#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ra3 s VAL 17 N 0.00 5.26 -0.15 1.39 1.01 0.14 -3.98 120.40 124.07 2ra3 s VAL 17 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.59 2ra3 s VAL 17 Cb 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.74 2ra3 s VAL 17 CO 0.00 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.15 2ra3 n GLY 18 N 2.96 0.51 0.00 4.51 0.00 -1.25 -1.95 105.19 109.97 2ra3 n GLY 18 Ca -0.13 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.24 2ra3 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ra3 n GLY 19 N -2.68 1.86 3.22 -0.02 0.00 -1.26 -4.89 105.19 101.41 2ra3 n GLY 19 Ca -0.01 -1.96 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 2ra3 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ra3 s TYR 20 N 2.40 0.19 0.03 1.61 1.13 0.03 -4.94 117.35 117.80 2ra3 s TYR 20 Ca 0.00 -0.61 -0.30 0.00 -1.41 0.00 0.00 57.07 54.74 2ra3 s TYR 20 Cb 0.00 -0.06 -0.07 0.00 -1.10 0.00 0.00 41.96 40.72 2ra3 s TYR 20 CO 0.00 -0.57 1.60 -0.80 -2.51 0.00 0.00 175.55 173.28 2ra3 s ASN 21 N -2.88 6.67 0.40 -0.18 0.01 -1.26 -0.40 114.94 117.30 2ra3 s ASN 21 Ca 0.07 2.37 -0.26 0.00 -0.71 0.00 0.00 52.86 54.32 2ra3 s ASN 21 Cb 0.05 -2.56 -0.09 0.00 0.41 0.00 0.00 41.25 39.06 2ra3 s ASN 21 CO -0.09 -0.86 1.31 0.00 -1.51 0.00 0.00 177.10 175.95 2ra3 s GLU 23 N -2.22 3.81 0.30 0.00 2.02 -1.26 -4.92 118.70 116.43 2ra3 s GLU 23 Ca 0.56 2.22 -0.30 0.00 0.02 0.00 0.00 54.97 57.47 2ra3 s GLU 23 Cb -0.38 -2.67 -0.11 0.00 0.10 0.00 0.00 34.13 31.06 2ra3 s GLU 23 CO 0.50 -0.64 1.61 -1.21 0.02 0.00 0.00 175.26 175.53 2ra3 s GLU 24 N -2.38 4.11 0.00 1.61 2.02 -1.26 -1.81 118.70 120.99 2ra3 s GLU 24 Ca 0.60 2.61 0.00 0.00 0.02 0.00 0.00 54.97 58.19 2ra3 s GLU 24 Cb -0.39 -3.01 0.00 0.00 0.10 0.00 0.00 34.13 30.82 2ra3 s GLU 24 CO 0.50 -0.65 0.00 0.09 0.02 0.00 0.00 175.26 175.22 2ra3 n ASN 25 N 2.11 -1.80 0.12 -0.19 5.03 -1.26 -4.88 115.26 114.39 2ra3 n ASN 25 Ca 0.08 0.00 0.12 0.00 0.87 0.00 0.00 54.58 55.66 2ra3 n ASN 25 Cb 0.37 -1.26 0.28 0.00 -1.02 0.00 0.00 39.78 38.15 2ra3 n ASN 25 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 2ra3 h SER 26 N 0.00 0.00 -2.16 6.41 4.64 -1.72 -3.36 113.55 117.36 2ra3 h SER 26 Ca 0.00 -0.05 -0.57 0.00 -0.47 0.00 0.00 61.79 60.71 2ra3 h SER 26 Cb 0.17 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 61.84 2ra3 h SER 26 CO 0.00 0.02 -0.81 0.52 -0.87 0.00 0.00 176.83 175.69 2ra3 n VAL 27 N -2.44 1.70 0.77 0.95 0.31 -1.26 -4.94 118.33 113.41 2ra3 n VAL 27 Ca 0.04 -5.07 0.09 0.00 -0.01 0.00 0.00 64.34 59.40 2ra3 n VAL 27 Cb 0.46 -1.42 0.44 0.00 -0.91 0.00 0.00 33.84 32.41 2ra3 n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2ra3 n PRO 28 N 0.38 0.11 0.00 5.55 -0.04 -1.26 -1.76 135.00 137.98 2ra3 n PRO 28 Ca 0.28 0.14 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 2ra3 n PRO 28 Cb 0.47 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.63 2ra3 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2ra3 n TYR 29 N -1.42 0.00 -2.43 0.54 0.18 -1.16 -2.26 117.16 110.62 2ra3 n TYR 29 Ca 0.06 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.43 2ra3 n TYR 29 Cb 0.20 -0.19 -0.03 0.00 -0.38 0.00 0.00 39.34 38.94 2ra3 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 2ra3 s GLN 30 N -2.92 4.46 0.27 -3.48 2.00 -0.72 -0.91 119.66 118.36 2ra3 s GLN 30 Ca 0.13 1.78 0.12 0.00 -2.00 0.00 0.00 55.36 55.38 2ra3 s GLN 30 Cb 0.18 -3.32 -0.05 0.00 0.80 0.00 0.00 33.01 30.61 2ra3 s GLN 30 CO 0.70 -0.19 -0.20 0.14 -0.50 0.00 0.00 175.29 175.24 2ra3 s VAL 31 N 0.75 2.44 -0.16 1.34 -7.23 -0.40 -4.44 120.40 112.69 2ra3 s VAL 31 Ca 0.57 -2.39 -0.05 0.00 -1.81 0.00 0.00 61.98 58.30 2ra3 s VAL 31 Cb -0.30 -2.28 -0.03 0.00 0.56 0.00 0.00 36.38 34.33 2ra3 s VAL 31 CO 0.31 -0.40 -0.01 -0.55 -0.31 0.00 0.00 175.10 174.14 2ra3 s SER 32 N -3.49 5.04 -0.14 4.85 0.15 -0.41 -2.22 113.70 117.48 2ra3 s SER 32 Ca 0.29 -0.06 -0.15 0.00 0.70 0.00 0.00 55.95 56.74 2ra3 s SER 32 Cb -0.05 -1.81 -0.05 0.00 -1.71 0.00 0.00 66.02 62.41 2ra3 s SER 32 CO 0.14 0.18 0.34 -0.76 1.20 0.00 0.00 173.24 174.35 2ra3 s LEU 33 N 0.28 4.27 -0.06 3.45 1.43 0.18 -0.39 118.68 127.83 2ra3 s LEU 33 Ca -0.01 0.60 0.02 0.00 -1.03 0.00 0.00 54.13 53.71 2ra3 s LEU 33 Cb -0.13 -2.45 0.02 0.00 0.03 0.00 0.00 46.19 43.65 2ra3 s LEU 33 CO 0.02 0.09 -0.10 0.21 0.23 0.00 0.00 176.35 176.81 2ra3 s ASN 34 N 0.39 1.52 -0.23 2.29 3.84 -0.10 -1.54 114.94 121.11 2ra3 s ASN 34 Ca 0.19 -0.25 0.10 0.00 0.21 0.00 0.00 52.86 53.12 2ra3 s ASN 34 Cb -0.14 -0.71 0.43 0.00 -0.55 0.00 0.00 41.25 40.29 2ra3 s ASN 34 CO 0.06 0.00 1.21 -1.54 -2.79 0.00 0.00 177.10 174.04 2ra3 n SER 37 N 3.91 2.69 0.00 -4.21 3.41 -1.26 -1.18 113.62 116.98 2ra3 n SER 37 Ca -0.23 -3.76 0.00 0.00 -0.26 0.00 0.00 58.87 54.61 2ra3 n SER 37 Cb 0.51 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2ra3 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ra3 n GLY 38 N -0.93 1.35 3.59 5.00 0.00 -1.26 -5.04 105.19 107.91 2ra3 n GLY 38 Ca 0.26 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.23 2ra3 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ra3 s TYR 39 N -2.20 -0.23 -0.03 1.61 1.13 -1.26 -5.13 117.35 111.24 2ra3 s TYR 39 Ca 0.00 0.06 -0.30 0.00 -1.41 0.00 0.00 57.07 55.42 2ra3 s TYR 39 Cb 0.00 0.56 -0.05 0.00 -1.10 0.00 0.00 41.96 41.37 2ra3 s TYR 39 CO 0.00 -0.54 1.43 -1.58 -2.51 0.00 0.00 175.55 172.34 2ra3 s HIS 40 N -2.99 2.70 0.00 -3.49 5.65 -1.26 -4.25 115.29 111.64 2ra3 s HIS 40 Ca 0.08 0.73 0.00 0.00 0.25 0.00 0.00 55.06 56.13 2ra3 s HIS 40 Cb -0.01 -3.69 0.00 0.00 -1.18 0.00 0.00 32.58 27.71 2ra3 s HIS 40 CO -0.05 -2.60 0.00 1.97 -0.65 0.00 0.00 174.74 173.41 2ra3 n PHE 41 N 5.85 0.00 -3.66 3.88 1.16 -0.59 -5.00 117.46 119.10 2ra3 n PHE 41 Ca 0.14 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.64 2ra3 n PHE 41 Cb 0.44 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.29 2ra3 n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2ra3 n GLY 43 N -0.41 2.18 3.79 0.00 0.00 0.11 -0.65 105.19 110.21 2ra3 n GLY 43 Ca -0.09 -2.22 -0.03 0.00 0.00 0.00 0.00 46.02 43.69 2ra3 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ra3 s GLY 44 N -3.79 -0.10 -0.06 -0.02 0.00 -0.94 -3.68 107.32 98.72 2ra3 s GLY 44 Ca 0.38 -0.03 0.02 0.00 0.00 0.00 0.00 44.72 45.10 2ra3 s GLY 44 CO 0.24 0.91 -0.11 -0.56 0.00 0.00 0.00 173.10 173.59 2ra3 s SER 45 N -3.12 1.62 -0.28 1.64 0.01 -0.12 -1.28 113.70 112.17 2ra3 s SER 45 Ca 0.16 -0.27 -0.29 0.00 1.31 0.00 0.00 55.95 56.86 2ra3 s SER 45 Cb -0.01 -0.75 0.01 0.00 0.21 0.00 0.00 66.02 65.47 2ra3 s SER 45 CO 0.03 0.01 1.18 -0.22 0.41 0.00 0.00 173.24 174.65 2ra3 s LEU 46 N 0.74 3.96 -0.00 2.44 2.96 -0.09 -0.90 118.68 127.79 2ra3 s LEU 46 Ca -0.13 1.22 0.12 0.00 -0.22 0.00 0.00 54.13 55.11 2ra3 s LEU 46 Cb -0.15 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 42.86 2ra3 s LEU 46 CO 0.03 -0.92 0.48 2.30 -1.32 0.00 0.00 176.35 176.92 2ra3 n ILE 47 N 5.88 0.00 -3.59 6.68 -5.35 -0.41 -1.16 119.36 121.41 2ra3 n ILE 47 Ca 0.13 -0.23 -0.10 0.00 -0.27 0.00 0.00 62.75 62.28 2ra3 n ILE 47 Cb 0.46 0.94 -0.02 0.00 -1.74 0.00 0.00 39.64 39.28 2ra3 n ILE 47 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2ra3 s ASN 48 N -2.21 -0.43 0.63 7.28 2.47 -1.13 -4.68 114.94 116.87 2ra3 s ASN 48 Ca 0.04 -0.24 0.34 0.00 0.42 0.00 0.00 52.86 53.42 2ra3 s ASN 48 Cb 0.09 0.62 1.92 0.00 -1.45 0.00 0.00 41.25 42.43 2ra3 s ASN 48 CO 0.48 -1.07 2.19 -0.33 -3.72 0.00 0.00 177.10 174.65 2ra3 h GLU 49 N 2.05 0.00 -0.01 0.43 5.08 -1.95 -2.81 114.58 117.36 2ra3 h GLU 49 Ca -0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2ra3 h GLU 49 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2ra3 h GLU 49 CO 0.34 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.39 2ra3 n GLN 50 N -3.46 0.43 -4.15 2.33 6.02 -1.26 -0.76 117.38 116.53 2ra3 n GLN 50 Ca -0.01 -0.88 -0.16 0.00 -0.01 0.00 0.00 57.00 55.93 2ra3 n GLN 50 Cb 0.21 -1.01 -0.15 0.00 1.02 0.00 0.00 30.24 30.31 2ra3 n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2ra3 s TRP 51 N -0.38 0.50 -0.03 1.08 0.52 -1.06 -0.31 118.94 119.26 2ra3 s TRP 51 Ca 0.01 -0.10 0.07 0.00 0.02 0.00 0.00 56.10 56.10 2ra3 s TRP 51 Cb 0.01 -0.36 -0.01 0.00 -1.15 0.00 0.00 33.47 31.95 2ra3 s TRP 51 CO 0.01 -0.04 -0.24 0.08 0.02 0.00 0.00 176.95 176.78 2ra3 s VAL 52 N 0.09 1.89 -0.14 4.03 1.01 -0.03 -1.29 120.40 125.95 2ra3 s VAL 52 Ca -0.01 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 2ra3 s VAL 52 Cb -0.05 -1.58 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 2ra3 s VAL 52 CO -0.00 0.53 0.25 -0.69 0.00 0.00 0.00 175.10 175.19 2ra3 s VAL 53 N -0.39 5.33 0.00 2.92 1.01 -0.08 -0.36 120.40 128.83 2ra3 s VAL 53 Ca 0.04 0.45 0.00 0.00 0.00 0.00 0.00 61.98 62.48 2ra3 s VAL 53 Cb -0.11 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2ra3 s VAL 53 CO 0.01 0.47 0.00 -0.24 0.00 0.00 0.00 175.10 175.33 2ra3 n SER 54 N 3.04 0.00 -4.88 3.32 2.88 -0.28 -0.95 113.62 116.76 2ra3 n SER 54 Ca -0.14 -0.70 -0.31 0.00 -1.33 0.00 0.00 58.87 56.38 2ra3 n SER 54 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.94 2ra3 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ra3 s ALA 55 N -1.80 3.63 0.39 -1.46 0.00 -1.26 -0.99 121.76 120.27 2ra3 s ALA 55 Ca 0.00 -0.38 0.12 0.00 0.00 0.00 0.00 51.96 51.70 2ra3 s ALA 55 Cb 0.00 -2.34 0.78 0.00 0.00 0.00 0.00 23.12 21.56 2ra3 s ALA 55 CO 0.00 0.51 1.87 0.78 0.00 0.00 0.00 175.76 178.92 2ra3 h GLY 56 N 2.49 0.05 1.49 0.00 0.00 -1.67 -2.11 103.07 103.32 2ra3 h GLY 56 Ca -0.47 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 46.83 2ra3 h GLY 56 CO 0.70 0.03 0.00 -2.39 0.00 0.00 0.00 176.54 174.88 2ra3 n HIS 57 N -4.17 0.00 1.28 5.60 1.44 -1.26 -1.80 115.22 116.31 2ra3 n HIS 57 Ca -0.02 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.76 2ra3 n HIS 57 Cb 0.35 -0.24 0.26 0.00 0.12 0.00 0.00 29.99 30.48 2ra3 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2ra3 s TYR 59 N -1.74 2.92 0.04 0.00 5.04 -0.74 -5.00 117.35 117.86 2ra3 s TYR 59 Ca 0.24 0.80 -0.05 0.00 -2.44 0.00 0.00 57.07 55.62 2ra3 s TYR 59 Cb 0.13 -3.96 -0.01 0.00 0.35 0.00 0.00 41.96 38.46 2ra3 s TYR 59 CO 0.18 -3.31 0.07 0.15 -1.34 0.00 0.00 175.55 171.30 2ra3 s LYS 60 N 0.00 0.56 0.51 4.97 1.02 -1.26 -5.06 119.74 120.48 2ra3 s LYS 60 Ca 0.64 -0.78 0.30 0.00 0.02 0.00 0.00 55.97 56.15 2ra3 s LYS 60 Cb -0.45 0.22 1.19 0.00 -0.52 0.00 0.00 37.83 38.26 2ra3 s LYS 60 CO 0.42 -0.13 1.92 0.66 -0.92 0.00 0.00 175.35 177.30 2ra3 h SER 61 N 3.71 0.00 -3.51 2.83 4.64 -2.00 -3.41 113.55 115.81 2ra3 h SER 61 Ca -0.33 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.61 2ra3 h SER 61 Cb 1.18 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.94 2ra3 h SER 61 CO 0.51 0.08 -0.76 -0.13 -0.87 0.00 0.00 176.83 175.65 2ra3 s ARG 62 N -3.67 0.67 -0.04 4.77 1.81 -1.26 -4.98 118.95 116.25 2ra3 s ARG 62 Ca 0.01 -0.07 -0.02 0.00 -1.72 0.00 0.00 55.73 53.93 2ra3 s ARG 62 Cb 0.09 -0.71 0.02 0.00 -0.45 0.00 0.00 34.95 33.91 2ra3 s ARG 62 CO 0.58 -0.07 0.10 0.42 -0.68 0.00 0.00 175.30 175.65 2ra3 s ILE 63 N 0.83 -0.03 -0.25 1.52 1.01 -1.26 -4.83 121.20 118.19 2ra3 s ILE 63 Ca -0.10 0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.55 2ra3 s ILE 63 Cb -0.13 -0.16 -0.05 0.00 0.01 0.00 0.00 42.46 42.13 2ra3 s ILE 63 CO -0.00 0.04 0.15 -1.58 0.00 0.00 0.00 174.94 173.55 2ra3 s GLN 64 N 0.63 3.97 -0.16 2.79 0.74 -0.33 -0.89 119.66 126.41 2ra3 s GLN 64 Ca -0.05 -0.32 -0.21 0.00 0.05 0.00 0.00 55.36 54.83 2ra3 s GLN 64 Cb -0.07 -3.52 -0.03 0.00 1.10 0.00 0.00 33.01 30.50 2ra3 s GLN 64 CO -0.03 -0.03 0.61 0.08 -0.55 0.00 0.00 175.29 175.37 2ra3 s VAL 65 N 1.30 5.05 -0.25 1.34 1.01 0.20 -0.93 120.40 128.12 2ra3 s VAL 65 Ca 0.07 1.18 -0.04 0.00 0.00 0.00 0.00 61.98 63.19 2ra3 s VAL 65 Cb -0.14 -3.94 0.01 0.00 0.00 0.00 0.00 36.38 32.31 2ra3 s VAL 65 CO 0.06 0.17 -0.01 -0.13 0.00 0.00 0.00 175.10 175.19 2ra3 s ARG 66 N 1.53 3.09 0.22 2.72 0.52 0.47 -0.70 118.95 126.80 2ra3 s ARG 66 Ca 0.29 -0.83 0.08 0.00 -0.52 0.00 0.00 55.73 54.76 2ra3 s ARG 66 Cb -0.16 -3.12 -0.04 0.00 0.52 0.00 0.00 34.95 32.15 2ra3 s ARG 66 CO 0.11 -0.35 0.03 -0.51 0.02 0.00 0.00 175.30 174.61 2ra3 s LEU 67 N 1.43 3.36 -1.07 2.53 1.02 0.11 -1.29 118.68 124.77 2ra3 s LEU 67 Ca 0.03 -0.46 0.00 0.00 0.02 0.00 0.00 54.13 53.71 2ra3 s LEU 67 Cb -0.16 -1.94 0.00 0.00 0.02 0.00 0.00 46.19 44.11 2ra3 s LEU 67 CO -0.02 0.03 0.00 0.61 0.02 0.00 0.00 176.35 176.99 2ra3 n GLY 69 N -0.61 1.03 3.80 -3.19 0.00 -1.26 -0.99 105.19 103.97 2ra3 n GLY 69 Ca -0.08 -0.55 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 2ra3 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ra3 s GLU 70 N -3.07 4.39 0.04 1.61 0.41 -1.26 -4.02 118.70 116.80 2ra3 s GLU 70 Ca 0.00 0.98 0.00 0.00 -0.41 0.00 0.00 54.97 55.54 2ra3 s GLU 70 Cb 0.00 -3.15 0.00 0.00 -1.78 0.00 0.00 34.13 29.20 2ra3 s GLU 70 CO 0.00 0.54 0.00 1.58 -0.49 0.00 0.00 175.26 176.89 2ra3 n HIS 71 N 1.37 -0.02 -3.14 1.61 -0.00 -1.26 -4.93 115.22 108.84 2ra3 n HIS 71 Ca -0.06 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.24 2ra3 n HIS 71 Cb 0.50 0.01 -0.07 0.00 -0.00 0.00 0.00 29.99 30.43 2ra3 n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2ra3 s ASN 72 N -5.39 6.32 0.00 0.26 3.84 -1.26 -1.98 114.94 116.73 2ra3 s ASN 72 Ca 0.00 -0.27 0.22 0.00 0.21 0.00 0.00 52.86 53.02 2ra3 s ASN 72 Cb 0.00 -2.31 1.09 0.00 -0.55 0.00 0.00 41.25 39.49 2ra3 s ASN 72 CO 0.00 -0.70 1.71 2.30 -2.79 0.00 0.00 177.10 177.62 2ra3 n ILE 73 N 5.73 0.33 0.04 -5.21 -5.35 -0.52 -3.23 119.36 111.15 2ra3 n ILE 73 Ca -0.02 0.08 0.11 0.00 -0.27 0.00 0.00 62.75 62.64 2ra3 n ILE 73 Cb 0.48 -0.72 -0.09 0.00 -1.74 0.00 0.00 39.64 37.57 2ra3 n ILE 73 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2ra3 n GLU 74 N -1.31 0.63 -4.33 6.28 0.00 -1.26 -4.95 120.64 115.71 2ra3 n GLU 74 Ca 0.10 -0.04 -0.20 0.00 0.00 0.00 0.00 57.16 57.02 2ra3 n GLU 74 Cb 0.19 -1.67 -0.13 0.00 0.00 0.00 0.00 31.44 29.83 2ra3 n GLU 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2ra3 s VAL 75 N -3.41 1.13 0.09 6.31 0.11 -1.20 -5.11 120.40 118.32 2ra3 s VAL 75 Ca -0.04 -1.07 -0.31 0.00 -2.93 0.00 0.00 61.98 57.63 2ra3 s VAL 75 Cb 0.12 -1.04 -0.08 0.00 -1.53 0.00 0.00 36.38 33.85 2ra3 s VAL 75 CO 0.85 -0.03 1.47 -0.76 -3.33 0.00 0.00 175.10 173.29 2ra3 s LEU 76 N -1.26 4.36 0.00 2.54 1.02 -1.26 -4.78 118.68 119.29 2ra3 s LEU 76 Ca 0.01 2.34 0.04 0.00 0.02 0.00 0.00 54.13 56.54 2ra3 s LEU 76 Cb -0.08 -3.58 -0.01 0.00 0.02 0.00 0.00 46.19 42.54 2ra3 s LEU 76 CO 0.01 -0.74 0.34 -0.62 0.02 0.00 0.00 176.35 175.37 2ra3 n GLU 77 N 4.60 3.39 0.00 1.70 1.02 -1.26 -5.03 120.64 125.07 2ra3 n GLU 77 Ca 0.13 -0.29 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 2ra3 n GLU 77 Cb 0.42 -0.83 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 2ra3 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ra3 n GLY 78 N 0.76 0.50 0.50 0.62 0.00 -1.26 -4.93 105.19 101.38 2ra3 n GLY 78 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.08 2ra3 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ra3 n ASN 79 N 0.00 2.41 -4.78 1.61 3.02 -1.26 -5.02 115.26 111.23 2ra3 n ASN 79 Ca 0.00 -1.75 -0.35 0.00 -0.03 0.00 0.00 54.58 52.45 2ra3 n ASN 79 Cb 0.00 -0.12 -0.01 0.00 -0.61 0.00 0.00 39.78 39.04 2ra3 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2ra3 s GLU 80 N -0.93 3.55 -0.09 3.52 8.01 -1.26 -4.46 118.70 127.04 2ra3 s GLU 80 Ca 0.17 1.53 0.02 0.00 0.01 0.00 0.00 54.97 56.70 2ra3 s GLU 80 Cb 0.10 -2.07 0.01 0.00 -4.31 0.00 0.00 34.13 27.87 2ra3 s GLU 80 CO 0.14 -0.67 -0.14 -0.65 0.01 0.00 0.00 175.26 173.94 2ra3 s GLN 81 N -3.22 2.00 -0.24 1.61 -0.21 -0.16 -4.99 119.66 114.45 2ra3 s GLN 81 Ca 0.70 -0.49 -0.04 0.00 0.02 0.00 0.00 55.36 55.55 2ra3 s GLN 81 Cb -0.21 -1.69 -0.00 0.00 1.00 0.00 0.00 33.01 32.11 2ra3 s GLN 81 CO 0.25 -0.03 -0.01 -0.06 -2.12 0.00 0.00 175.29 173.32 2ra3 s PHE 82 N 0.88 3.02 -0.08 0.91 0.08 -1.26 -0.71 117.98 120.82 2ra3 s PHE 82 Ca -0.10 -1.00 -0.00 0.00 0.12 0.00 0.00 56.93 55.96 2ra3 s PHE 82 Cb -0.15 -2.14 0.02 0.00 -0.57 0.00 0.00 43.02 40.18 2ra3 s PHE 82 CO 0.01 -0.57 -0.05 0.42 -0.10 0.00 0.00 175.22 174.93 2ra3 s ILE 83 N 1.47 0.71 0.42 0.64 1.01 0.12 -4.98 121.20 120.59 2ra3 s ILE 83 Ca 0.04 -0.14 -0.24 0.00 0.00 0.00 0.00 60.65 60.32 2ra3 s ILE 83 Cb -0.15 -0.76 -0.08 0.00 0.01 0.00 0.00 42.46 41.47 2ra3 s ILE 83 CO -0.02 0.30 1.09 0.20 0.00 0.00 0.00 174.94 176.51 2ra3 s ASN 84 N 1.48 6.56 0.23 3.58 0.01 -1.26 -0.63 114.94 124.92 2ra3 s ASN 84 Ca -0.01 2.12 -0.30 0.00 -0.71 0.00 0.00 52.86 53.96 2ra3 s ASN 84 Cb -0.13 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 38.84 2ra3 s ASN 84 CO -0.04 -0.64 1.42 0.00 -1.51 0.00 0.00 177.10 176.34 2ra3 s ALA 85 N -1.63 3.62 -0.17 0.60 0.00 -0.07 -0.99 121.76 123.12 2ra3 s ALA 85 Ca 0.60 1.29 0.03 0.00 0.00 0.00 0.00 51.96 53.88 2ra3 s ALA 85 Cb -0.24 -3.55 -0.22 0.00 0.00 0.00 0.00 23.12 19.11 2ra3 s ALA 85 CO 0.30 -0.71 0.15 0.00 0.00 0.00 0.00 175.76 175.50 2ra3 n ALA 86 N 2.49 1.26 -2.80 0.00 0.00 0.79 -4.73 120.51 117.52 2ra3 n ALA 86 Ca 0.07 -0.91 -0.15 0.00 0.00 0.00 0.00 53.44 52.45 2ra3 n ALA 86 Cb 0.41 -0.42 -0.14 0.00 0.00 0.00 0.00 19.45 19.29 2ra3 n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2ra3 s LYS 87 N -2.54 0.37 -0.18 0.00 1.02 -1.10 -5.00 119.74 112.32 2ra3 s LYS 87 Ca -0.22 -0.26 -0.02 0.00 0.02 0.00 0.00 55.97 55.48 2ra3 s LYS 87 Cb 0.08 -0.31 0.05 0.00 -0.52 0.00 0.00 37.83 37.13 2ra3 s LYS 87 CO 0.73 0.08 0.01 0.42 -0.92 0.00 0.00 175.35 175.67 2ra3 s ILE 88 N -0.35 0.66 -0.33 2.17 1.01 -1.26 -0.81 121.20 122.29 2ra3 s ILE 88 Ca -0.01 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.14 2ra3 s ILE 88 Cb -0.03 -1.06 0.10 0.00 0.01 0.00 0.00 42.46 41.48 2ra3 s ILE 88 CO -0.00 -0.10 0.06 -0.63 0.00 0.00 0.00 174.94 174.27 2ra3 s ILE 89 N 1.81 1.98 0.38 2.92 1.01 0.45 -5.00 121.20 124.74 2ra3 s ILE 89 Ca -0.00 -2.12 -0.20 0.00 0.00 0.00 0.00 60.65 58.32 2ra3 s ILE 89 Cb -0.16 -2.46 -0.10 0.00 0.01 0.00 0.00 42.46 39.75 2ra3 s ILE 89 CO -0.07 -0.60 0.89 -0.60 0.00 0.00 0.00 174.94 174.56 2ra3 s ARG 90 N 1.06 4.21 0.21 2.79 3.52 -1.26 -0.90 118.95 128.58 2ra3 s ARG 90 Ca 0.10 1.02 -0.32 0.00 -0.13 0.00 0.00 55.73 56.40 2ra3 s ARG 90 Cb -0.19 -2.34 -0.14 0.00 -1.56 0.00 0.00 34.95 30.73 2ra3 s ARG 90 CO -0.11 0.07 1.45 1.58 -0.81 0.00 0.00 175.30 177.48 2ra3 n HIS 91 N -0.38 2.16 0.29 5.12 -0.00 -0.50 -4.84 115.22 117.08 2ra3 n HIS 91 Ca 0.05 0.39 0.18 0.00 -0.00 0.00 0.00 57.72 58.34 2ra3 n HIS 91 Cb 0.53 -2.48 0.86 0.00 -0.00 0.00 0.00 29.99 28.90 2ra3 n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2ra3 h PRO 92 N 4.75 0.00 -0.49 1.57 0.13 -1.92 -1.72 132.00 134.31 2ra3 h PRO 92 Ca -0.45 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.57 2ra3 h PRO 92 Cb 1.27 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.34 2ra3 h PRO 92 CO 0.80 0.03 0.09 1.04 -0.23 0.00 0.00 178.00 179.73 2ra3 n GLN 93 N -3.20 3.34 -1.64 0.86 3.00 -1.26 -4.99 117.38 113.49 2ra3 n GLN 93 Ca -0.01 -3.03 -0.46 0.00 -0.01 0.00 0.00 57.00 53.49 2ra3 n GLN 93 Cb 0.22 -2.04 -0.03 0.00 0.00 0.00 0.00 30.24 28.39 2ra3 n GLN 93 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.06 178.04 2ra3 n TYR 94 N -0.32 1.87 -4.04 1.08 9.36 -0.65 -4.64 117.16 119.82 2ra3 n TYR 94 Ca 0.31 0.51 -0.31 0.00 3.32 0.00 0.00 57.90 61.73 2ra3 n TYR 94 Cb 1.14 -2.40 -0.16 0.00 -0.63 0.00 0.00 39.34 37.29 2ra3 n TYR 94 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2ra3 s ASP 95 N 0.23 3.49 0.00 2.98 -1.08 -0.78 -5.01 116.67 116.50 2ra3 s ASP 95 Ca 0.71 -0.91 0.23 0.00 -0.52 0.00 0.00 52.55 52.06 2ra3 s ASP 95 Cb -0.72 -1.35 1.08 0.00 -1.46 0.00 0.00 42.92 40.47 2ra3 s ASP 95 CO 0.50 -0.11 1.76 -2.11 0.52 0.00 0.00 175.17 175.72 2ra3 n ARG 96 N 4.63 0.15 -0.14 4.34 1.85 -1.26 -0.44 116.66 125.79 2ra3 n ARG 96 Ca -0.16 0.09 -0.28 0.00 -1.00 0.00 0.00 57.85 56.49 2ra3 n ARG 96 Cb 0.47 -1.50 -0.10 0.00 -1.05 0.00 0.00 32.46 30.28 2ra3 n ARG 96 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2ra3 n LYS 97 N -1.40 0.59 0.12 2.89 4.76 -1.26 -4.60 118.16 119.26 2ra3 n LYS 97 Ca 0.08 0.24 0.12 0.00 -2.87 0.00 0.00 58.31 55.88 2ra3 n LYS 97 Cb 0.23 -1.48 0.12 0.00 -1.84 0.00 0.00 35.03 32.06 2ra3 n LYS 97 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2ra3 h THR 98 N -0.87 0.00 -0.28 -0.18 1.35 -2.00 -3.48 112.91 107.46 2ra3 h THR 98 Ca -0.69 -0.80 -0.12 0.00 -0.55 0.00 0.00 66.41 64.25 2ra3 h THR 98 Cb 1.65 1.47 -0.05 0.00 -1.73 0.00 0.00 68.15 69.49 2ra3 h THR 98 CO -0.38 0.00 -0.11 0.18 -0.25 0.00 0.00 175.52 174.96 2ra3 n LEU 99 N -2.56 -0.12 -4.77 3.87 4.77 0.41 -5.00 117.00 113.60 2ra3 n LEU 99 Ca 0.02 0.15 -0.41 0.00 -0.03 0.00 0.00 56.01 55.74 2ra3 n LEU 99 Cb 0.50 -1.79 -0.01 0.00 -2.33 0.00 0.00 43.42 39.79 2ra3 n LEU 99 CO 0.37 -0.62 1.05 0.21 -1.33 0.00 0.00 177.39 177.07 2ra3 s ASN 100 N -2.41 6.52 -1.01 -1.43 3.04 -1.25 -3.19 114.94 115.21 2ra3 s ASN 100 Ca 0.00 2.86 -0.06 0.00 0.04 0.00 0.00 52.86 55.70 2ra3 s ASN 100 Cb 0.00 -2.66 0.01 0.00 -1.54 0.00 0.00 41.25 37.06 2ra3 s ASN 100 CO 0.00 -0.73 0.88 0.59 -3.04 0.00 0.00 177.10 174.80 2ra3 n ASN 101 N 0.57 -4.82 -4.14 -4.21 3.02 -1.26 -1.87 115.26 102.55 2ra3 n ASN 101 Ca 0.01 -0.42 -0.43 0.00 -0.03 0.00 0.00 54.58 53.71 2ra3 n ASN 101 Cb 0.41 -3.94 0.00 0.00 -0.61 0.00 0.00 39.78 35.63 2ra3 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2ra3 n ASP 102 N -2.02 4.46 -3.73 6.41 2.03 -1.19 -4.16 116.55 118.34 2ra3 n ASP 102 Ca -0.03 -2.90 -0.14 0.00 0.52 0.00 0.00 54.79 52.25 2ra3 n ASP 102 Cb 0.56 -1.68 -0.08 0.00 -0.72 0.00 0.00 41.12 39.19 2ra3 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2ra3 s ILE 103 N 3.39 0.05 -0.02 5.18 2.07 -1.26 -3.56 121.20 127.05 2ra3 s ILE 103 Ca 0.49 -0.42 -0.15 0.00 -1.41 0.00 0.00 60.65 59.16 2ra3 s ILE 103 Cb 0.09 -0.69 0.02 0.00 0.13 0.00 0.00 42.46 42.01 2ra3 s ILE 103 CO -0.01 -0.23 0.32 -0.32 -1.91 0.00 0.00 174.94 172.79 2ra3 s MET 104 N -1.41 0.65 -0.08 3.50 -2.45 -0.16 -1.41 119.30 117.95 2ra3 s MET 104 Ca -0.13 -0.13 0.01 0.00 -1.25 0.00 0.00 55.69 54.20 2ra3 s MET 104 Cb -0.04 0.29 -0.03 0.00 1.25 0.00 0.00 34.83 36.30 2ra3 s MET 104 CO 0.04 -0.18 -0.10 -0.51 1.05 0.00 0.00 175.02 175.33 2ra3 s LEU 105 N -1.20 2.97 -0.15 4.11 1.43 -0.08 -1.12 118.68 124.65 2ra3 s LEU 105 Ca -0.12 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2ra3 s LEU 105 Cb -0.05 -1.64 -0.00 0.00 0.03 0.00 0.00 46.19 44.53 2ra3 s LEU 105 CO 0.04 0.32 -0.16 -0.63 0.23 0.00 0.00 176.35 176.14 2ra3 s ILE 106 N -0.54 2.61 -0.19 -0.59 1.01 0.51 -0.41 121.20 123.60 2ra3 s ILE 106 Ca 0.08 -0.80 -0.15 0.00 0.00 0.00 0.00 60.65 59.78 2ra3 s ILE 106 Cb -0.12 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2ra3 s ILE 106 CO 0.02 0.52 0.34 -0.75 0.00 0.00 0.00 174.94 175.07 2ra3 s LYS 107 N 0.73 4.19 0.46 2.79 2.20 0.01 -0.85 119.74 129.26 2ra3 s LYS 107 Ca -0.07 0.12 -0.22 0.00 -0.36 0.00 0.00 55.97 55.45 2ra3 s LYS 107 Cb -0.16 -3.50 -0.08 0.00 -1.51 0.00 0.00 37.83 32.58 2ra3 s LYS 107 CO 0.01 0.05 1.06 -0.51 -0.36 0.00 0.00 175.35 175.60 2ra3 s LEU 108 N 1.03 3.94 0.47 5.43 1.43 0.58 -0.15 118.68 131.42 2ra3 s LEU 108 Ca 0.17 2.01 0.27 0.00 -1.03 0.00 0.00 54.13 55.55 2ra3 s LEU 108 Cb -0.14 -4.42 1.00 0.00 0.03 0.00 0.00 46.19 42.66 2ra3 s LEU 108 CO 0.06 -0.73 1.85 0.77 0.23 0.00 0.00 176.35 178.53 2ra3 h SER 109 N 1.86 0.00 -5.33 2.29 4.64 -1.35 -3.41 113.55 112.25 2ra3 h SER 109 Ca -0.49 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.68 2ra3 h SER 109 Cb 1.22 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.17 2ra3 h SER 109 CO 0.60 0.14 -0.55 -0.94 -0.87 0.00 0.00 176.83 175.21 2ra3 s SER 110 N -6.03 0.25 0.12 4.97 1.04 -1.26 -5.00 113.70 107.79 2ra3 s SER 110 Ca 0.01 -1.04 -0.30 0.00 0.48 0.00 0.00 55.95 55.10 2ra3 s SER 110 Cb 0.09 0.32 -0.06 0.00 0.10 0.00 0.00 66.02 66.47 2ra3 s SER 110 CO 0.61 -0.75 1.10 -0.13 0.98 0.00 0.00 173.24 175.05 2ra3 s ARG 111 N -3.99 4.56 0.45 4.02 0.52 -1.26 -4.84 118.95 118.41 2ra3 s ARG 111 Ca 0.18 1.67 -0.25 0.00 -0.52 0.00 0.00 55.73 56.81 2ra3 s ARG 111 Cb 0.06 -3.33 -0.08 0.00 0.52 0.00 0.00 34.95 32.12 2ra3 s ARG 111 CO -0.02 -0.02 1.37 0.00 0.02 0.00 0.00 175.30 176.65 2ra3 s ALA 112 N 0.30 3.16 -0.21 2.13 0.00 0.06 -4.97 121.76 122.23 2ra3 s ALA 112 Ca 0.52 1.35 -0.25 0.00 0.00 0.00 0.00 51.96 53.58 2ra3 s ALA 112 Cb -0.28 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.29 2ra3 s ALA 112 CO 0.32 -1.09 0.83 0.08 0.00 0.00 0.00 175.76 175.90 2ra3 s VAL 113 N -1.25 4.86 -0.21 0.00 1.01 -1.26 -4.90 120.40 118.65 2ra3 s VAL 113 Ca 0.62 1.58 -0.20 0.00 0.00 0.00 0.00 61.98 63.98 2ra3 s VAL 113 Cb -0.41 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 31.83 2ra3 s VAL 113 CO 0.52 -0.03 0.61 -0.63 0.00 0.00 0.00 175.10 175.56 2ra3 s ILE 114 N 2.54 5.03 0.00 2.22 -1.09 -1.26 -4.66 121.20 123.98 2ra3 s ILE 114 Ca 0.36 1.13 0.00 0.00 -2.23 0.00 0.00 60.65 59.91 2ra3 s ILE 114 Cb -0.16 -3.92 0.00 0.00 -1.58 0.00 0.00 42.46 36.80 2ra3 s ILE 114 CO 0.09 0.11 0.00 -0.46 -1.23 0.00 0.00 174.94 173.45 2ra3 n ASN 115 N 5.10 0.00 0.28 3.58 0.23 -0.00 -4.98 115.26 119.47 2ra3 n ASN 115 Ca -0.02 -0.19 0.16 0.00 -0.53 0.00 0.00 54.58 54.01 2ra3 n ASN 115 Cb 0.50 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 38.99 2ra3 n ASN 115 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ra3 h ALA 116 N 1.68 1.10 0.00 -2.53 0.00 -2.00 -3.06 119.26 114.45 2ra3 h ALA 116 Ca 0.00 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 2ra3 h ALA 116 Cb 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2ra3 h ALA 116 CO 0.00 0.08 -2.10 0.72 0.00 0.00 0.00 179.25 177.95 2ra3 n HIS 117 N -3.30 0.12 -3.92 0.00 8.25 -1.26 -4.88 115.22 110.22 2ra3 n HIS 117 Ca -0.01 0.04 -0.22 0.00 -0.26 0.00 0.00 57.72 57.27 2ra3 n HIS 117 Cb 0.25 -0.79 -0.17 0.00 1.12 0.00 0.00 29.99 30.39 2ra3 n HIS 117 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2ra3 s VAL 118 N -2.99 0.46 0.24 1.59 1.01 -1.15 -4.14 120.40 115.41 2ra3 s VAL 118 Ca -0.08 0.01 -0.22 0.00 0.00 0.00 0.00 61.98 61.69 2ra3 s VAL 118 Cb 0.10 -0.56 0.05 0.00 0.00 0.00 0.00 36.38 35.97 2ra3 s VAL 118 CO 0.86 0.25 0.86 -0.94 0.00 0.00 0.00 175.10 176.13 2ra3 s SER 119 N 1.55 -0.15 0.29 3.32 1.04 -0.96 -0.82 113.70 117.96 2ra3 s SER 119 Ca -0.01 -0.63 0.02 0.00 0.48 0.00 0.00 55.95 55.81 2ra3 s SER 119 Cb -0.13 0.63 -0.03 0.00 0.10 0.00 0.00 66.02 66.59 2ra3 s SER 119 CO -0.03 -1.20 0.45 0.42 0.98 0.00 0.00 173.24 173.86 2ra3 s THR 120 N -3.20 5.18 -0.08 2.02 -4.23 -1.26 -2.99 115.64 111.08 2ra3 s THR 120 Ca 0.14 -0.68 0.01 0.00 -1.18 0.00 0.00 61.69 59.98 2ra3 s THR 120 Cb -0.04 -3.85 -0.02 0.00 1.34 0.00 0.00 72.50 69.93 2ra3 s THR 120 CO 0.06 -0.43 -0.11 -0.51 -0.54 0.00 0.00 174.62 173.09 2ra3 s ILE 121 N -2.13 3.31 0.36 2.99 1.10 -0.31 -4.86 121.20 121.66 2ra3 s ILE 121 Ca 0.37 -0.61 -0.26 0.00 -0.51 0.00 0.00 60.65 59.64 2ra3 s ILE 121 Cb -0.09 -2.34 -0.09 0.00 0.15 0.00 0.00 42.46 40.08 2ra3 s ILE 121 CO 0.32 0.57 1.13 -0.44 -2.11 0.00 0.00 174.94 174.41 2ra3 s SER 122 N -0.45 6.82 0.68 4.50 0.01 -1.26 -4.54 113.70 119.46 2ra3 s SER 122 Ca 0.06 2.27 -0.14 0.00 1.31 0.00 0.00 55.95 59.44 2ra3 s SER 122 Cb -0.12 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.51 2ra3 s SER 122 CO 0.02 -0.46 1.12 -0.76 0.41 0.00 0.00 173.24 173.57 2ra3 s LEU 123 N -2.18 3.34 0.36 2.44 1.43 -1.26 -0.80 118.68 122.01 2ra3 s LEU 123 Ca 0.53 2.02 -0.26 0.00 -1.03 0.00 0.00 54.13 55.39 2ra3 s LEU 123 Cb -0.29 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.28 2ra3 s LEU 123 CO 0.37 -1.76 1.05 -2.16 0.23 0.00 0.00 176.35 174.09 2ra3 s PRO 124 N -4.17 4.33 0.00 1.29 0.04 -1.26 -4.69 135.00 130.55 2ra3 s PRO 124 Ca 0.67 1.57 0.13 0.00 0.04 0.00 0.00 61.00 63.41 2ra3 s PRO 124 Cb -0.21 -2.75 0.33 0.00 0.04 0.00 0.00 34.50 31.91 2ra3 s PRO 124 CO 0.44 -0.00 1.25 0.25 0.04 0.00 0.00 177.00 178.97 2ra3 n THR 125 N 0.34 0.84 -3.60 1.26 -2.24 -1.26 -4.88 114.28 104.74 2ra3 n THR 125 Ca 0.03 -0.92 -0.12 0.00 -2.27 0.00 0.00 64.05 60.77 2ra3 n THR 125 Cb 0.48 0.62 -0.05 0.00 -2.10 0.00 0.00 70.33 69.29 2ra3 n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ra3 s ALA 127 N -1.02 -1.14 1.08 6.98 0.00 -1.26 -5.17 121.76 121.22 2ra3 s ALA 127 Ca 0.26 0.27 -0.17 0.00 0.00 0.00 0.00 51.96 52.32 2ra3 s ALA 127 Cb 0.14 0.56 0.24 0.00 0.00 0.00 0.00 23.12 24.06 2ra3 s ALA 127 CO 0.19 -0.58 1.21 -1.25 0.00 0.00 0.00 175.76 175.32 2ra3 s PRO 128 N -3.14 -0.23 0.33 0.00 0.04 -1.26 -4.83 135.00 125.91 2ra3 s PRO 128 Ca -0.01 -0.20 -0.29 0.00 0.04 0.00 0.00 61.00 60.54 2ra3 s PRO 128 Cb 0.00 -1.72 -0.11 0.00 0.04 0.00 0.00 34.50 32.71 2ra3 s PRO 128 CO -0.07 -3.03 1.42 -2.14 0.04 0.00 0.00 177.00 173.21 2ra3 s PRO 129 N -5.62 4.23 -0.17 0.56 0.02 -1.26 -4.99 135.00 127.78 2ra3 s PRO 129 Ca 0.72 2.39 -0.01 0.00 0.02 0.00 0.00 61.00 64.11 2ra3 s PRO 129 Cb -0.07 -3.04 -0.01 0.00 0.02 0.00 0.00 34.50 31.40 2ra3 s PRO 129 CO 0.54 -0.39 -0.11 0.00 -0.33 0.00 0.00 177.00 176.72 2ra3 s ALA 130 N -0.82 2.65 0.16 -1.55 0.00 -1.26 -5.08 121.76 115.87 2ra3 s ALA 130 Ca 0.53 -1.05 -0.34 0.00 0.00 0.00 0.00 51.96 51.11 2ra3 s ALA 130 Cb -0.43 -1.40 -0.15 0.00 0.00 0.00 0.00 23.12 21.14 2ra3 s ALA 130 CO 0.54 -0.11 1.42 2.41 0.00 0.00 0.00 175.76 180.02 2ra3 n THR 132 N 4.19 0.37 0.00 0.00 -1.04 -1.26 -1.66 114.28 114.87 2ra3 n THR 132 Ca -0.19 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 2ra3 n THR 132 Cb 0.52 -1.24 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 2ra3 n THR 132 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ra3 n GLY 133 N 2.68 2.05 3.77 3.41 0.00 -0.07 -4.97 105.19 112.06 2ra3 n GLY 133 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2ra3 n GLY 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ra3 s THR 134 N -2.39 3.21 -0.03 2.61 -4.23 -0.66 -4.72 115.64 109.43 2ra3 s THR 134 Ca 0.00 0.66 -0.22 0.00 -1.18 0.00 0.00 61.69 60.95 2ra3 s THR 134 Cb 0.00 -3.20 -0.05 0.00 1.34 0.00 0.00 72.50 70.59 2ra3 s THR 134 CO 0.00 -0.26 0.65 -0.54 -0.54 0.00 0.00 174.62 173.94 2ra3 s LYS 135 N -3.68 4.40 0.19 3.99 1.02 -1.26 -1.63 119.74 122.77 2ra3 s LYS 135 Ca 0.70 0.82 0.09 0.00 0.02 0.00 0.00 55.97 57.59 2ra3 s LYS 135 Cb -0.22 -3.39 -0.04 0.00 -0.52 0.00 0.00 37.83 33.65 2ra3 s LYS 135 CO 0.34 0.22 -0.17 0.00 -0.92 0.00 0.00 175.35 174.82 2ra3 s LEU 137 N -3.01 2.87 -0.09 0.00 2.96 0.82 -1.26 118.68 120.98 2ra3 s LEU 137 Ca 0.20 -0.72 -0.00 0.00 -0.22 0.00 0.00 54.13 53.39 2ra3 s LEU 137 Cb -0.04 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 44.99 2ra3 s LEU 137 CO 0.08 -0.07 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.34 2ra3 s ILE 138 N 1.35 3.71 0.04 6.68 1.01 -0.15 -1.33 121.20 132.51 2ra3 s ILE 138 Ca 0.02 -0.46 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 2ra3 s ILE 138 Cb -0.15 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 2ra3 s ILE 138 CO -0.06 0.57 0.02 -0.94 0.00 0.00 0.00 174.94 174.53 2ra3 s SER 139 N -0.47 0.33 0.00 3.58 1.04 -1.19 -0.78 113.70 116.21 2ra3 s SER 139 Ca 0.07 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.76 2ra3 s SER 139 Cb -0.12 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.19 2ra3 s SER 139 CO 0.02 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.33 2ra3 n GLY 140 N 0.60 1.08 2.04 7.32 0.00 -0.46 -4.38 105.19 111.39 2ra3 n GLY 140 Ca -0.18 -1.06 -0.11 0.00 0.00 0.00 0.00 46.02 44.67 2ra3 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2ra3 n TRP 141 N -0.72 2.60 -1.65 1.61 8.01 -1.26 -1.80 117.44 124.23 2ra3 n TRP 141 Ca 0.00 -1.41 -0.27 0.00 -1.31 0.00 0.00 57.50 54.51 2ra3 n TRP 141 Cb 0.00 -0.76 0.20 0.00 -2.01 0.00 0.00 31.31 28.74 2ra3 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2ra3 n GLY 142 N -0.48 -1.79 3.71 6.99 0.00 -1.25 -4.44 105.19 107.93 2ra3 n GLY 142 Ca 0.46 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 2ra3 n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ra3 n ASN 143 N -4.02 2.67 -0.68 1.61 2.85 0.45 -2.96 115.26 115.19 2ra3 n ASN 143 Ca 0.15 1.13 0.09 0.00 -0.11 0.00 0.00 54.58 55.83 2ra3 n ASN 143 Cb 0.54 -1.51 0.07 0.00 1.24 0.00 0.00 39.78 40.12 2ra3 n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2ra3 n THR 144 N -0.11 0.00 -4.29 -0.44 -2.24 -0.31 -0.89 114.28 106.00 2ra3 n THR 144 Ca 0.06 -0.49 -0.35 0.00 -2.27 0.00 0.00 64.05 61.00 2ra3 n THR 144 Cb 0.39 1.35 -0.10 0.00 -2.10 0.00 0.00 70.33 69.88 2ra3 n THR 144 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ra3 s ALA 145 N -1.49 3.31 -0.34 6.98 0.00 -1.26 -4.28 121.76 124.68 2ra3 s ALA 145 Ca 0.20 -0.79 0.21 0.00 0.00 0.00 0.00 51.96 51.58 2ra3 s ALA 145 Cb 0.14 -1.59 0.23 0.00 0.00 0.00 0.00 23.12 21.91 2ra3 s ALA 145 CO 0.23 0.49 1.50 0.66 0.00 0.00 0.00 175.76 178.64 2ra3 h SER 146 N 5.54 0.00 -4.13 0.00 4.64 -1.93 -3.43 113.55 114.24 2ra3 h SER 146 Ca -0.47 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 60.56 2ra3 h SER 146 Cb 1.19 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 63.02 2ra3 h SER 146 CO 0.58 0.14 -0.74 -0.94 -0.87 0.00 0.00 176.83 175.00 2ra3 s SER 147 N -6.19 0.57 0.23 4.97 1.04 -1.26 -4.63 113.70 108.43 2ra3 s SER 147 Ca 0.05 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2ra3 s SER 147 Cb 0.06 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.15 2ra3 s SER 147 CO 0.70 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.51 2ra3 n GLY 148 N 2.57 -0.79 2.91 7.32 0.00 -1.26 -4.91 105.19 111.03 2ra3 n GLY 148 Ca -0.15 -1.16 -0.19 0.00 0.00 0.00 0.00 46.02 44.51 2ra3 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ra3 s ALA 149 N -1.23 0.63 -0.36 4.61 0.00 -1.26 -4.73 121.76 119.42 2ra3 s ALA 149 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 51.90 2ra3 s ALA 149 Cb 0.00 -0.35 0.16 0.00 0.00 0.00 0.00 23.12 22.93 2ra3 s ALA 149 CO 0.00 0.03 0.40 0.34 0.00 0.00 0.00 175.76 176.53 2ra3 s ASP 150 N 0.67 0.80 -0.14 0.00 -1.08 -1.26 -4.94 116.67 110.72 2ra3 s ASP 150 Ca -0.09 -1.31 -0.11 0.00 -0.52 0.00 0.00 52.55 50.52 2ra3 s ASP 150 Cb -0.12 0.78 -0.05 0.00 -1.46 0.00 0.00 42.92 42.07 2ra3 s ASP 150 CO 0.00 -0.27 0.23 -0.31 0.52 0.00 0.00 175.17 175.34 2ra3 s TYR 151 N 1.65 3.51 0.27 -5.34 2.02 -1.26 -1.16 117.35 117.04 2ra3 s TYR 151 Ca 0.16 0.56 -0.04 0.00 -0.37 0.00 0.00 57.07 57.38 2ra3 s TYR 151 Cb -0.14 -2.19 -0.05 0.00 -0.40 0.00 0.00 41.96 39.18 2ra3 s TYR 151 CO -0.09 0.42 0.51 -1.25 -1.57 0.00 0.00 175.55 173.57 2ra3 s PRO 152 N -0.09 3.59 -0.00 -1.71 0.04 -1.26 -5.01 135.00 130.57 2ra3 s PRO 152 Ca 0.15 -0.10 -0.05 0.00 0.04 0.00 0.00 61.00 61.04 2ra3 s PRO 152 Cb -0.13 -2.70 -0.28 0.00 0.04 0.00 0.00 34.50 31.43 2ra3 s PRO 152 CO 0.03 0.26 0.84 -0.44 0.04 0.00 0.00 177.00 177.74 2ra3 h ASP 153 N 1.72 0.44 -2.84 6.66 3.32 -1.94 -3.48 116.42 120.29 2ra3 h ASP 153 Ca -0.48 -0.60 -0.64 0.00 0.02 0.00 0.00 57.03 55.33 2ra3 h ASP 153 Cb 1.19 -0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.54 2ra3 h ASP 153 CO 0.66 1.50 -0.34 -1.61 -1.72 0.00 0.00 179.24 177.73 2ra3 s GLU 154 N -2.61 3.67 0.17 3.56 2.02 -1.26 -1.44 118.70 122.81 2ra3 s GLU 154 Ca -0.10 0.12 -0.34 0.00 0.02 0.00 0.00 54.97 54.68 2ra3 s GLU 154 Cb 0.07 -3.18 -0.14 0.00 0.10 0.00 0.00 34.13 30.97 2ra3 s GLU 154 CO 0.86 0.72 1.59 -0.11 0.02 0.00 0.00 175.26 178.34 2ra3 n LEU 155 N 1.78 3.19 -4.80 1.80 7.94 -0.84 -4.88 117.00 121.20 2ra3 n LEU 155 Ca -0.16 1.08 -0.32 0.00 -1.11 0.00 0.00 56.01 55.50 2ra3 n LEU 155 Cb 0.54 -1.44 -0.06 0.00 0.53 0.00 0.00 43.42 42.98 2ra3 n LEU 155 CO 0.35 -0.24 -0.24 -1.10 -1.11 0.00 0.00 177.39 175.05 2ra3 s GLN 156 N 0.89 3.05 0.13 1.96 -1.52 -0.75 -1.37 119.66 122.06 2ra3 s GLN 156 Ca 0.78 -0.54 0.08 0.00 -1.95 0.00 0.00 55.36 53.73 2ra3 s GLN 156 Cb -0.66 -2.84 -0.04 0.00 -0.22 0.00 0.00 33.01 29.25 2ra3 s GLN 156 CO 0.38 0.62 -0.18 0.00 -0.25 0.00 0.00 175.29 175.85 2ra3 s LEU 158 N -2.36 0.08 -0.15 0.00 2.96 0.04 -0.79 118.68 118.45 2ra3 s LEU 158 Ca 0.11 0.66 -0.21 0.00 -0.22 0.00 0.00 54.13 54.47 2ra3 s LEU 158 Cb -0.07 0.92 -0.03 0.00 0.50 0.00 0.00 46.19 47.51 2ra3 s LEU 158 CO 0.05 -0.19 0.63 -1.81 -1.32 0.00 0.00 176.35 173.71 2ra3 s ASP 159 N 1.61 6.77 -0.06 3.68 1.01 -1.26 -0.98 116.67 127.45 2ra3 s ASP 159 Ca -0.07 0.93 -0.22 0.00 0.71 0.00 0.00 52.55 53.90 2ra3 s ASP 159 Cb -0.10 -2.36 0.05 0.00 1.01 0.00 0.00 42.92 41.52 2ra3 s ASP 159 CO -0.10 -0.19 0.50 0.00 0.21 0.00 0.00 175.17 175.59 2ra3 s ALA 160 N 1.43 -1.28 0.19 5.23 0.00 -0.39 -4.97 121.76 121.98 2ra3 s ALA 160 Ca 0.31 0.92 -0.08 0.00 0.00 0.00 0.00 51.96 53.10 2ra3 s ALA 160 Cb -0.16 -0.09 -0.07 0.00 0.00 0.00 0.00 23.12 22.80 2ra3 s ALA 160 CO 0.12 -0.31 0.49 -1.25 0.00 0.00 0.00 175.76 174.81 2ra3 s PRO 161 N -1.04 3.75 0.23 0.00 0.04 -1.26 -0.73 135.00 135.99 2ra3 s PRO 161 Ca -0.11 0.16 -0.31 0.00 0.04 0.00 0.00 61.00 60.79 2ra3 s PRO 161 Cb -0.03 -2.73 -0.11 0.00 0.04 0.00 0.00 34.50 31.67 2ra3 s PRO 161 CO 0.06 0.38 1.59 0.08 0.04 0.00 0.00 177.00 179.15 2ra3 s VAL 162 N -1.74 2.30 0.17 -0.36 1.01 -0.65 -1.86 120.40 119.28 2ra3 s VAL 162 Ca 0.44 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.66 2ra3 s VAL 162 Cb -0.12 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2ra3 s VAL 162 CO 0.22 0.03 0.34 -0.76 0.00 0.00 0.00 175.10 174.93 2ra3 s LEU 163 N 0.33 4.28 0.77 3.92 1.43 -0.30 -0.89 118.68 128.21 2ra3 s LEU 163 Ca 0.67 0.31 -0.14 0.00 -1.03 0.00 0.00 54.13 53.95 2ra3 s LEU 163 Cb -0.46 -3.07 0.06 0.00 0.03 0.00 0.00 46.19 42.75 2ra3 s LEU 163 CO 0.39 0.00 1.19 -0.94 0.23 0.00 0.00 176.35 177.22 2ra3 s SER 164 N -3.15 3.99 0.26 2.29 1.04 -1.26 -4.62 113.70 112.25 2ra3 s SER 164 Ca 0.37 2.29 -0.03 0.00 0.48 0.00 0.00 55.95 59.05 2ra3 s SER 164 Cb -0.11 -2.58 0.38 0.00 0.10 0.00 0.00 66.02 63.81 2ra3 s SER 164 CO 0.29 -2.40 1.87 -0.61 0.98 0.00 0.00 173.24 173.37 2ra3 h GLN 165 N -0.64 1.05 -0.67 4.02 4.15 -1.98 -1.60 115.11 119.45 2ra3 h GLN 165 Ca -0.46 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 58.88 2ra3 h GLN 165 Cb 1.29 -0.24 -0.03 0.00 0.21 0.00 0.00 27.48 28.71 2ra3 h GLN 165 CO 0.48 0.69 0.38 0.00 -1.93 0.00 0.00 178.83 178.45 2ra3 h ALA 166 N 1.44 0.86 -0.64 3.38 0.00 -1.99 0.17 119.26 122.47 2ra3 h ALA 166 Ca 0.41 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 2ra3 h ALA 166 Cb 0.18 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2ra3 h ALA 166 CO -0.18 0.36 0.09 0.87 0.00 0.00 0.00 179.25 180.40 2ra3 h LYS 167 N 0.91 1.06 -0.02 0.00 1.57 -1.80 -0.85 116.57 117.45 2ra3 h LYS 167 Ca 0.24 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2ra3 h LYS 167 Cb 0.03 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 2ra3 h LYS 167 CO -0.04 0.98 0.01 0.00 -0.57 0.00 0.00 179.45 179.83 2ra3 h GLU 169 N -0.10 1.24 -0.08 0.00 5.08 -0.93 -1.99 114.58 117.80 2ra3 h GLU 169 Ca 0.01 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2ra3 h GLU 169 Cb 0.13 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 2ra3 h GLU 169 CO -0.00 0.85 -0.15 0.00 -1.00 0.00 0.00 179.01 178.72 2ra3 h ALA 170 N 1.31 1.61 0.00 3.43 0.00 -0.96 -2.37 119.26 122.28 2ra3 h ALA 170 Ca 0.33 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 2ra3 h ALA 170 Cb -0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2ra3 h ALA 170 CO -0.07 0.28 -0.42 0.77 0.00 0.00 0.00 179.25 179.82 2ra3 h SER 171 N 0.12 0.00 -1.85 0.00 0.02 -0.59 -3.39 113.55 107.86 2ra3 h SER 171 Ca 0.02 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.44 2ra3 h SER 171 Cb 0.33 0.00 -0.37 0.00 0.14 0.00 0.00 62.40 62.51 2ra3 h SER 171 CO 0.02 0.42 -1.04 -1.22 -1.14 0.00 0.00 176.83 173.87 2ra3 n TYR 172 N -3.27 -0.69 -1.68 3.45 4.01 -0.81 -4.83 117.16 113.34 2ra3 n TYR 172 Ca 0.02 -3.37 -0.45 0.00 -0.16 0.00 0.00 57.90 53.94 2ra3 n TYR 172 Cb 0.66 -0.13 -0.04 0.00 -0.31 0.00 0.00 39.34 39.52 2ra3 n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2ra3 n PRO 173 N 1.55 2.46 -0.98 -0.72 -0.02 -0.93 -1.75 135.00 134.61 2ra3 n PRO 173 Ca 0.21 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 2ra3 n PRO 173 Cb 0.53 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 2ra3 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ra3 n GLY 174 N 3.96 0.86 0.00 -1.23 0.00 -1.26 -4.87 105.19 102.66 2ra3 n GLY 174 Ca 0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 2ra3 n GLY 174 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ra3 n LYS 175 N -2.16 3.88 -3.34 1.61 5.02 -0.72 -4.95 118.16 117.51 2ra3 n LYS 175 Ca 0.00 -0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.87 2ra3 n LYS 175 Cb 0.00 -0.91 -0.09 0.00 -0.02 0.00 0.00 35.03 34.01 2ra3 n LYS 175 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2ra3 s ILE 176 N -1.85 5.11 0.75 -0.18 -1.09 -1.25 -5.01 121.20 117.68 2ra3 s ILE 176 Ca 0.02 0.00 -0.06 0.00 -2.23 0.00 0.00 60.65 58.38 2ra3 s ILE 176 Cb 0.06 -3.92 0.11 0.00 -1.58 0.00 0.00 42.46 37.13 2ra3 s ILE 176 CO 0.33 -0.22 1.05 0.42 -1.23 0.00 0.00 174.94 175.29 2ra3 s THR 177 N 2.14 2.21 -0.78 2.92 -4.23 -1.26 -4.96 115.64 111.68 2ra3 s THR 177 Ca 0.13 -0.34 0.15 0.00 -1.18 0.00 0.00 61.69 60.45 2ra3 s THR 177 Cb -0.16 -2.87 0.14 0.00 1.34 0.00 0.00 72.50 70.95 2ra3 s THR 177 CO 0.13 0.00 1.46 -1.54 -0.54 0.00 0.00 174.62 174.13 2ra3 n SER 178 N -3.02 0.23 -1.40 3.99 3.41 -1.26 -2.03 113.62 113.55 2ra3 n SER 178 Ca 0.11 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.37 2ra3 n SER 178 Cb 0.60 -0.61 0.31 0.00 -0.26 0.00 0.00 64.21 64.24 2ra3 n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2ra3 n ASN 179 N -1.77 4.12 -4.22 4.04 3.02 -1.26 -4.91 115.26 114.29 2ra3 n ASN 179 Ca 0.02 -2.37 -0.18 0.00 -0.03 0.00 0.00 54.58 52.01 2ra3 n ASN 179 Cb 0.14 -0.53 -0.11 0.00 -0.61 0.00 0.00 39.78 38.66 2ra3 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2ra3 s MET 180 N -1.80 0.95 0.16 3.52 -1.94 -0.86 -1.02 119.30 118.31 2ra3 s MET 180 Ca 0.44 -1.13 -0.12 0.00 -1.71 0.00 0.00 55.69 53.17 2ra3 s MET 180 Cb 0.28 -0.88 0.00 0.00 2.01 0.00 0.00 34.83 36.24 2ra3 s MET 180 CO 0.21 0.18 0.34 -0.59 -0.01 0.00 0.00 175.02 175.15 2ra3 s PHE 181 N -1.80 0.19 -0.01 -0.03 -0.71 -0.43 -4.80 117.98 110.39 2ra3 s PHE 181 Ca 0.05 -0.56 0.03 0.00 -1.04 0.00 0.00 56.93 55.41 2ra3 s PHE 181 Cb -0.07 0.08 -0.03 0.00 -1.21 0.00 0.00 43.02 41.79 2ra3 s PHE 181 CO 0.03 -0.75 -0.09 0.00 -1.34 0.00 0.00 175.22 173.07 2ra3 s VAL 183 N -0.91 0.55 -0.82 0.00 1.01 -1.15 -1.15 120.40 117.92 2ra3 s VAL 183 Ca 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2ra3 s VAL 183 Cb -0.11 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.79 2ra3 s VAL 183 CO 0.05 0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2ra3 n GLY 184 N 3.07 0.43 2.77 4.51 0.00 -0.78 -3.65 105.19 111.53 2ra3 n GLY 184 Ca -0.15 -1.48 -0.17 0.00 0.00 0.00 0.00 46.02 44.23 2ra3 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ra3 s PHE 184 N -3.12 -0.02 0.32 1.61 0.40 -1.26 -4.35 117.98 111.56 2ra3 s PHE 184 Ca 0.00 0.29 0.29 0.00 -0.60 0.00 0.00 56.93 56.91 2ra3 s PHE 184 Cb 0.00 -0.30 1.40 0.00 0.51 0.00 0.00 43.02 44.63 2ra3 s PHE 184 CO 0.00 -0.16 2.03 -0.07 0.70 0.00 0.00 175.22 177.72 2ra3 h LEU 185 N 7.82 0.00 0.00 -0.37 3.38 -1.96 -1.73 115.31 122.45 2ra3 h LEU 185 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2ra3 h LEU 185 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2ra3 h LEU 185 CO 0.32 0.11 0.00 -1.84 0.09 0.00 0.00 178.44 177.12 2ra3 n GLU 186 N -3.43 0.54 0.00 1.13 0.00 -1.26 0.07 120.64 117.69 2ra3 n GLU 186 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2ra3 n GLU 186 Cb 0.28 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.22 2ra3 n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ra3 n GLY 187 N 1.09 -1.20 1.34 -1.84 0.00 -0.65 -4.60 105.19 99.33 2ra3 n GLY 187 Ca 0.16 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2ra3 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ra3 n GLY 188 N 0.00 2.86 2.77 -0.02 0.00 -0.24 -4.85 105.19 105.71 2ra3 n GLY 188 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2ra3 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ra3 s LYS 188 N -0.03 -0.02 0.01 1.61 1.02 -1.26 -3.95 119.74 117.12 2ra3 s LYS 188 Ca 0.00 0.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.89 2ra3 s LYS 188 Cb 0.00 -0.28 0.11 0.00 -0.52 0.00 0.00 37.83 37.14 2ra3 s LYS 188 CO 0.00 -0.18 1.22 0.34 -0.92 0.00 0.00 175.35 175.81 2ra3 s ASP 189 N 1.14 -0.09 0.53 2.83 -1.08 -0.82 -4.49 116.67 114.69 2ra3 s ASP 189 Ca -0.08 -0.18 -0.07 0.00 -0.52 0.00 0.00 52.55 51.70 2ra3 s ASP 189 Cb -0.13 0.23 -0.03 0.00 -1.46 0.00 0.00 42.92 41.52 2ra3 s ASP 189 CO -0.03 -0.41 0.86 -0.94 0.52 0.00 0.00 175.17 175.17 2ra3 s SER 190 N -2.92 6.21 0.36 -0.34 1.04 -1.26 -0.68 113.70 116.11 2ra3 s SER 190 Ca 0.13 1.05 -0.04 0.00 0.48 0.00 0.00 55.95 57.57 2ra3 s SER 190 Cb 0.03 -2.28 0.01 0.00 0.10 0.00 0.00 66.02 63.89 2ra3 s SER 190 CO -0.03 -0.68 0.54 0.00 0.98 0.00 0.00 173.24 174.05 2ra3 n GLN 192 N -0.58 2.16 0.00 0.00 3.00 -1.26 -0.86 117.38 119.83 2ra3 n GLN 192 Ca -0.01 0.78 0.00 0.00 -0.01 0.00 0.00 57.00 57.76 2ra3 n GLN 192 Cb 0.61 -2.52 0.00 0.00 0.00 0.00 0.00 30.24 28.33 2ra3 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ra3 n GLY 193 N 3.05 1.37 0.11 1.08 0.00 -1.26 -0.41 105.19 109.13 2ra3 n GLY 193 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 2ra3 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ra3 n ASP 194 N 0.00 0.79 -4.61 1.61 8.00 -0.04 -3.79 116.55 118.51 2ra3 n ASP 194 Ca 0.00 0.31 -0.44 0.00 0.71 0.00 0.00 54.79 55.37 2ra3 n ASP 194 Cb 0.00 0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 41.63 2ra3 n ASP 194 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ra3 n ALA 195 N -2.20 0.08 0.00 2.24 0.00 -1.26 -1.92 120.51 117.44 2ra3 n ALA 195 Ca -0.01 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2ra3 n ALA 195 Cb 0.57 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.96 2ra3 n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ra3 n GLY 196 N 1.14 3.22 3.86 0.00 0.00 -0.04 0.06 105.19 113.43 2ra3 n GLY 196 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2ra3 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ra3 s GLY 197 N -2.10 1.77 0.22 -0.02 0.00 -0.81 -3.17 107.32 103.20 2ra3 s GLY 197 Ca 0.00 -1.25 -0.19 0.00 0.00 0.00 0.00 44.72 43.28 2ra3 s GLY 197 CO 0.00 -0.40 0.71 2.56 0.00 0.00 0.00 173.10 175.96 2ra3 s PRO 198 N -5.85 4.22 -0.28 2.90 0.04 -1.26 -1.33 135.00 133.44 2ra3 s PRO 198 Ca 0.75 0.83 0.02 0.00 0.04 0.00 0.00 61.00 62.64 2ra3 s PRO 198 Cb -0.04 -2.87 0.06 0.00 0.04 0.00 0.00 34.50 31.69 2ra3 s PRO 198 CO 0.54 0.40 -0.07 0.08 0.04 0.00 0.00 177.00 177.99 2ra3 s VAL 199 N -1.53 2.39 -0.18 -0.36 1.01 -0.44 -3.14 120.40 118.15 2ra3 s VAL 199 Ca 0.43 -1.64 -0.04 0.00 0.00 0.00 0.00 61.98 60.73 2ra3 s VAL 199 Cb -0.16 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2ra3 s VAL 199 CO 0.21 -0.10 -0.03 -0.69 0.00 0.00 0.00 175.10 174.48 2ra3 s VAL 200 N 1.12 3.76 -0.03 2.92 1.01 -0.44 -1.23 120.40 127.50 2ra3 s VAL 200 Ca -0.06 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.54 2ra3 s VAL 200 Cb -0.20 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.53 2ra3 s VAL 200 CO -0.04 0.46 -0.05 0.00 0.00 0.00 0.00 175.10 175.47 2ra3 n ASN 202 N 3.76 -5.71 -0.46 0.00 3.02 -1.26 -1.76 115.26 112.85 2ra3 n ASN 202 Ca -0.23 -0.05 -0.06 0.00 -0.03 0.00 0.00 54.58 54.21 2ra3 n ASN 202 Cb 0.52 -4.73 -0.03 0.00 -0.61 0.00 0.00 39.78 34.93 2ra3 n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ra3 n GLY 203 N -1.09 0.83 3.14 7.41 0.00 -1.26 -5.02 105.19 109.20 2ra3 n GLY 203 Ca -0.21 -0.55 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 2ra3 n GLY 203 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ra3 s GLN 204 N -2.22 0.75 -0.95 1.61 -0.21 -0.72 -4.31 119.66 113.59 2ra3 s GLN 204 Ca 0.00 -1.12 -0.24 0.00 0.02 0.00 0.00 55.36 54.02 2ra3 s GLN 204 Cb 0.00 -0.32 0.03 0.00 1.00 0.00 0.00 33.01 33.71 2ra3 s GLN 204 CO 0.00 0.03 1.53 -1.17 -2.12 0.00 0.00 175.29 173.56 2ra3 s LEU 209 N -2.45 3.39 0.07 2.90 2.96 0.02 -1.42 118.68 124.15 2ra3 s LEU 209 Ca 0.04 -1.14 -0.02 0.00 -0.22 0.00 0.00 54.13 52.79 2ra3 s LEU 209 Cb -0.01 -2.57 -0.27 0.00 0.50 0.00 0.00 46.19 43.84 2ra3 s LEU 209 CO -0.02 -1.79 1.12 1.56 -1.32 0.00 0.00 176.35 175.90 2ra3 h GLN 210 N 10.25 0.22 -4.40 1.98 1.08 -1.47 -3.35 115.11 119.42 2ra3 h GLN 210 Ca 0.11 -0.37 -0.18 0.00 -1.45 0.00 0.00 58.65 56.76 2ra3 h GLN 210 Cb 1.02 0.14 -0.16 0.00 -0.05 0.00 0.00 27.48 28.43 2ra3 h GLN 210 CO 1.37 1.16 -0.69 0.20 -0.95 0.00 0.00 178.83 179.91 2ra3 s GLY 211 N -4.71 0.56 -0.14 3.46 0.00 -0.82 -1.85 107.32 103.82 2ra3 s GLY 211 Ca -0.04 -1.15 -0.01 0.00 0.00 0.00 0.00 44.72 43.53 2ra3 s GLY 211 CO 0.87 -1.25 -0.12 0.14 0.00 0.00 0.00 173.10 172.74 2ra3 s VAL 212 N -3.28 3.10 0.11 1.40 1.01 -0.96 -1.33 120.40 120.45 2ra3 s VAL 212 Ca 0.05 -0.64 -0.32 0.00 0.00 0.00 0.00 61.98 61.06 2ra3 s VAL 212 Cb 0.03 -2.31 -0.12 0.00 0.00 0.00 0.00 36.38 33.98 2ra3 s VAL 212 CO -0.06 0.52 1.77 0.52 0.00 0.00 0.00 175.10 177.84 2ra3 n VAL 213 N 3.60 0.26 0.00 2.92 0.31 -0.44 -1.37 118.33 123.61 2ra3 n VAL 213 Ca -0.18 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2ra3 n VAL 213 Cb 0.53 -1.92 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 2ra3 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2ra3 n SER 214 N 5.03 0.00 -3.70 4.52 2.88 -1.07 -0.86 113.62 120.41 2ra3 n SER 214 Ca 0.18 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.61 2ra3 n SER 214 Cb 0.34 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.75 2ra3 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2ra3 s TRP 215 N -0.04 0.64 -0.07 0.66 1.48 -0.87 -4.88 118.94 115.87 2ra3 s TRP 215 Ca 0.00 -0.97 -0.32 0.00 -1.06 0.00 0.00 56.10 53.75 2ra3 s TRP 215 Cb 0.00 0.08 0.13 0.00 -1.16 0.00 0.00 33.47 32.52 2ra3 s TRP 215 CO 0.00 -1.05 1.31 0.20 -4.06 0.00 0.00 176.95 173.35 2ra3 s GLY 216 N -3.11 -0.40 -0.70 3.67 0.00 -1.26 -0.29 107.32 105.22 2ra3 s GLY 216 Ca 0.26 0.92 -0.22 0.00 0.00 0.00 0.00 44.72 45.69 2ra3 s GLY 216 CO 0.13 0.21 0.98 0.99 0.00 0.00 0.00 173.10 175.41 2ra3 s ASP 217 N -2.83 6.25 0.50 1.64 1.01 -1.26 -4.89 116.67 117.09 2ra3 s ASP 217 Ca 0.14 -1.20 0.00 0.00 0.71 0.00 0.00 52.55 52.20 2ra3 s ASP 217 Cb 0.04 -2.41 0.00 0.00 1.01 0.00 0.00 42.92 41.56 2ra3 s ASP 217 CO -0.04 -1.36 0.00 0.61 0.21 0.00 0.00 175.17 174.59 2ra3 n GLY 219 N 5.38 -0.30 2.89 0.21 0.00 -1.26 -4.69 105.19 107.42 2ra3 n GLY 219 Ca 0.01 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.77 2ra3 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ra3 n ALA 221 N 3.87 -0.35 -2.28 0.00 0.00 -1.26 -4.69 120.51 115.80 2ra3 n ALA 221 Ca -0.24 0.16 -0.30 0.00 0.00 0.00 0.00 53.44 53.06 2ra3 n ALA 221 Cb 0.52 -1.64 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 2ra3 n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2ra3 s GLN 221 N -4.14 3.75 0.26 0.00 -1.52 -1.26 -1.07 119.66 115.68 2ra3 s GLN 221 Ca 0.00 0.34 -0.30 0.00 -1.95 0.00 0.00 55.36 53.45 2ra3 s GLN 221 Cb 0.00 -2.48 -0.11 0.00 -0.22 0.00 0.00 33.01 30.21 2ra3 s GLN 221 CO 0.00 0.06 1.51 0.15 -0.25 0.00 0.00 175.29 176.76 2ra3 s LYS 222 N -3.66 4.21 -0.84 2.91 1.02 -1.26 -2.21 119.74 119.90 2ra3 s LYS 222 Ca 0.49 2.41 0.00 0.00 0.02 0.00 0.00 55.97 58.89 2ra3 s LYS 222 Cb -0.10 -3.08 0.00 0.00 -0.52 0.00 0.00 37.83 34.13 2ra3 s LYS 222 CO 0.30 -0.51 0.00 -1.71 -0.92 0.00 0.00 175.35 172.51 2ra3 n ASN 223 N 2.34 -5.18 -3.16 2.83 5.15 0.11 -4.91 115.26 112.45 2ra3 n ASN 223 Ca 0.08 0.20 -0.23 0.00 -0.60 0.00 0.00 54.58 54.02 2ra3 n ASN 223 Cb 0.39 -3.38 -0.05 0.00 -0.53 0.00 0.00 39.78 36.21 2ra3 n ASN 223 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2ra3 n LYS 224 N -1.14 1.83 -1.14 1.20 4.76 -0.94 -4.51 118.16 118.21 2ra3 n LYS 224 Ca -0.08 -3.99 -0.32 0.00 -2.87 0.00 0.00 58.31 51.05 2ra3 n LYS 224 Cb 0.46 -1.85 0.11 0.00 -1.84 0.00 0.00 35.03 31.92 2ra3 n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2ra3 s PRO 225 N -2.46 1.84 0.65 1.97 0.04 -1.26 -4.33 135.00 131.45 2ra3 s PRO 225 Ca 0.41 1.44 -0.17 0.00 0.04 0.00 0.00 61.00 62.72 2ra3 s PRO 225 Cb 0.26 -1.83 -0.00 0.00 0.04 0.00 0.00 34.50 32.96 2ra3 s PRO 225 CO -0.09 -2.00 1.19 0.20 0.04 0.00 0.00 177.00 176.34 2ra3 s GLY 226 N -2.80 2.50 -0.10 0.56 0.00 -1.24 -4.78 107.32 101.47 2ra3 s GLY 226 Ca 0.66 0.89 -0.01 0.00 0.00 0.00 0.00 44.72 46.25 2ra3 s GLY 226 CO 0.53 1.28 -0.03 0.14 0.00 0.00 0.00 173.10 175.02 2ra3 s VAL 227 N -1.86 4.04 0.01 1.40 1.01 0.60 -2.95 120.40 122.65 2ra3 s VAL 227 Ca 0.75 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 62.43 2ra3 s VAL 227 Cb -0.28 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 2ra3 s VAL 227 CO 0.39 0.58 -0.15 -0.31 0.00 0.00 0.00 175.10 175.61 2ra3 s TYR 228 N -0.58 1.32 0.14 5.22 1.51 0.93 -2.04 117.35 123.85 2ra3 s TYR 228 Ca 0.09 -0.29 -0.30 0.00 -1.01 0.00 0.00 57.07 55.56 2ra3 s TYR 228 Cb -0.12 -0.82 -0.08 0.00 -0.11 0.00 0.00 41.96 40.84 2ra3 s TYR 228 CO 0.02 0.01 1.25 0.99 -1.11 0.00 0.00 175.55 176.71 2ra3 s THR 229 N -0.55 3.57 -0.89 -0.71 2.01 -0.47 -1.31 115.64 117.29 2ra3 s THR 229 Ca 0.04 1.23 -0.22 0.00 0.31 0.00 0.00 61.69 63.05 2ra3 s THR 229 Cb -0.07 -3.79 0.08 0.00 0.01 0.00 0.00 72.50 68.74 2ra3 s THR 229 CO 0.00 0.15 1.23 -0.75 -0.69 0.00 0.00 174.62 174.56 2ra3 s LYS 230 N 0.36 3.47 0.37 4.92 2.20 -0.19 -2.28 119.74 128.58 2ra3 s LYS 230 Ca 0.57 -1.21 0.07 0.00 -0.36 0.00 0.00 55.97 55.04 2ra3 s LYS 230 Cb -0.33 -4.87 0.77 0.00 -1.51 0.00 0.00 37.83 31.89 2ra3 s LYS 230 CO 0.34 -1.97 1.96 0.28 -0.36 0.00 0.00 175.35 175.59 2ra3 h VAL 231 N 6.22 1.00 -0.97 4.02 2.07 -1.64 -1.93 116.25 125.02 2ra3 h VAL 231 Ca 0.05 -0.25 0.24 0.00 0.82 0.00 0.00 66.70 67.56 2ra3 h VAL 231 Cb 1.03 0.22 -0.07 0.00 -1.52 0.00 0.00 31.29 30.94 2ra3 h VAL 231 CO 1.25 0.13 0.64 0.22 0.02 0.00 0.00 177.57 179.84 2ra3 h TYR 232 N 0.72 0.52 0.00 1.57 3.20 -1.83 0.78 116.97 121.93 2ra3 h TYR 232 Ca 0.31 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.20 2ra3 h TYR 232 Cb 0.30 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.41 2ra3 h TYR 232 CO -0.00 0.10 0.00 0.09 -1.64 0.00 0.00 178.16 176.71 2ra3 n ASN 233 N -4.52 0.00 -0.33 -2.11 3.02 -0.72 -2.94 115.26 107.66 2ra3 n ASN 233 Ca 0.22 0.18 0.03 0.00 -0.03 0.00 0.00 54.58 54.98 2ra3 n ASN 233 Cb 0.81 -0.37 0.07 0.00 -0.61 0.00 0.00 39.78 39.68 2ra3 n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2ra3 n TYR 234 N -1.37 0.19 -0.04 3.10 4.01 0.26 -4.71 117.16 118.59 2ra3 n TYR 234 Ca 0.08 -0.35 -0.10 0.00 -0.16 0.00 0.00 57.90 57.37 2ra3 n TYR 234 Cb 0.20 -0.03 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 2ra3 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2ra3 h VAL 235 N 1.17 1.01 -0.63 -0.72 2.07 -1.46 0.73 116.25 118.42 2ra3 h VAL 235 Ca 0.00 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2ra3 h VAL 235 Cb 0.52 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 2ra3 h VAL 235 CO 0.00 0.04 0.23 0.50 0.02 0.00 0.00 177.57 178.36 2ra3 h LYS 236 N 0.22 0.97 -0.66 1.57 3.64 -1.85 -1.15 116.57 119.31 2ra3 h LYS 236 Ca 0.08 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2ra3 h LYS 236 Cb 0.01 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 2ra3 h LYS 236 CO -0.04 0.83 0.40 2.35 -2.27 0.00 0.00 179.45 180.72 2ra3 h TRP 237 N 0.90 0.86 -0.08 1.91 7.01 -1.76 0.86 115.95 125.65 2ra3 h TRP 237 Ca 0.21 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.20 2ra3 h TRP 237 Cb 0.25 -0.28 -0.00 0.00 -2.10 0.00 0.00 29.16 27.02 2ra3 h TRP 237 CO 0.02 0.58 0.03 0.82 -2.79 0.00 0.00 178.44 177.10 2ra3 h ILE 238 N 0.89 1.13 -0.52 2.65 2.04 -0.59 0.08 117.51 123.19 2ra3 h ILE 238 Ca 0.24 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2ra3 h ILE 238 Cb -0.04 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2ra3 h ILE 238 CO -0.05 0.11 -0.05 0.11 0.00 0.00 0.00 178.15 178.28 2ra3 h LYS 239 N -0.02 0.93 -0.44 2.37 1.57 -0.94 -0.68 116.57 119.38 2ra3 h LYS 239 Ca 0.03 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.42 2ra3 h LYS 239 Cb 0.15 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2ra3 h LYS 239 CO -0.00 0.95 -0.08 -0.91 -0.57 0.00 0.00 179.45 178.84 2ra3 h ASN 240 N 0.85 0.82 -0.49 0.86 -0.26 -0.76 -1.55 115.58 115.05 2ra3 h ASN 240 Ca 0.15 -0.35 -0.06 0.00 -0.56 0.00 0.00 56.30 55.48 2ra3 h ASN 240 Cb 0.57 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.59 2ra3 h ASN 240 CO 0.03 0.98 0.08 0.74 -1.06 0.00 0.00 177.43 178.21 2ra3 h THR 241 N 0.65 1.25 0.19 2.81 2.02 -0.60 -0.62 112.91 118.62 2ra3 h THR 241 Ca 0.11 -0.92 -0.01 0.00 0.77 0.00 0.00 66.41 66.37 2ra3 h THR 241 Cb 0.60 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 2ra3 h THR 241 CO 0.04 0.33 -0.12 0.40 0.37 0.00 0.00 175.52 176.53 2ra3 h ILE 242 N 0.68 0.74 -0.83 3.11 2.04 -1.08 -2.46 117.51 119.71 2ra3 h ILE 242 Ca 0.15 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.09 2ra3 h ILE 242 Cb 0.39 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 2ra3 h ILE 242 CO 0.01 0.00 0.54 0.00 0.00 0.00 0.00 178.15 178.70 2ra3 h ALA 243 N 0.49 1.65 0.00 1.87 0.00 -1.16 -1.85 119.26 120.27 2ra3 h ALA 243 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ra3 h ALA 243 Cb 0.26 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2ra3 h ALA 243 CO 0.02 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.47 2ra3 n ALA 244 N -2.42 2.06 -2.06 0.00 0.00 -0.25 -3.57 120.51 114.26 2ra3 n ALA 244 Ca 0.13 -0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.56 2ra3 n ALA 244 Cb 0.26 -1.39 0.11 0.00 0.00 0.00 0.00 19.45 18.43 2ra3 n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2ra3 n ASN 245 N -1.70 1.44 -0.62 0.00 3.02 -0.72 -5.08 115.26 111.59 2ra3 n ASN 245 Ca 0.05 -2.96 0.08 0.00 -0.03 0.00 0.00 54.58 51.72 2ra3 n ASN 245 Cb 0.29 -0.42 0.07 0.00 -0.61 0.00 0.00 39.78 39.11 2ra3 n ASN 245 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44