.06 0.55 5.09 -1.09 -1.25 -5.03 121.20 121.48 1c1s s ILE 176 Ca -0.02 1.05 0.04 0.00 -2.23 0.00 0.00 60.65 59.50 1c1s s ILE 176 Cb 0.12 -3.85 0.03 0.00 -1.58 0.00 0.00 42.46 37.19 1c1s s ILE 176 CO 0.75 0.40 0.30 0.42 -1.23 0.00 0.00 174.94 175.57 1c1s s THR 177 N 0.06 1.44 -1.10 2.92 -4.23 -1.26 -4.99 115.64 108.49 1c1s s THR 177 Ca 0.28 -1.63 0.14 0.00 -1.18 0.00 0.00 61.69 59.29 1c1s s THR 177 Cb -0.17 -2.07 0.14 0.00 1.34 0.00 0.00 72.50 71.75 1c1s s THR 177 CO 0.13 0.00 1.42 -1.54 -0.54 0.00 0.00 174.62 174.09 1c1s n SER 178 N -1.66 0.00 -1.65 3.99 3.41 -1.26 -2.42 113.62 114.03 1c1s n SER 178 Ca -0.07 0.41 0.09 0.00 -0.26 0.00 0.00 58.87 59.03 1c1s n SER 178 Cb 0.65 -0.45 0.37 0.00 -0.26 0.00 0.00 64.21 64.52 1c1s n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c1s n ASN 179 N -1.45 4.91 -4.14 4.04 3.02 -1.26 -4.92 115.26 115.46 1c1s n ASN 179 Ca 0.04 -2.52 -0.13 0.00 -0.03 0.00 0.00 54.58 51.94 1c1s n ASN 179 Cb 0.15 -0.60 -0.11 0.00 -0.61 0.00 0.00 39.78 38.61 1c1s n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1c1s s MET 180 N -2.00 0.75 0.11 3.52 -1.94 -1.02 -1.44 119.30 117.29 1c1s s MET 180 Ca 0.52 -1.11 -0.10 0.00 -1.71 0.00 0.00 55.69 53.29 1c1s s MET 180 Cb 0.34 -0.35 0.00 0.00 2.01 0.00 0.00 34.83 36.83 1c1s s MET 180 CO 0.23 0.04 0.24 -0.59 -0.01 0.00 0.00 175.02 174.93 1c1s s PHE 181 N -2.55 0.14 0.11 -0.03 -0.12 -0.66 -4.78 117.98 110.09 1c1s s PHE 181 Ca 0.03 -0.54 0.06 0.00 -0.05 0.00 0.00 56.93 56.43 1c1s s PHE 181 Cb -0.02 -0.01 -0.04 0.00 -0.63 0.00 0.00 43.02 42.32 1c1s s PHE 181 CO -0.02 -0.60 -0.05 0.00 -0.05 0.00 0.00 175.22 174.50 1c1s s ALA 183 N -1.34 -0.49 0.00 0.00 0.00 -1.02 -0.97 121.76 117.94 1c1s s ALA 183 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.17 1c1s s ALA 183 Cb -0.11 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.16 1c1s s ALA 183 CO 0.16 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.06 1c1s n GLY 184 N 1.17 0.77 2.96 0.00 0.00 -0.63 -2.60 105.19 106.86 1c1s n GLY 184 Ca -0.21 -1.86 -0.30 0.00 0.00 0.00 0.00 46.02 43.64 1c1s n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c1s s TYR 184 N -2.62 2.33 0.60 1.61 1.51 -1.26 -4.42 117.35 115.10 1c1s s TYR 184 Ca 0.00 -1.60 0.38 0.00 -1.01 0.00 0.00 57.07 54.84 1c1s s TYR 184 Cb 0.00 -1.58 2.10 0.00 -0.11 0.00 0.00 41.96 42.37 1c1s s TYR 184 CO 0.00 -0.74 2.30 -0.07 -1.11 0.00 0.00 175.55 175.93 1c1s h LEU 185 N 7.98 0.00 -1.18 -1.29 3.38 -1.95 0.23 115.31 122.49 1c1s h LEU 185 Ca -0.23 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 1c1s h LEU 185 Cb 1.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1c1s h LEU 185 CO 0.44 0.01 -0.14 1.05 0.09 0.00 0.00 178.44 179.89 1c1s h GLU 186 N 0.00 0.00 0.00 1.13 9.09 -1.95 0.15 114.58 123.01 1c1s h GLU 186 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1c1s h GLU 186 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.14 1c1s h GLU 186 CO 0.00 0.14 0.00 0.41 0.05 0.00 0.00 179.01 179.61 1c1s n GLY 187 N 0.16 -1.61 3.01 1.06 0.00 0.81 -4.26 105.19 104.36 1c1s n GLY 187 Ca 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1c1s n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c1s n GLY 188 N 0.00 1.53 3.08 -0.02 0.00 -0.88 -4.75 105.19 104.15 1c1s n GLY 188 Ca 0.00 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.57 1c1s n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1s s LYS 188 N 0.00 1.45 -0.07 1.61 1.02 -1.26 -3.95 119.74 118.54 1c1s s LYS 188 Ca 0.00 -0.49 -0.31 0.00 0.02 0.00 0.00 55.97 55.19 1c1s s LYS 188 Cb 0.00 -1.29 0.11 0.00 -0.52 0.00 0.00 37.83 36.13 1c1s s LYS 188 CO 0.00 0.19 1.36 0.34 -0.92 0.00 0.00 175.35 176.33 1c1s s ASP 189 N 0.09 -0.00 0.48 2.83 3.68 -0.78 -4.23 116.67 118.73 1c1s s ASP 189 Ca -0.03 -0.07 0.05 0.00 2.13 0.00 0.00 52.55 54.63 1c1s s ASP 189 Cb -0.10 0.05 0.02 0.00 -1.45 0.00 0.00 42.92 41.44 1c1s s ASP 189 CO 0.01 -0.11 0.66 -0.94 0.13 0.00 0.00 175.17 174.93 1c1s s SER 190 N -3.61 5.50 0.02 -0.34 1.04 -1.26 -1.24 113.70 113.81 1c1s s SER 190 Ca 0.26 -0.21 -0.00 0.00 0.48 0.00 0.00 55.95 56.48 1c1s s SER 190 Cb 0.02 -0.80 0.00 0.00 0.10 0.00 0.00 66.02 65.35 1c1s s SER 190 CO -0.03 -0.92 0.04 0.00 0.98 0.00 0.00 173.24 173.30 1c1s s GLN 192 N -2.05 4.31 0.00 0.00 -2.07 -1.26 -2.18 119.66 116.42 1c1s s GLN 192 Ca 0.02 1.68 0.00 0.00 -1.82 0.00 0.00 55.36 55.24 1c1s s GLN 192 Cb -0.00 -2.80 0.00 0.00 -1.09 0.00 0.00 33.01 29.12 1c1s s GLN 192 CO 0.01 -0.05 0.00 0.41 -1.32 0.00 0.00 175.29 174.34 1c1s n GLY 193 N 0.71 1.68 0.02 2.60 0.00 -1.26 -1.74 105.19 107.21 1c1s n GLY 193 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1c1s n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c1s n ASP 194 N 0.00 0.51 -4.51 1.61 10.43 -0.92 -3.77 116.55 119.89 1c1s n ASP 194 Ca 0.00 -0.28 -0.42 0.00 2.57 0.00 0.00 54.79 56.66 1c1s n ASP 194 Cb 0.00 1.21 0.01 0.00 1.84 0.00 0.00 41.12 44.17 1c1s n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1c1s n SER 195 N -2.00 -0.02 0.00 -2.24 7.64 -1.26 -2.35 113.62 113.39 1c1s n SER 195 Ca 0.00 0.97 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1c1s n SER 195 Cb 0.46 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.46 1c1s n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1s n GLY 196 N 1.55 3.14 3.75 0.23 0.00 -0.22 -0.56 105.19 113.08 1c1s n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1c1s n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c1s s GLY 197 N -1.60 1.60 0.47 -0.02 0.00 -0.99 -3.45 107.32 103.33 1c1s s GLY 197 Ca 0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 44.72 44.33 1c1s s GLY 197 CO 0.00 0.27 0.92 2.56 0.00 0.00 0.00 173.10 176.84 1c1s s PRO 198 N -5.07 3.94 -0.22 2.90 0.04 -1.26 -1.39 135.00 133.93 1c1s s PRO 198 Ca 0.63 0.84 -0.02 0.00 0.04 0.00 0.00 61.00 62.49 1c1s s PRO 198 Cb -0.16 -2.22 0.07 0.00 0.04 0.00 0.00 34.50 32.23 1c1s s PRO 198 CO 0.55 -0.17 0.05 0.08 0.04 0.00 0.00 177.00 177.56 1c1s s VAL 199 N -2.48 0.56 -0.14 -0.36 1.01 -0.95 -3.62 120.40 114.42 1c1s s VAL 199 Ca 0.57 -0.74 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1c1s s VAL 199 Cb -0.10 -1.16 -0.01 0.00 0.00 0.00 0.00 36.38 35.11 1c1s s VAL 199 CO 0.28 -0.34 -0.12 -0.69 0.00 0.00 0.00 175.10 174.24 1c1s s VAL 200 N 1.82 3.09 -0.06 2.92 1.01 -0.71 -1.42 120.40 127.06 1c1s s VAL 200 Ca 0.02 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1c1s s VAL 200 Cb -0.17 -2.31 0.02 0.00 0.00 0.00 0.00 36.38 33.92 1c1s s VAL 200 CO -0.13 0.52 -0.09 0.00 0.00 0.00 0.00 175.10 175.39 1c1s n SER 202 N 3.92 -4.67 0.00 0.00 7.64 -1.26 -2.15 113.62 117.10 1c1s n SER 202 Ca -0.24 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 58.84 1c1s n SER 202 Cb 0.51 -3.76 0.00 0.00 -1.01 0.00 0.00 64.21 59.96 1c1s n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c1s n GLY 203 N -1.66 0.80 3.29 0.23 0.00 -1.26 -5.01 105.19 101.57 1c1s n GLY 203 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1c1s n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c1s s LYS 204 N -0.01 1.14 -0.50 1.61 -0.14 -0.91 -4.20 119.74 116.73 1c1s s LYS 204 Ca 0.00 -1.22 -0.26 0.00 -1.36 0.00 0.00 55.97 53.12 1c1s s LYS 204 Cb 0.00 -1.32 0.03 0.00 -1.68 0.00 0.00 37.83 34.86 1c1s s LYS 204 CO 0.00 0.29 1.03 -1.17 -0.76 0.00 0.00 175.35 174.74 1c1s s LEU 209 N -2.14 3.84 -0.02 3.17 2.96 -0.38 -1.49 118.68 124.63 1c1s s LEU 209 Ca 0.09 0.10 0.16 0.00 -0.22 0.00 0.00 54.13 54.26 1c1s s LEU 209 Cb -0.09 -3.20 -0.24 0.00 0.50 0.00 0.00 46.19 43.16 1c1s s LEU 209 CO 0.05 -1.21 0.36 0.00 -1.32 0.00 0.00 176.35 174.23 1c1s n GLN 210 N 7.61 0.54 -4.07 1.98 1.13 -0.51 -4.17 117.38 119.90 1c1s n GLN 210 Ca 0.07 -0.14 -0.10 0.00 -1.94 0.00 0.00 57.00 54.89 1c1s n GLN 210 Cb 0.49 -1.37 -0.07 0.00 0.11 0.00 0.00 30.24 29.39 1c1s n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1c1s s GLY 211 N -3.77 0.89 -0.04 1.08 0.00 -0.99 -1.95 107.32 102.54 1c1s s GLY 211 Ca -0.05 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.47 1c1s s GLY 211 CO 0.66 -0.97 -0.06 -0.42 0.00 0.00 0.00 173.10 172.31 1c1s s ILE 212 N -4.07 0.60 -0.02 0.90 1.01 -1.11 -2.24 121.20 116.27 1c1s s ILE 212 Ca 0.28 -0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.44 1c1s s ILE 212 Cb 0.03 -0.59 -0.07 0.00 0.01 0.00 0.00 42.46 41.85 1c1s s ILE 212 CO 0.09 0.22 1.71 -0.69 0.00 0.00 0.00 174.94 176.27 1c1s s VAL 213 N 0.66 3.40 0.02 2.92 1.01 -0.49 -1.47 120.40 126.45 1c1s s VAL 213 Ca -0.09 0.54 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 1c1s s VAL 213 Cb -0.12 -3.35 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 1c1s s VAL 213 CO 0.01 -0.04 -0.02 -0.24 0.00 0.00 0.00 175.10 174.81 1c1s n SER 214 N 6.97 0.40 -0.99 3.32 2.88 -1.03 -1.06 113.62 124.11 1c1s n SER 214 Ca 0.17 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 1c1s n SER 214 Cb 0.42 -0.19 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 1c1s n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1c1s n TRP 215 N -2.87 -0.63 -1.04 0.66 4.27 -0.90 -4.95 117.44 111.99 1c1s n TRP 215 Ca -0.01 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.60 1c1s n TRP 215 Cb 0.03 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.98 1c1s n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1c1s n GLY 216 N 0.00 -2.02 3.14 -1.67 0.00 -1.26 -1.09 105.19 102.28 1c1s n GLY 216 Ca 0.00 -1.18 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 1c1s n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1c1s s SER 217 N -1.14 5.14 0.58 1.61 0.15 -1.26 -4.99 113.70 113.78 1c1s s SER 217 Ca 0.00 -1.79 0.00 0.00 0.70 0.00 0.00 55.95 54.86 1c1s s SER 217 Cb 0.00 -1.79 0.00 0.00 -1.71 0.00 0.00 66.02 62.52 1c1s s SER 217 CO 0.00 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.60 1c1s n GLY 219 N 4.60 -0.44 3.00 9.45 0.00 -1.26 -4.65 105.19 115.89 1c1s n GLY 219 Ca -0.05 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.70 1c1s n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c1s n ALA 221 N 3.14 -1.23 -2.54 0.00 0.00 -1.26 -4.52 120.51 114.10 1c1s n ALA 221 Ca -0.16 0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.12 1c1s n ALA 221 Cb 0.55 -3.88 -0.01 0.00 0.00 0.00 0.00 19.45 16.11 1c1s n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1c1s s GLN 221 N -6.65 3.53 0.39 0.00 -1.52 -1.26 -2.08 119.66 112.07 1c1s s GLN 221 Ca 0.66 -0.13 -0.25 0.00 -1.95 0.00 0.00 55.36 53.69 1c1s s GLN 221 Cb -0.35 -2.59 -0.09 0.00 -0.22 0.00 0.00 33.01 29.76 1c1s s GLN 221 CO 0.82 0.08 1.12 0.21 -0.25 0.00 0.00 175.29 177.27 1c1s s LYS 222 N -4.23 4.13 -1.31 2.91 2.20 -1.26 -2.81 119.74 119.38 1c1s s LYS 222 Ca 0.43 1.72 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 1c1s s LYS 222 Cb -0.10 -2.67 0.00 0.00 -1.51 0.00 0.00 37.83 33.55 1c1s s LYS 222 CO 0.37 -0.22 0.00 0.09 -0.36 0.00 0.00 175.35 175.23 1c1s n ASN 223 N 0.11 -4.52 -3.33 1.43 3.02 0.53 -4.89 115.26 107.61 1c1s n ASN 223 Ca 0.04 0.30 -0.26 0.00 -0.03 0.00 0.00 54.58 54.64 1c1s n ASN 223 Cb 0.47 -3.71 -0.08 0.00 -0.61 0.00 0.00 39.78 35.86 1c1s n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1c1s n LYS 224 N -1.33 1.78 -0.85 3.52 4.76 -1.12 -4.75 118.16 120.17 1c1s n LYS 224 Ca -0.12 -4.08 -0.29 0.00 -2.87 0.00 0.00 58.31 50.94 1c1s n LYS 224 Cb 0.51 -1.83 0.24 0.00 -1.84 0.00 0.00 35.03 32.11 1c1s n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1c1s s PRO 225 N -1.93 -1.14 0.48 1.97 0.04 -1.26 -4.36 135.00 128.80 1c1s s PRO 225 Ca 0.38 0.29 -0.09 0.00 0.04 0.00 0.00 61.00 61.62 1c1s s PRO 225 Cb 0.15 -1.57 -0.05 0.00 0.04 0.00 0.00 34.50 33.07 1c1s s PRO 225 CO -0.05 -3.73 0.84 0.20 0.04 0.00 0.00 177.00 174.29 1c1s s GLY 226 N -3.34 1.72 -0.11 0.56 0.00 -1.07 -4.49 107.32 100.59 1c1s s GLY 226 Ca 0.69 -0.28 0.03 0.00 0.00 0.00 0.00 44.72 45.15 1c1s s GLY 226 CO 0.59 -0.08 -0.21 0.14 0.00 0.00 0.00 173.10 173.53 1c1s s VAL 227 N -2.68 2.34 0.11 1.40 1.01 -0.25 -2.43 120.40 119.89 1c1s s VAL 227 Ca 0.51 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.66 1c1s s VAL 227 Cb -0.10 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1c1s s VAL 227 CO 0.41 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.51 1c1s s TYR 228 N 0.33 2.09 0.10 5.22 2.02 -0.14 -2.11 117.35 124.85 1c1s s TYR 228 Ca -0.16 -0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 55.84 1c1s s TYR 228 Cb -0.17 -1.15 -0.06 0.00 -0.40 0.00 0.00 41.96 40.17 1c1s s TYR 228 CO 0.08 0.26 1.09 0.99 -1.57 0.00 0.00 175.55 176.40 1c1s s THR 229 N -1.06 4.19 -1.01 -0.71 2.01 -0.54 -1.65 115.64 116.87 1c1s s THR 229 Ca 0.11 1.70 -0.20 0.00 0.31 0.00 0.00 61.69 63.61 1c1s s THR 229 Cb -0.10 -4.09 0.10 0.00 0.01 0.00 0.00 72.50 68.42 1c1s s THR 229 CO 0.05 0.20 1.32 -0.75 -0.69 0.00 0.00 174.62 174.75 1c1s s LYS 230 N 0.42 3.66 0.44 4.92 2.20 -0.52 -2.77 119.74 128.08 1c1s s LYS 230 Ca 0.53 -1.58 0.15 0.00 -0.36 0.00 0.00 55.97 54.71 1c1s s LYS 230 Cb -0.27 -5.15 1.05 0.00 -1.51 0.00 0.00 37.83 31.96 1c1s s LYS 230 CO 0.31 -1.98 1.96 0.28 -0.36 0.00 0.00 175.35 175.56 1c1s h VAL 231 N 6.12 0.85 -0.00 4.02 2.07 -1.70 -2.41 116.25 125.20 1c1s h VAL 231 Ca 0.21 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1c1s h VAL 231 Cb 1.00 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1c1s h VAL 231 CO 1.27 0.07 0.02 0.00 0.02 0.00 0.00 177.57 178.95 1c1s n ASN 233 N -3.08 0.35 -0.20 0.00 3.02 -0.91 -4.01 115.26 110.43 1c1s n ASN 233 Ca -0.03 -0.39 0.03 0.00 -0.03 0.00 0.00 54.58 54.16 1c1s n ASN 233 Cb 0.09 -0.12 0.07 0.00 -0.61 0.00 0.00 39.78 39.20 1c1s n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1c1s n TYR 234 N -1.09 0.16 -0.32 3.10 4.01 0.29 -4.77 117.16 118.54 1c1s n TYR 234 Ca 0.13 -0.61 -0.04 0.00 -0.16 0.00 0.00 57.90 57.22 1c1s n TYR 234 Cb 0.28 -0.08 0.08 0.00 -0.31 0.00 0.00 39.34 39.31 1c1s n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1c1s h VAL 235 N 0.53 1.25 -0.42 -0.72 2.07 -1.69 -1.08 116.25 116.19 1c1s h VAL 235 Ca 0.00 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 66.90 1c1s h VAL 235 Cb 0.70 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1c1s h VAL 235 CO 0.01 0.26 0.02 0.77 0.02 0.00 0.00 177.57 178.66 1c1s h SER 236 N 1.20 0.70 -0.83 0.57 4.64 -1.90 -0.20 113.55 117.73 1c1s h SER 236 Ca 0.31 -0.29 -0.02 0.00 -0.47 0.00 0.00 61.79 61.32 1c1s h SER 236 Cb -0.02 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 61.84 1c1s h SER 236 CO -0.06 0.82 0.45 -0.25 -0.87 0.00 0.00 176.83 176.93 1c1s h TRP 237 N 0.56 1.15 0.02 4.77 7.01 -1.85 -0.12 115.95 127.49 1c1s h TRP 237 Ca 0.12 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.09 1c1s h TRP 237 Cb 0.45 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 27.15 1c1s h TRP 237 CO 0.03 0.80 -0.01 0.82 -2.79 0.00 0.00 178.44 177.29 1c1s h ILE 238 N 1.16 1.09 -0.65 2.65 2.04 -0.90 0.00 117.51 122.90 1c1s h ILE 238 Ca 0.29 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1c1s h ILE 238 Cb 0.04 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1c1s h ILE 238 CO -0.05 0.09 0.25 0.11 0.00 0.00 0.00 178.15 178.55 1c1s h LYS 239 N -0.17 0.97 -0.38 2.37 1.57 -0.89 -1.44 116.57 118.59 1c1s h LYS 239 Ca -0.00 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.48 1c1s h LYS 239 Cb 0.16 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1c1s h LYS 239 CO 0.00 0.82 -0.22 1.96 -0.57 0.00 0.00 179.45 181.44 1c1s h GLN 240 N 0.91 0.83 -0.35 3.15 4.20 -0.93 -2.96 115.11 119.97 1c1s h GLN 240 Ca 0.21 -0.38 -0.07 0.00 0.06 0.00 0.00 58.65 58.47 1c1s h GLN 240 Cb 0.22 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1c1s h GLN 240 CO -0.02 1.02 -0.05 1.15 -0.67 0.00 0.00 178.83 180.25 1c1s h THR 241 N 0.63 1.27 0.00 -0.54 2.02 -0.85 -2.80 112.91 112.65 1c1s h THR 241 Ca 0.08 -1.09 -0.04 0.00 0.77 0.00 0.00 66.41 66.13 1c1s h THR 241 Cb 0.79 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 1c1s h THR 241 CO 0.06 0.36 -0.20 0.16 0.37 0.00 0.00 175.52 176.27 1c1s h ILE 242 N 0.45 0.54 0.00 3.11 3.07 -1.30 -2.79 117.51 120.59 1c1s h ILE 242 Ca 0.09 -1.01 -0.06 0.00 1.55 0.00 0.00 64.86 65.43 1c1s h ILE 242 Cb 0.54 1.69 -0.01 0.00 -0.27 0.00 0.00 36.82 38.77 1c1s h ILE 242 CO 0.03 0.20 -0.30 0.00 -1.05 0.00 0.00 178.15 177.03 1c1s h ALA 243 N 1.80 0.83 -0.70 0.16 0.00 -1.43 -3.21 119.26 116.70 1c1s h ALA 243 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1c1s h ALA 243 Cb 0.67 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1c1s h ALA 243 CO 0.03 0.38 0.00 0.43 0.00 0.00 0.00 179.25 180.08 1c1s n SER 244 N -3.21 3.89 0.00 0.00 7.64 -1.07 -5.12 113.62 115.76 1c1s n SER 244 Ca 0.02 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 57.90 1c1s n SER 244 Cb 0.62 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 1c1s n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62