#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 5.23 -0.49 1.39 1.01 0.49 -4.05 120.40 123.99 2ra3 s VAL 17 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.76 2ra3 s VAL 17 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2ra3 s VAL 17 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.08 2ra3 n GLY 18 N 3.23 0.64 0.00 4.51 0.00 -1.26 -1.51 105.19 110.80 2ra3 n GLY 18 Ca -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.15 2.68 3.22 -0.02 0.00 -1.26 -4.87 105.19 102.80 2ra3 n GLY 19 Ca -0.05 -1.89 -0.10 0.00 0.00 0.00 0.00 46.02 43.98 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 2.69 0.06 0.12 1.61 1.13 0.31 -4.93 117.35 118.34 2ra3 s TYR 20 Ca 0.00 -0.41 -0.31 0.00 -1.41 0.00 0.00 57.07 54.94 2ra3 s TYR 20 Cb 0.00 0.01 -0.09 0.00 -1.10 0.00 0.00 41.96 40.77 2ra3 s TYR 20 CO 0.00 -0.54 1.69 1.21 -2.51 0.00 0.00 175.55 175.39 2ra3 s ASN 21 N -2.64 6.53 0.00 -0.18 3.84 -1.26 -0.46 114.94 120.77 2ra3 s ASN 21 Ca 0.02 2.62 0.16 0.00 0.21 0.00 0.00 52.86 55.87 2ra3 s ASN 21 Cb 0.03 -2.57 0.94 0.00 -0.55 0.00 0.00 41.25 39.09 2ra3 s ASN 21 CO -0.09 -0.91 1.38 0.00 -2.79 0.00 0.00 177.10 174.69 2ra3 h GLU 23 N 0.00 0.00 -0.02 0.00 4.11 -1.90 0.77 114.58 117.55 2ra3 h GLU 23 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ra3 h GLU 23 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2ra3 h GLU 23 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 179.01 178.23 2ra3 n GLU 24 N -3.05 1.64 -4.52 1.06 0.28 -1.24 -4.91 120.64 109.90 2ra3 n GLU 24 Ca -0.02 -0.93 -0.24 0.00 -0.16 0.00 0.00 57.16 55.80 2ra3 n GLU 24 Cb 0.23 -1.48 -0.11 0.00 1.43 0.00 0.00 31.44 31.52 2ra3 n GLU 24 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2ra3 s ASN 25 N -1.98 3.21 -0.32 -1.84 0.02 0.26 -5.13 114.94 109.17 2ra3 s ASN 25 Ca 0.38 -1.30 -0.10 0.00 -1.02 0.00 0.00 52.86 50.83 2ra3 s ASN 25 Cb 0.21 -0.26 -0.00 0.00 0.02 0.00 0.00 41.25 41.22 2ra3 s ASN 25 CO 0.33 -0.42 0.15 -0.55 0.02 0.00 0.00 177.10 176.64 2ra3 s SER 26 N -3.57 5.55 -0.50 -1.22 0.15 -1.26 -5.00 113.70 107.84 2ra3 s SER 26 Ca 0.34 -0.59 0.08 0.00 0.70 0.00 0.00 55.95 56.47 2ra3 s SER 26 Cb 0.07 -2.00 0.31 0.00 -1.71 0.00 0.00 66.02 62.69 2ra3 s SER 26 CO 0.16 -0.22 0.77 0.52 1.20 0.00 0.00 173.24 175.67 2ra3 n VAL 27 N 4.98 1.40 1.13 4.45 0.31 -1.26 -4.96 118.33 124.38 2ra3 n VAL 27 Ca -0.14 -4.97 0.14 0.00 -0.01 0.00 0.00 64.34 59.37 2ra3 n VAL 27 Cb 0.49 -1.34 0.66 0.00 -0.91 0.00 0.00 33.84 32.74 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 0.42 0.15 0.00 5.55 -0.04 -1.26 -2.59 135.00 137.22 2ra3 n PRO 28 Ca 0.27 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.86 2ra3 n PRO 28 Cb 0.49 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.61 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 -2.41 0.54 0.18 -1.20 -2.05 117.16 110.80 2ra3 n TYR 29 Ca 0.09 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.46 2ra3 n TYR 29 Cb 0.30 -0.11 -0.03 0.00 -0.38 0.00 0.00 39.34 39.12 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 -2.74 4.47 0.24 -3.48 2.00 -1.07 -1.01 119.66 118.07 2ra3 s GLN 30 Ca 0.16 1.81 0.11 0.00 -2.00 0.00 0.00 55.36 55.44 2ra3 s GLN 30 Cb 0.18 -3.29 -0.05 0.00 0.80 0.00 0.00 33.01 30.65 2ra3 s GLN 30 CO 0.65 -0.16 -0.19 0.14 -0.50 0.00 0.00 175.29 175.24 2ra3 s VAL 31 N 0.48 2.23 -0.15 1.34 -7.23 -0.27 -4.45 120.40 112.33 2ra3 s VAL 31 Ca 0.55 -2.25 -0.05 0.00 -1.81 0.00 0.00 61.98 58.43 2ra3 s VAL 31 Cb -0.31 -2.17 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 2ra3 s VAL 31 CO 0.33 -0.39 -0.00 -0.55 -0.31 0.00 0.00 175.10 174.18 2ra3 s SER 32 N -3.24 5.13 -0.19 4.85 0.15 -0.48 -2.29 113.70 117.62 2ra3 s SER 32 Ca 0.25 -0.02 -0.15 0.00 0.70 0.00 0.00 55.95 56.73 2ra3 s SER 32 Cb -0.05 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.43 2ra3 s SER 32 CO 0.12 0.20 0.36 -0.76 1.20 0.00 0.00 173.24 174.36 2ra3 s LEU 33 N 0.16 4.17 -0.06 3.45 1.43 0.14 -0.71 118.68 127.26 2ra3 s LEU 33 Ca 0.01 0.49 0.04 0.00 -1.03 0.00 0.00 54.13 53.63 2ra3 s LEU 33 Cb -0.13 -2.45 -0.00 0.00 0.03 0.00 0.00 46.19 43.64 2ra3 s LEU 33 CO 0.02 -0.02 -0.19 0.21 0.23 0.00 0.00 176.35 176.60 2ra3 s ASN 34 N 0.92 2.41 -0.33 2.29 3.84 -0.02 -1.30 114.94 122.74 2ra3 s ASN 34 Ca 0.18 -0.41 0.13 0.00 0.21 0.00 0.00 52.86 52.97 2ra3 s ASN 34 Cb -0.14 -0.85 0.46 0.00 -0.55 0.00 0.00 41.25 40.16 2ra3 s ASN 34 CO 0.07 0.14 1.09 -1.54 -2.79 0.00 0.00 177.10 174.07 2ra3 n SER 37 N 3.33 3.24 0.00 -4.21 3.41 -1.26 -1.71 113.62 116.43 2ra3 n SER 37 Ca -0.19 -3.10 0.00 0.00 -0.26 0.00 0.00 58.87 55.32 2ra3 n SER 37 Cb 0.53 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 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 -0.46 0.88 3.60 5.00 0.00 -1.26 -4.98 105.19 107.97 2ra3 n GLY 38 Ca 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.54 -0.15 -0.04 1.61 1.13 -1.26 -5.14 117.35 110.96 2ra3 s TYR 39 Ca 0.00 0.05 -0.30 0.00 -1.41 0.00 0.00 57.07 55.41 2ra3 s TYR 39 Cb 0.00 0.54 -0.04 0.00 -1.10 0.00 0.00 41.96 41.36 2ra3 s TYR 39 CO 0.00 -0.34 1.32 -1.58 -2.51 0.00 0.00 175.55 172.44 2ra3 s HIS 40 N -2.62 2.95 0.00 -3.49 5.65 -1.26 -4.25 115.29 112.27 2ra3 s HIS 40 Ca 0.10 0.96 0.00 0.00 0.25 0.00 0.00 55.06 56.37 2ra3 s HIS 40 Cb 0.00 -3.56 0.00 0.00 -1.18 0.00 0.00 32.58 27.84 2ra3 s HIS 40 CO -0.05 -1.99 0.00 1.97 -0.65 0.00 0.00 174.74 174.02 2ra3 n PHE 41 N 5.50 0.00 -3.48 3.88 1.16 -0.42 -4.98 117.46 119.12 2ra3 n PHE 41 Ca 0.13 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.61 2ra3 n PHE 41 Cb 0.45 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.30 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 -0.32 1.12 3.83 0.00 0.00 0.58 -0.68 105.19 109.71 2ra3 n GLY 43 Ca -0.13 -2.09 -0.02 0.00 0.00 0.00 0.00 46.02 43.78 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 -4.60 -0.05 -0.08 -0.02 0.00 -0.97 -3.73 107.32 97.87 2ra3 s GLY 44 Ca 0.56 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 45.21 2ra3 s GLY 44 CO 0.37 1.73 -0.08 -0.56 0.00 0.00 0.00 173.10 174.56 2ra3 s SER 45 N -3.26 1.80 -0.25 1.64 0.01 -0.05 -1.12 113.70 112.46 2ra3 s SER 45 Ca 0.19 -0.26 -0.29 0.00 1.31 0.00 0.00 55.95 56.90 2ra3 s SER 45 Cb -0.01 -0.74 -0.01 0.00 0.21 0.00 0.00 66.02 65.46 2ra3 s SER 45 CO 0.03 -0.06 1.39 -0.22 0.41 0.00 0.00 173.24 174.79 2ra3 s LEU 46 N 1.23 3.95 -0.00 2.44 2.96 -0.18 -0.89 118.68 128.18 2ra3 s LEU 46 Ca -0.05 1.43 0.10 0.00 -0.22 0.00 0.00 54.13 55.40 2ra3 s LEU 46 Cb -0.14 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 42.89 2ra3 s LEU 46 CO -0.02 -1.07 0.40 2.30 -1.32 0.00 0.00 176.35 176.63 2ra3 n ILE 47 N 6.10 0.00 -3.59 6.68 -5.35 -0.47 -0.87 119.36 121.86 2ra3 n ILE 47 Ca 0.16 -0.25 -0.11 0.00 -0.27 0.00 0.00 62.75 62.27 2ra3 n ILE 47 Cb 0.46 0.84 -0.04 0.00 -1.74 0.00 0.00 39.64 39.16 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 -2.24 -0.31 0.60 7.28 2.47 -1.07 -4.69 114.94 116.98 2ra3 s ASN 48 Ca 0.02 -0.19 0.29 0.00 0.42 0.00 0.00 52.86 53.40 2ra3 s ASN 48 Cb 0.08 0.49 1.51 0.00 -1.45 0.00 0.00 41.25 41.88 2ra3 s ASN 48 CO 0.43 -0.84 1.92 -0.33 -3.72 0.00 0.00 177.10 174.55 2ra3 h GLU 49 N 2.39 0.00 -0.01 0.43 5.08 -1.95 -2.37 114.58 118.15 2ra3 h GLU 49 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2ra3 h GLU 49 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2ra3 h GLU 49 CO 0.45 0.00 -0.05 1.04 -1.00 0.00 0.00 179.01 179.44 2ra3 n GLN 50 N -3.56 0.93 -3.97 2.33 6.02 -1.26 -0.83 117.38 117.04 2ra3 n GLN 50 Ca 0.06 -0.70 -0.14 0.00 -0.01 0.00 0.00 57.00 56.21 2ra3 n GLN 50 Cb 0.58 -1.05 -0.14 0.00 1.02 0.00 0.00 30.24 30.65 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 -0.72 0.17 -0.03 1.08 0.52 -0.89 -0.30 118.94 118.76 2ra3 s TRP 51 Ca 0.06 -0.02 0.07 0.00 0.02 0.00 0.00 56.10 56.23 2ra3 s TRP 51 Cb 0.05 -0.13 -0.02 0.00 -1.15 0.00 0.00 33.47 32.22 2ra3 s TRP 51 CO 0.11 -0.01 -0.24 0.08 0.02 0.00 0.00 176.95 176.90 2ra3 s VAL 52 N 0.06 2.17 -0.08 4.03 1.01 -0.22 -1.36 120.40 126.00 2ra3 s VAL 52 Ca -0.00 -1.05 -0.03 0.00 0.00 0.00 0.00 61.98 60.89 2ra3 s VAL 52 Cb -0.02 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2ra3 s VAL 52 CO -0.00 0.58 0.05 0.54 0.00 0.00 0.00 175.10 176.26 2ra3 s VAL 53 N -0.49 4.66 0.00 2.92 0.11 -0.07 -0.70 120.40 126.83 2ra3 s VAL 53 Ca 0.06 -0.16 0.00 0.00 -2.93 0.00 0.00 61.98 58.96 2ra3 s VAL 53 Cb -0.11 -3.00 0.00 0.00 -1.53 0.00 0.00 36.38 31.74 2ra3 s VAL 53 CO 0.00 0.57 0.00 -0.24 -3.33 0.00 0.00 175.10 172.11 2ra3 n SER 54 N 1.97 0.00 -4.87 3.54 2.88 -0.24 -0.88 113.62 116.02 2ra3 n SER 54 Ca -0.18 -0.76 -0.33 0.00 -1.33 0.00 0.00 58.87 56.26 2ra3 n SER 54 Cb 0.54 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.95 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 -1.66 3.68 0.39 -1.46 0.00 -1.26 -1.21 121.76 120.24 2ra3 s ALA 55 Ca 0.00 -0.36 0.10 0.00 0.00 0.00 0.00 51.96 51.70 2ra3 s ALA 55 Cb 0.00 -2.31 0.80 0.00 0.00 0.00 0.00 23.12 21.60 2ra3 s ALA 55 CO 0.00 0.56 1.91 0.78 0.00 0.00 0.00 175.76 179.02 2ra3 h GLY 56 N 3.12 0.21 1.64 0.00 0.00 -1.65 -2.03 103.07 104.36 2ra3 h GLY 56 Ca -0.48 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 46.72 2ra3 h GLY 56 CO 0.69 0.12 0.00 -2.39 0.00 0.00 0.00 176.54 174.96 2ra3 n HIS 57 N -4.26 0.00 1.52 5.60 1.44 -1.26 -2.07 115.22 116.19 2ra3 n HIS 57 Ca -0.01 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.80 2ra3 n HIS 57 Cb 0.28 -0.32 0.43 0.00 0.12 0.00 0.00 29.99 30.50 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 -1.87 2.82 0.03 0.00 5.04 -0.88 -5.01 117.35 117.49 2ra3 s TYR 59 Ca 0.30 0.60 -0.02 0.00 -2.44 0.00 0.00 57.07 55.52 2ra3 s TYR 59 Cb 0.15 -4.10 -0.03 0.00 0.35 0.00 0.00 41.96 38.34 2ra3 s TYR 59 CO 0.24 -3.88 -0.00 0.15 -1.34 0.00 0.00 175.55 170.71 2ra3 s LYS 60 N 0.19 0.48 0.48 4.97 1.02 -1.26 -5.07 119.74 120.55 2ra3 s LYS 60 Ca 0.68 -0.87 0.28 0.00 0.02 0.00 0.00 55.97 56.08 2ra3 s LYS 60 Cb -0.49 0.17 0.97 0.00 -0.52 0.00 0.00 37.83 37.97 2ra3 s LYS 60 CO 0.41 -0.09 1.84 0.66 -0.92 0.00 0.00 175.35 177.25 2ra3 h SER 61 N 3.88 0.00 -3.85 2.83 4.64 -1.99 -3.42 113.55 115.63 2ra3 h SER 61 Ca -0.33 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.69 2ra3 h SER 61 Cb 1.18 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 62.99 2ra3 h SER 61 CO 0.52 0.10 -0.74 -0.13 -0.87 0.00 0.00 176.83 175.71 2ra3 s ARG 62 N -3.54 0.30 -0.06 4.77 1.81 -1.26 -4.93 118.95 116.05 2ra3 s ARG 62 Ca 0.02 -0.13 -0.03 0.00 -1.72 0.00 0.00 55.73 53.87 2ra3 s ARG 62 Cb 0.09 -0.30 0.03 0.00 -0.45 0.00 0.00 34.95 34.32 2ra3 s ARG 62 CO 0.61 0.08 0.14 0.42 -0.68 0.00 0.00 175.30 175.86 2ra3 s ILE 63 N -0.08 -0.03 -0.25 1.52 1.01 -1.26 -4.92 121.20 117.19 2ra3 s ILE 63 Ca 0.01 0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.66 2ra3 s ILE 63 Cb -0.02 -0.22 -0.05 0.00 0.01 0.00 0.00 42.46 42.19 2ra3 s ILE 63 CO -0.00 0.05 0.21 -1.58 0.00 0.00 0.00 174.94 173.61 2ra3 s GLN 64 N 0.77 4.03 -0.17 2.79 0.74 -0.69 -1.29 119.66 125.84 2ra3 s GLN 64 Ca -0.06 -0.22 -0.18 0.00 0.05 0.00 0.00 55.36 54.94 2ra3 s GLN 64 Cb -0.08 -3.59 -0.04 0.00 1.10 0.00 0.00 33.01 30.41 2ra3 s GLN 64 CO -0.04 -0.06 0.51 0.08 -0.55 0.00 0.00 175.29 175.23 2ra3 s VAL 65 N 1.41 5.14 -0.27 1.34 1.01 0.09 -0.84 120.40 128.27 2ra3 s VAL 65 Ca 0.09 0.96 -0.04 0.00 0.00 0.00 0.00 61.98 62.99 2ra3 s VAL 65 Cb -0.15 -3.84 0.02 0.00 0.00 0.00 0.00 36.38 32.42 2ra3 s VAL 65 CO 0.07 0.23 0.00 -0.13 0.00 0.00 0.00 175.10 175.28 2ra3 s ARG 66 N 1.25 2.97 0.20 2.72 0.52 0.11 -0.80 118.95 125.91 2ra3 s ARG 66 Ca 0.25 -0.91 0.07 0.00 -0.52 0.00 0.00 55.73 54.62 2ra3 s ARG 66 Cb -0.15 -3.16 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 2ra3 s ARG 66 CO 0.10 -0.41 0.08 -0.51 0.02 0.00 0.00 175.30 174.58 2ra3 s LEU 67 N 1.41 3.54 -0.13 2.53 1.02 0.36 -1.39 118.68 126.02 2ra3 s LEU 67 Ca 0.01 -0.32 0.00 0.00 0.02 0.00 0.00 54.13 53.84 2ra3 s LEU 67 Cb -0.17 -2.14 0.00 0.00 0.02 0.00 0.00 46.19 43.90 2ra3 s LEU 67 CO -0.01 0.05 0.00 0.61 0.02 0.00 0.00 176.35 177.01 2ra3 n GLY 69 N -0.49 0.50 3.81 -3.19 0.00 -1.26 -1.21 105.19 103.36 2ra3 n GLY 69 Ca -0.08 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.28 4.25 0.08 1.61 0.41 -1.26 -4.08 118.70 118.43 2ra3 s GLU 70 Ca 0.00 0.81 -0.01 0.00 -0.41 0.00 0.00 54.97 55.36 2ra3 s GLU 70 Cb 0.00 -3.12 -0.00 0.00 -1.78 0.00 0.00 34.13 29.23 2ra3 s GLU 70 CO 0.00 0.55 -0.01 1.58 -0.49 0.00 0.00 175.26 176.89 2ra3 n HIS 71 N 1.35 0.00 -3.20 1.61 -0.00 -1.26 -4.93 115.22 108.79 2ra3 n HIS 71 Ca -0.07 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.22 2ra3 n HIS 71 Cb 0.51 -0.02 -0.08 0.00 -0.00 0.00 0.00 29.99 30.40 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 -5.88 6.28 0.00 0.26 3.84 -1.26 -1.80 114.94 116.38 2ra3 s ASN 72 Ca -0.01 -0.42 0.25 0.00 0.21 0.00 0.00 52.86 52.89 2ra3 s ASN 72 Cb 0.00 -2.28 1.25 0.00 -0.55 0.00 0.00 41.25 39.68 2ra3 s ASN 72 CO 0.02 -0.68 1.84 2.30 -2.79 0.00 0.00 177.10 177.79 2ra3 n ILE 73 N 5.66 0.20 -0.02 -5.21 -5.35 -0.32 -3.21 119.36 111.11 2ra3 n ILE 73 Ca -0.04 0.05 -0.02 0.00 -0.27 0.00 0.00 62.75 62.47 2ra3 n ILE 73 Cb 0.48 -0.63 -0.13 0.00 -1.74 0.00 0.00 39.64 37.62 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 -1.30 0.65 -5.14 6.28 0.00 -1.26 -4.96 120.64 114.90 2ra3 n GLU 74 Ca 0.11 0.07 -0.32 0.00 0.00 0.00 0.00 57.16 57.03 2ra3 n GLU 74 Cb 0.21 -1.66 -0.16 0.00 0.00 0.00 0.00 31.44 29.83 2ra3 n GLU 74 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2ra3 s VAL 75 N -2.87 2.29 -0.00 6.31 1.01 -1.20 -5.10 120.40 120.85 2ra3 s VAL 75 Ca -0.06 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.66 2ra3 s VAL 75 Cb 0.09 -1.87 -0.06 0.00 0.00 0.00 0.00 36.38 34.53 2ra3 s VAL 75 CO 0.84 0.56 1.49 -0.76 0.00 0.00 0.00 175.10 177.22 2ra3 s LEU 76 N 0.06 4.32 -0.00 3.92 1.43 -1.26 -4.77 118.68 122.38 2ra3 s LEU 76 Ca -0.09 2.19 0.08 0.00 -1.03 0.00 0.00 54.13 55.27 2ra3 s LEU 76 Cb -0.15 -3.56 -0.10 0.00 0.03 0.00 0.00 46.19 42.41 2ra3 s LEU 76 CO 0.06 -0.79 0.26 -0.62 0.23 0.00 0.00 176.35 175.48 2ra3 n GLU 77 N 5.78 2.67 0.00 1.70 1.02 -1.26 -5.03 120.64 125.53 2ra3 n GLU 77 Ca 0.14 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2ra3 n GLU 77 Cb 0.43 -1.00 0.00 0.00 -0.02 0.00 0.00 31.44 30.85 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 1.55 0.76 0.34 0.62 0.00 -1.26 -4.96 105.19 102.25 2ra3 n GLY 78 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 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 2.17 -4.77 1.61 3.02 -1.26 -5.04 115.26 110.98 2ra3 n ASN 79 Ca 0.00 -1.71 -0.37 0.00 -0.03 0.00 0.00 54.58 52.47 2ra3 n ASN 79 Cb 0.00 -0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.07 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 -0.83 3.89 -0.09 3.52 8.01 -1.26 -4.44 118.70 127.51 2ra3 s GLU 80 Ca 0.12 1.73 0.02 0.00 0.01 0.00 0.00 54.97 56.85 2ra3 s GLU 80 Cb 0.07 -2.48 0.01 0.00 -4.31 0.00 0.00 34.13 27.42 2ra3 s GLU 80 CO 0.09 -0.43 -0.14 -0.65 0.01 0.00 0.00 175.26 174.14 2ra3 s GLN 81 N -2.59 2.05 -0.23 1.61 -0.21 -0.35 -4.99 119.66 114.95 2ra3 s GLN 81 Ca 0.61 -0.51 -0.03 0.00 0.02 0.00 0.00 55.36 55.45 2ra3 s GLN 81 Cb -0.28 -1.71 0.01 0.00 1.00 0.00 0.00 33.01 32.03 2ra3 s GLN 81 CO 0.34 -0.01 -0.06 -0.06 -2.12 0.00 0.00 175.29 173.38 2ra3 s PHE 82 N 0.82 2.99 -0.08 0.91 0.08 -1.26 -0.49 117.98 120.95 2ra3 s PHE 82 Ca -0.11 -1.22 -0.01 0.00 0.12 0.00 0.00 56.93 55.72 2ra3 s PHE 82 Cb -0.15 -2.08 0.03 0.00 -0.57 0.00 0.00 43.02 40.24 2ra3 s PHE 82 CO 0.01 -0.64 -0.03 0.42 -0.10 0.00 0.00 175.22 174.89 2ra3 s ILE 83 N 1.41 0.58 0.45 0.64 1.01 0.02 -4.98 121.20 120.33 2ra3 s ILE 83 Ca 0.04 -0.03 -0.21 0.00 0.00 0.00 0.00 60.65 60.45 2ra3 s ILE 83 Cb -0.15 -0.68 -0.09 0.00 0.01 0.00 0.00 42.46 41.55 2ra3 s ILE 83 CO -0.04 0.29 1.03 0.20 0.00 0.00 0.00 174.94 176.41 2ra3 s ASN 84 N 1.75 6.56 0.22 3.58 0.01 -1.26 -0.73 114.94 125.08 2ra3 s ASN 84 Ca 0.03 1.92 -0.30 0.00 -0.71 0.00 0.00 52.86 53.80 2ra3 s ASN 84 Cb -0.13 -2.56 -0.09 0.00 0.41 0.00 0.00 41.25 38.88 2ra3 s ASN 84 CO -0.05 -0.63 1.28 0.00 -1.51 0.00 0.00 177.10 176.19 2ra3 s ALA 85 N -1.92 3.50 -0.06 0.60 0.00 -0.41 -1.13 121.76 122.34 2ra3 s ALA 85 Ca 0.64 1.10 -0.04 0.00 0.00 0.00 0.00 51.96 53.66 2ra3 s ALA 85 Cb -0.17 -3.46 -0.27 0.00 0.00 0.00 0.00 23.12 19.22 2ra3 s ALA 85 CO 0.21 -0.51 0.59 0.00 0.00 0.00 0.00 175.76 176.05 2ra3 h ALA 86 N 4.95 0.38 -3.10 0.00 0.00 -0.87 -3.44 119.26 117.19 2ra3 h ALA 86 Ca -0.45 -1.28 -0.18 0.00 0.00 0.00 0.00 54.91 53.00 2ra3 h ALA 86 Cb 1.22 0.52 -0.23 0.00 0.00 0.00 0.00 17.79 19.30 2ra3 h ALA 86 CO 0.74 1.25 -0.62 0.15 0.00 0.00 0.00 179.25 180.77 2ra3 s LYS 87 N -2.58 0.29 -0.14 0.00 1.02 -1.12 -5.00 119.74 112.21 2ra3 s LYS 87 Ca -0.15 -0.34 -0.02 0.00 0.02 0.00 0.00 55.97 55.47 2ra3 s LYS 87 Cb 0.07 0.11 0.05 0.00 -0.52 0.00 0.00 37.83 37.53 2ra3 s LYS 87 CO 0.82 -0.06 0.03 0.42 -0.92 0.00 0.00 175.35 175.64 2ra3 s ILE 88 N -0.99 0.39 -0.36 2.17 1.01 -1.26 -0.98 121.20 121.18 2ra3 s ILE 88 Ca -0.11 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.35 2ra3 s ILE 88 Cb -0.06 -0.76 0.11 0.00 0.01 0.00 0.00 42.46 41.75 2ra3 s ILE 88 CO 0.00 -0.01 0.11 -0.63 0.00 0.00 0.00 174.94 174.41 2ra3 s ILE 89 N 1.94 1.76 0.43 2.92 1.01 0.61 -5.00 121.20 124.87 2ra3 s ILE 89 Ca 0.02 -2.18 -0.24 0.00 0.00 0.00 0.00 60.65 58.25 2ra3 s ILE 89 Cb -0.15 -2.29 -0.08 0.00 0.01 0.00 0.00 42.46 39.95 2ra3 s ILE 89 CO -0.07 -0.68 1.14 -0.60 0.00 0.00 0.00 174.94 174.73 2ra3 s ARG 90 N 0.93 3.91 0.20 2.79 3.52 -1.26 -0.93 118.95 128.10 2ra3 s ARG 90 Ca 0.12 1.72 -0.33 0.00 -0.13 0.00 0.00 55.73 57.12 2ra3 s ARG 90 Cb -0.20 -2.49 -0.14 0.00 -1.56 0.00 0.00 34.95 30.57 2ra3 s ARG 90 CO -0.12 -0.41 1.47 1.58 -0.81 0.00 0.00 175.30 177.01 2ra3 n HIS 91 N -0.29 2.16 0.30 5.12 -0.00 -0.63 -4.82 115.22 117.06 2ra3 n HIS 91 Ca 0.06 0.38 0.17 0.00 -0.00 0.00 0.00 57.72 58.33 2ra3 n HIS 91 Cb 0.48 -2.48 0.79 0.00 -0.00 0.00 0.00 29.99 28.78 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 4.91 0.00 -0.30 1.57 0.13 -1.92 -1.72 132.00 134.67 2ra3 h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2ra3 h PRO 92 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2ra3 h PRO 92 CO 0.81 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.62 2ra3 n GLN 93 N -2.75 3.08 -1.63 0.86 3.00 -1.26 -5.00 117.38 113.68 2ra3 n GLN 93 Ca -0.01 -2.80 -0.48 0.00 -0.01 0.00 0.00 57.00 53.71 2ra3 n GLN 93 Cb 0.17 -1.83 -0.04 0.00 0.00 0.00 0.00 30.24 28.54 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 1.85 -4.01 1.08 9.36 -0.65 -4.63 117.16 119.84 2ra3 n TYR 94 Ca 0.21 0.49 -0.33 0.00 3.32 0.00 0.00 57.90 61.59 2ra3 n TYR 94 Cb 0.88 -2.41 -0.15 0.00 -0.63 0.00 0.00 39.34 37.03 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 0.41 4.30 0.00 2.98 -1.08 -0.68 -5.00 116.67 117.60 2ra3 s ASP 95 Ca 0.75 -1.10 0.19 0.00 -0.52 0.00 0.00 52.55 51.87 2ra3 s ASP 95 Cb -0.77 -1.61 0.93 0.00 -1.46 0.00 0.00 42.92 40.01 2ra3 s ASP 95 CO 0.47 -0.16 1.61 -2.11 0.52 0.00 0.00 175.17 175.50 2ra3 n ARG 96 N 4.57 0.19 -0.13 4.34 1.85 -1.26 -0.34 116.66 125.87 2ra3 n ARG 96 Ca -0.16 0.13 -0.27 0.00 -1.00 0.00 0.00 57.85 56.55 2ra3 n ARG 96 Cb 0.45 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 30.27 2ra3 n ARG 96 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 2ra3 n LYS 97 N -1.36 0.58 0.14 2.89 4.81 -1.26 -4.64 118.16 119.33 2ra3 n LYS 97 Ca 0.08 0.25 0.12 0.00 -0.87 0.00 0.00 58.31 57.89 2ra3 n LYS 97 Cb 0.18 -1.47 0.13 0.00 0.02 0.00 0.00 35.03 33.88 2ra3 n LYS 97 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 2ra3 h THR 98 N -0.99 0.00 -0.21 3.15 1.35 -2.00 -3.47 112.91 110.74 2ra3 h THR 98 Ca -0.62 -0.88 -0.09 0.00 -0.55 0.00 0.00 66.41 64.27 2ra3 h THR 98 Cb 1.54 1.64 -0.04 0.00 -1.73 0.00 0.00 68.15 69.56 2ra3 h THR 98 CO -0.38 0.00 -0.08 0.18 -0.25 0.00 0.00 175.52 174.99 2ra3 n LEU 99 N -2.73 -0.13 -4.77 3.87 4.77 0.54 -4.97 117.00 113.58 2ra3 n LEU 99 Ca 0.03 0.11 -0.39 0.00 -0.03 0.00 0.00 56.01 55.72 2ra3 n LEU 99 Cb 0.52 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 2ra3 n LEU 99 CO 0.36 -0.42 0.98 0.21 -1.33 0.00 0.00 177.39 177.20 2ra3 s ASN 100 N -2.48 6.21 -1.07 -1.43 3.04 -1.25 -3.22 114.94 114.74 2ra3 s ASN 100 Ca 0.00 2.70 -0.05 0.00 0.04 0.00 0.00 52.86 55.56 2ra3 s ASN 100 Cb 0.00 -2.64 0.01 0.00 -1.54 0.00 0.00 41.25 37.07 2ra3 s ASN 100 CO 0.00 -0.92 0.92 0.59 -3.04 0.00 0.00 177.10 174.65 2ra3 n ASN 101 N 0.04 -4.32 -4.26 -4.21 3.02 -1.26 -1.69 115.26 102.58 2ra3 n ASN 101 Ca 0.04 -0.47 -0.43 0.00 -0.03 0.00 0.00 54.58 53.69 2ra3 n ASN 101 Cb 0.43 -4.27 0.00 0.00 -0.61 0.00 0.00 39.78 35.34 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 -2.42 4.65 -3.69 6.41 2.03 -1.20 -4.22 116.55 118.11 2ra3 n ASP 102 Ca -0.08 -2.91 -0.14 0.00 0.52 0.00 0.00 54.79 52.18 2ra3 n ASP 102 Cb 0.58 -1.69 -0.08 0.00 -0.72 0.00 0.00 41.12 39.22 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 3.40 0.05 -0.03 5.18 2.07 -1.26 -3.78 121.20 126.83 2ra3 s ILE 103 Ca 0.50 -0.40 -0.16 0.00 -1.41 0.00 0.00 60.65 59.18 2ra3 s ILE 103 Cb 0.07 -0.78 0.03 0.00 0.13 0.00 0.00 42.46 41.90 2ra3 s ILE 103 CO 0.01 -0.22 0.35 -0.32 -1.91 0.00 0.00 174.94 172.85 2ra3 s MET 104 N -1.65 0.68 -0.02 3.50 -2.45 -0.35 -1.60 119.30 117.41 2ra3 s MET 104 Ca -0.11 -0.08 0.05 0.00 -1.25 0.00 0.00 55.69 54.30 2ra3 s MET 104 Cb -0.03 0.31 -0.03 0.00 1.25 0.00 0.00 34.83 36.33 2ra3 s MET 104 CO 0.03 -0.18 -0.16 -0.51 1.05 0.00 0.00 175.02 175.24 2ra3 s LEU 105 N -1.17 2.64 -0.14 4.11 1.43 -0.11 -1.08 118.68 124.36 2ra3 s LEU 105 Ca -0.12 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 2ra3 s LEU 105 Cb -0.05 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.66 2ra3 s LEU 105 CO 0.04 0.31 -0.19 -0.63 0.23 0.00 0.00 176.35 176.12 2ra3 s ILE 106 N -0.79 1.85 -0.19 -0.59 1.01 0.12 -0.29 121.20 122.32 2ra3 s ILE 106 Ca 0.13 -0.84 -0.17 0.00 0.00 0.00 0.00 60.65 59.76 2ra3 s ILE 106 Cb -0.11 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2ra3 s ILE 106 CO 0.02 0.51 0.47 -0.75 0.00 0.00 0.00 174.94 175.19 2ra3 s LYS 107 N 1.08 4.20 0.44 2.79 2.20 -0.15 -1.05 119.74 129.24 2ra3 s LYS 107 Ca -0.02 0.34 -0.23 0.00 -0.36 0.00 0.00 55.97 55.70 2ra3 s LYS 107 Cb -0.14 -3.54 -0.08 0.00 -1.51 0.00 0.00 37.83 32.55 2ra3 s LYS 107 CO -0.06 -0.09 1.08 -0.51 -0.36 0.00 0.00 175.35 175.42 2ra3 s LEU 108 N 1.44 4.04 0.40 5.43 1.43 0.59 -0.27 118.68 131.73 2ra3 s LEU 108 Ca 0.22 2.10 0.15 0.00 -1.03 0.00 0.00 54.13 55.58 2ra3 s LEU 108 Cb -0.15 -4.28 0.83 0.00 0.03 0.00 0.00 46.19 42.62 2ra3 s LEU 108 CO 0.09 -0.68 1.86 -1.28 0.23 0.00 0.00 176.35 176.57 2ra3 h SER 109 N 2.17 0.00 -5.10 2.29 0.87 -1.41 -3.41 113.55 108.96 2ra3 h SER 109 Ca -0.49 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 59.93 2ra3 h SER 109 Cb 1.23 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 63.03 2ra3 h SER 109 CO 0.61 0.33 -0.68 -0.94 -0.53 0.00 0.00 176.83 175.61 2ra3 s SER 110 N -6.79 0.62 0.27 6.23 1.04 -1.26 -4.97 113.70 108.83 2ra3 s SER 110 Ca -0.03 -0.98 -0.30 0.00 0.48 0.00 0.00 55.95 55.13 2ra3 s SER 110 Cb 0.14 0.17 -0.10 0.00 0.10 0.00 0.00 66.02 66.33 2ra3 s SER 110 CO 0.70 -0.56 1.39 -0.13 0.98 0.00 0.00 173.24 175.62 2ra3 s ARG 111 N -3.81 4.30 0.46 4.02 0.52 -1.26 -4.83 118.95 118.36 2ra3 s ARG 111 Ca 0.07 2.25 -0.24 0.00 -0.52 0.00 0.00 55.73 57.29 2ra3 s ARG 111 Cb 0.07 -3.11 -0.07 0.00 0.52 0.00 0.00 34.95 32.36 2ra3 s ARG 111 CO -0.09 -0.34 1.26 0.00 0.02 0.00 0.00 175.30 176.15 2ra3 s ALA 112 N -0.32 3.05 -0.17 2.13 0.00 -0.01 -4.99 121.76 121.46 2ra3 s ALA 112 Ca 0.56 1.13 -0.22 0.00 0.00 0.00 0.00 51.96 53.43 2ra3 s ALA 112 Cb -0.41 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 2ra3 s ALA 112 CO 0.46 -0.87 0.68 0.08 0.00 0.00 0.00 175.76 176.11 2ra3 s VAL 113 N -1.38 5.00 -0.12 0.00 1.01 -1.26 -4.91 120.40 118.74 2ra3 s VAL 113 Ca 0.63 1.33 -0.20 0.00 0.00 0.00 0.00 61.98 63.73 2ra3 s VAL 113 Cb -0.35 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 2ra3 s VAL 113 CO 0.43 0.12 0.57 -0.63 0.00 0.00 0.00 175.10 175.59 2ra3 s ILE 114 N 1.72 5.12 0.00 2.22 -1.09 -1.26 -4.71 121.20 123.20 2ra3 s ILE 114 Ca 0.32 1.14 0.00 0.00 -2.23 0.00 0.00 60.65 59.89 2ra3 s ILE 114 Cb -0.16 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.81 2ra3 s ILE 114 CO 0.12 0.27 0.00 -0.46 -1.23 0.00 0.00 174.94 173.64 2ra3 n ASN 115 N 3.94 0.00 0.29 3.58 0.23 -0.13 -4.98 115.26 118.19 2ra3 n ASN 115 Ca -0.04 -0.98 0.16 0.00 -0.53 0.00 0.00 54.58 53.18 2ra3 n ASN 115 Cb 0.51 0.00 0.89 0.00 -2.08 0.00 0.00 39.78 39.10 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 1.93 1.29 0.00 -2.53 0.00 -2.01 -2.97 119.26 114.97 2ra3 h ALA 116 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ra3 h ALA 116 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2ra3 h ALA 116 CO 0.00 0.06 -1.54 0.72 0.00 0.00 0.00 179.25 178.49 2ra3 n HIS 117 N -3.56 0.34 -3.64 0.00 8.25 -1.26 -4.74 115.22 110.61 2ra3 n HIS 117 Ca -0.02 0.10 -0.23 0.00 -0.26 0.00 0.00 57.72 57.31 2ra3 n HIS 117 Cb 0.16 -0.62 -0.18 0.00 1.12 0.00 0.00 29.99 30.47 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 -3.42 -0.10 0.25 1.59 1.01 -1.12 -3.98 120.40 114.64 2ra3 s VAL 118 Ca -0.04 0.15 -0.21 0.00 0.00 0.00 0.00 61.98 61.88 2ra3 s VAL 118 Cb 0.13 -0.35 0.03 0.00 0.00 0.00 0.00 36.38 36.19 2ra3 s VAL 118 CO 0.86 -0.04 0.69 -0.94 0.00 0.00 0.00 175.10 175.67 2ra3 s SER 119 N 2.15 -0.34 0.36 3.32 1.04 -0.87 -0.96 113.70 118.41 2ra3 s SER 119 Ca 0.04 -0.46 -0.07 0.00 0.48 0.00 0.00 55.95 55.94 2ra3 s SER 119 Cb -0.14 0.70 -0.05 0.00 0.10 0.00 0.00 66.02 66.62 2ra3 s SER 119 CO -0.06 -1.25 0.67 0.42 0.98 0.00 0.00 173.24 174.00 2ra3 s THR 120 N -3.88 4.91 -0.13 2.02 -4.23 -1.26 -3.25 115.64 109.82 2ra3 s THR 120 Ca 0.09 0.29 -0.03 0.00 -1.18 0.00 0.00 61.69 60.85 2ra3 s THR 120 Cb -0.05 -3.75 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 2ra3 s THR 120 CO 0.02 -0.48 -0.03 -0.51 -0.54 0.00 0.00 174.62 173.09 2ra3 s ILE 121 N -2.29 4.03 0.36 2.99 1.10 -0.05 -4.89 121.20 122.44 2ra3 s ILE 121 Ca 0.47 -0.32 -0.28 0.00 -0.51 0.00 0.00 60.65 60.00 2ra3 s ILE 121 Cb -0.10 -2.74 -0.11 0.00 0.15 0.00 0.00 42.46 39.66 2ra3 s ILE 121 CO 0.33 0.53 1.47 -0.44 -2.11 0.00 0.00 174.94 174.71 2ra3 s SER 122 N -0.04 6.42 0.65 4.50 0.01 -1.26 -4.57 113.70 119.41 2ra3 s SER 122 Ca 0.02 2.98 -0.16 0.00 1.31 0.00 0.00 55.95 60.10 2ra3 s SER 122 Cb -0.13 -2.66 -0.01 0.00 0.21 0.00 0.00 66.02 63.43 2ra3 s SER 122 CO 0.02 -0.82 1.15 -0.76 0.41 0.00 0.00 173.24 173.24 2ra3 s LEU 123 N -1.90 3.46 0.30 2.44 1.43 -1.26 -1.06 118.68 122.09 2ra3 s LEU 123 Ca 0.53 2.15 -0.28 0.00 -1.03 0.00 0.00 54.13 55.50 2ra3 s LEU 123 Cb -0.45 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.10 2ra3 s LEU 123 CO 0.60 -1.70 1.03 -2.16 0.23 0.00 0.00 176.35 174.35 2ra3 s PRO 124 N -3.83 4.60 0.00 1.29 0.04 -1.25 -4.71 135.00 131.14 2ra3 s PRO 124 Ca 0.71 1.60 0.18 0.00 0.04 0.00 0.00 61.00 63.53 2ra3 s PRO 124 Cb -0.24 -3.03 -0.01 0.00 0.04 0.00 0.00 34.50 31.25 2ra3 s PRO 124 CO 0.39 0.23 0.91 0.25 0.04 0.00 0.00 177.00 178.82 2ra3 n THR 125 N 0.94 0.00 -3.91 1.26 -2.24 -1.26 -4.86 114.28 104.21 2ra3 n THR 125 Ca 0.00 -0.31 -0.08 0.00 -2.27 0.00 0.00 64.05 61.40 2ra3 n THR 125 Cb 0.47 1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.88 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 -2.08 -0.79 0.73 6.98 0.00 -1.26 -5.15 121.76 120.19 2ra3 s ALA 127 Ca 0.14 -0.58 -0.11 0.00 0.00 0.00 0.00 51.96 51.42 2ra3 s ALA 127 Cb 0.14 0.91 0.03 0.00 0.00 0.00 0.00 23.12 24.21 2ra3 s ALA 127 CO 0.46 -0.97 1.08 -2.14 0.00 0.00 0.00 175.76 174.19 2ra3 s PRO 128 N -3.77 2.64 0.31 0.00 0.02 -1.26 -4.90 135.00 128.03 2ra3 s PRO 128 Ca 0.16 0.68 -0.28 0.00 0.02 0.00 0.00 61.00 61.58 2ra3 s PRO 128 Cb -0.04 -1.98 -0.09 0.00 0.02 0.00 0.00 34.50 32.41 2ra3 s PRO 128 CO 0.09 -1.24 1.01 -1.25 -0.33 0.00 0.00 177.00 175.27 2ra3 s PRO 129 N -5.18 4.58 0.26 5.54 0.04 -1.26 -5.03 135.00 133.95 2ra3 s PRO 129 Ca 0.59 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.88 2ra3 s PRO 129 Cb -0.13 -2.98 -0.09 0.00 0.04 0.00 0.00 34.50 31.33 2ra3 s PRO 129 CO 0.54 0.23 1.08 0.00 0.04 0.00 0.00 177.00 178.89 2ra3 s ALA 130 N -1.38 3.39 0.09 8.56 0.00 -1.26 -4.97 121.76 126.20 2ra3 s ALA 130 Ca 0.48 0.85 -0.25 0.00 0.00 0.00 0.00 51.96 53.03 2ra3 s ALA 130 Cb -0.25 -3.32 -0.14 0.00 0.00 0.00 0.00 23.12 19.41 2ra3 s ALA 130 CO 0.32 -0.12 0.57 2.41 0.00 0.00 0.00 175.76 178.94 2ra3 n THR 132 N 1.42 0.91 0.00 0.00 -1.04 -1.26 -1.43 114.28 112.88 2ra3 n THR 132 Ca -0.01 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 2ra3 n THR 132 Cb 0.45 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 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 1.38 2.00 3.76 3.41 0.00 -0.10 -4.97 105.19 110.67 2ra3 n GLY 133 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2ra3 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ra3 s THR 134 N -2.47 2.39 -0.00 2.61 2.01 -0.51 -4.64 115.64 115.03 2ra3 s THR 134 Ca 0.00 0.35 -0.23 0.00 0.31 0.00 0.00 61.69 62.12 2ra3 s THR 134 Cb 0.00 -3.22 -0.05 0.00 0.01 0.00 0.00 72.50 69.24 2ra3 s THR 134 CO 0.00 0.07 0.68 -0.54 -0.69 0.00 0.00 174.62 174.14 2ra3 s LYS 135 N -1.09 4.41 0.18 4.92 3.01 -1.26 -1.27 119.74 128.65 2ra3 s LYS 135 Ca 0.57 0.88 0.07 0.00 -1.01 0.00 0.00 55.97 56.48 2ra3 s LYS 135 Cb -0.44 -3.38 -0.05 0.00 -1.01 0.00 0.00 37.83 32.96 2ra3 s LYS 135 CO 0.51 0.26 -0.13 0.00 0.51 0.00 0.00 175.35 176.49 2ra3 s LEU 137 N -3.21 3.04 -0.10 0.00 2.96 0.10 -1.43 118.68 120.05 2ra3 s LEU 137 Ca 0.20 -0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 53.75 2ra3 s LEU 137 Cb -0.00 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.87 2ra3 s LEU 137 CO 0.05 -0.02 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.43 2ra3 s ILE 138 N 1.49 4.26 0.05 6.68 1.01 -0.17 -1.25 121.20 133.27 2ra3 s ILE 138 Ca 0.06 -0.26 -0.07 0.00 0.00 0.00 0.00 60.65 60.39 2ra3 s ILE 138 Cb -0.14 -2.81 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 2ra3 s ILE 138 CO -0.01 0.58 0.13 -0.94 0.00 0.00 0.00 174.94 174.69 2ra3 s SER 139 N -0.60 0.17 0.00 3.58 1.04 -1.19 -0.79 113.70 115.91 2ra3 s SER 139 Ca 0.10 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2ra3 s SER 139 Cb -0.12 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.27 2ra3 s SER 139 CO 0.02 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.27 2ra3 n GLY 140 N 0.46 0.66 1.95 7.32 0.00 -0.51 -4.34 105.19 110.74 2ra3 n GLY 140 Ca -0.17 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.59 2.40 -1.54 1.61 8.01 -1.26 -1.54 117.44 124.53 2ra3 n TRP 141 Ca 0.00 -1.24 -0.30 0.00 -1.31 0.00 0.00 57.50 54.65 2ra3 n TRP 141 Cb 0.00 -0.69 0.22 0.00 -2.01 0.00 0.00 31.31 28.83 2ra3 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2ra3 s GLY 142 N -1.14 1.70 0.32 6.99 0.00 -1.25 -4.44 107.32 109.50 2ra3 s GLY 142 Ca 0.55 -1.14 -0.29 0.00 0.00 0.00 0.00 44.72 43.84 2ra3 s GLY 142 CO 0.13 -0.29 1.33 -2.01 0.00 0.00 0.00 173.10 172.25 2ra3 n ASN 143 N -4.27 2.80 -0.87 1.64 2.85 0.43 -2.85 115.26 114.99 2ra3 n ASN 143 Ca 0.15 1.19 0.11 0.00 -0.11 0.00 0.00 54.58 55.92 2ra3 n ASN 143 Cb 0.59 -1.48 0.10 0.00 1.24 0.00 0.00 39.78 40.24 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 0.73 0.06 -4.33 -0.44 -2.24 -0.02 -0.92 114.28 107.12 2ra3 n THR 144 Ca 0.06 -0.53 -0.33 0.00 -2.27 0.00 0.00 64.05 60.98 2ra3 n THR 144 Cb 0.35 1.38 -0.09 0.00 -2.10 0.00 0.00 70.33 69.87 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 -1.72 3.23 -0.37 6.98 0.00 -1.26 -4.35 121.76 124.28 2ra3 s ALA 145 Ca 0.26 -0.94 0.23 0.00 0.00 0.00 0.00 51.96 51.51 2ra3 s ALA 145 Cb 0.18 -1.32 0.22 0.00 0.00 0.00 0.00 23.12 22.20 2ra3 s ALA 145 CO 0.27 0.63 1.42 0.77 0.00 0.00 0.00 175.76 178.85 2ra3 h SER 146 N 4.50 0.00 -4.09 0.00 0.02 -1.92 -3.45 113.55 108.60 2ra3 h SER 146 Ca -0.49 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.05 2ra3 h SER 146 Cb 1.18 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 63.43 2ra3 h SER 146 CO 0.56 0.00 -0.78 -0.44 -1.14 0.00 0.00 176.83 175.03 2ra3 s SER 147 N -5.93 1.18 0.36 3.07 0.01 -1.26 -4.77 113.70 106.37 2ra3 s SER 147 Ca 0.04 -0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.10 2ra3 s SER 147 Cb 0.07 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.17 2ra3 s SER 147 CO 0.71 0.11 0.00 0.61 0.41 0.00 0.00 173.24 175.08 2ra3 n GLY 148 N 2.76 -0.34 2.93 3.44 0.00 -1.26 -4.87 105.19 107.85 2ra3 n GLY 148 Ca -0.14 -1.06 -0.21 0.00 0.00 0.00 0.00 46.02 44.61 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 -1.36 0.84 -0.48 4.61 0.00 -1.26 -4.77 121.76 119.34 2ra3 s ALA 149 Ca 0.00 -0.16 0.06 0.00 0.00 0.00 0.00 51.96 51.86 2ra3 s ALA 149 Cb 0.00 -0.46 0.19 0.00 0.00 0.00 0.00 23.12 22.85 2ra3 s ALA 149 CO 0.00 0.03 0.63 -3.47 0.00 0.00 0.00 175.76 172.94 2ra3 n ASP 150 N 3.97 -2.34 -4.70 0.00 -0.08 -1.26 -4.95 116.55 107.18 2ra3 n ASP 150 Ca -0.24 -2.80 -0.37 0.00 -1.51 0.00 0.00 54.79 49.87 2ra3 n ASP 150 Cb 0.51 0.97 -0.07 0.00 2.34 0.00 0.00 41.12 44.87 2ra3 n ASP 150 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 2ra3 s TYR 151 N 0.50 3.44 0.31 -0.67 2.02 -1.26 -0.84 117.35 120.85 2ra3 s TYR 151 Ca 0.31 0.69 -0.16 0.00 -0.37 0.00 0.00 57.07 57.54 2ra3 s TYR 151 Cb 0.05 -2.47 -0.09 0.00 -0.40 0.00 0.00 41.96 39.05 2ra3 s TYR 151 CO -0.12 0.12 0.75 -1.25 -1.57 0.00 0.00 175.55 173.48 2ra3 s PRO 152 N 0.83 4.06 0.12 -1.71 0.04 -1.26 -4.99 135.00 132.09 2ra3 s PRO 152 Ca 0.20 0.74 0.03 0.00 0.04 0.00 0.00 61.00 62.01 2ra3 s PRO 152 Cb -0.14 -2.49 -0.19 0.00 0.04 0.00 0.00 34.50 31.72 2ra3 s PRO 152 CO 0.07 0.19 1.26 -0.44 0.04 0.00 0.00 177.00 178.12 2ra3 h ASP 153 N 2.43 0.17 -2.96 6.66 3.32 -1.94 -3.47 116.42 120.64 2ra3 h ASP 153 Ca -0.48 -0.18 -0.67 0.00 0.02 0.00 0.00 57.03 55.72 2ra3 h ASP 153 Cb 1.18 -0.06 -0.10 0.00 0.22 0.00 0.00 39.33 40.57 2ra3 h ASP 153 CO 0.65 1.10 -0.55 -1.61 -1.72 0.00 0.00 179.24 177.12 2ra3 s GLU 154 N -2.79 3.22 0.26 3.56 2.02 -1.26 -1.17 118.70 122.53 2ra3 s GLU 154 Ca -0.01 -0.29 -0.31 0.00 0.02 0.00 0.00 54.97 54.38 2ra3 s GLU 154 Cb 0.09 -3.00 -0.12 0.00 0.10 0.00 0.00 34.13 31.20 2ra3 s GLU 154 CO 0.84 0.73 1.56 -0.11 0.02 0.00 0.00 175.26 178.30 2ra3 n LEU 155 N 1.89 3.89 -4.76 1.80 7.94 -0.75 -4.89 117.00 122.13 2ra3 n LEU 155 Ca -0.18 1.13 -0.26 0.00 -1.11 0.00 0.00 56.01 55.59 2ra3 n LEU 155 Cb 0.54 -1.54 -0.06 0.00 0.53 0.00 0.00 43.42 42.90 2ra3 n LEU 155 CO 0.31 -0.05 -0.25 -1.10 -1.11 0.00 0.00 177.39 175.20 2ra3 s GLN 156 N -0.22 2.75 0.04 1.96 -1.52 -0.59 -0.97 119.66 121.11 2ra3 s GLN 156 Ca 0.67 -0.97 0.03 0.00 -1.95 0.00 0.00 55.36 53.14 2ra3 s GLN 156 Cb -0.55 -2.54 -0.02 0.00 -0.22 0.00 0.00 33.01 29.67 2ra3 s GLN 156 CO 0.46 0.46 -0.09 0.00 -0.25 0.00 0.00 175.29 175.88 2ra3 s LEU 158 N -1.39 0.55 -0.27 0.00 2.96 0.03 -0.53 118.68 120.03 2ra3 s LEU 158 Ca -0.06 0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 54.15 2ra3 s LEU 158 Cb -0.09 0.60 -0.04 0.00 0.50 0.00 0.00 46.19 47.16 2ra3 s LEU 158 CO 0.01 -0.16 0.31 -1.81 -1.32 0.00 0.00 176.35 173.38 2ra3 s ASP 159 N 1.20 6.18 0.01 3.68 1.01 -1.26 -1.00 116.67 126.48 2ra3 s ASP 159 Ca -0.09 0.18 -0.08 0.00 0.71 0.00 0.00 52.55 53.27 2ra3 s ASP 159 Cb -0.11 -2.18 0.00 0.00 1.01 0.00 0.00 42.92 41.64 2ra3 s ASP 159 CO -0.07 -0.14 0.15 0.00 0.21 0.00 0.00 175.17 175.31 2ra3 s ALA 160 N 1.97 -0.31 0.12 5.23 0.00 -0.51 -4.93 121.76 123.32 2ra3 s ALA 160 Ca 0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 51.96 51.85 2ra3 s ALA 160 Cb -0.16 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.07 2ra3 s ALA 160 CO 0.10 -0.25 0.33 -1.25 0.00 0.00 0.00 175.76 174.69 2ra3 s PRO 161 N -1.75 3.56 0.18 0.00 0.04 -1.26 -0.59 135.00 135.18 2ra3 s PRO 161 Ca -0.12 -0.20 -0.32 0.00 0.04 0.00 0.00 61.00 60.40 2ra3 s PRO 161 Cb -0.06 -2.91 -0.10 0.00 0.04 0.00 0.00 34.50 31.48 2ra3 s PRO 161 CO -0.00 0.51 1.58 0.08 0.04 0.00 0.00 177.00 179.21 2ra3 s VAL 162 N -1.62 2.54 0.24 -0.36 1.01 -0.39 -1.57 120.40 120.25 2ra3 s VAL 162 Ca 0.39 0.39 -0.01 0.00 0.00 0.00 0.00 61.98 62.75 2ra3 s VAL 162 Cb -0.12 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2ra3 s VAL 162 CO 0.26 0.03 0.45 -0.76 0.00 0.00 0.00 175.10 175.08 2ra3 s LEU 163 N 1.04 4.17 0.73 3.92 1.43 -0.31 -0.93 118.68 128.73 2ra3 s LEU 163 Ca 0.70 0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 54.11 2ra3 s LEU 163 Cb -0.44 -3.25 0.04 0.00 0.03 0.00 0.00 46.19 42.57 2ra3 s LEU 163 CO 0.32 -0.11 1.15 -0.94 0.23 0.00 0.00 176.35 177.00 2ra3 s SER 164 N -3.34 4.40 0.27 2.29 1.04 -1.26 -4.64 113.70 112.45 2ra3 s SER 164 Ca 0.40 2.15 -0.04 0.00 0.48 0.00 0.00 55.95 58.93 2ra3 s SER 164 Cb -0.11 -2.56 0.35 0.00 0.10 0.00 0.00 66.02 63.80 2ra3 s SER 164 CO 0.30 -2.12 1.92 -0.61 0.98 0.00 0.00 173.24 173.72 2ra3 h GLN 165 N -0.47 1.22 -0.90 4.02 4.15 -1.98 -1.90 115.11 119.24 2ra3 h GLN 165 Ca -0.46 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 58.91 2ra3 h GLN 165 Cb 1.27 -0.27 -0.05 0.00 0.21 0.00 0.00 27.48 28.63 2ra3 h GLN 165 CO 0.50 0.80 0.59 0.00 -1.93 0.00 0.00 178.83 178.80 2ra3 h ALA 166 N 1.42 1.18 -0.28 3.38 0.00 -1.99 0.20 119.26 123.17 2ra3 h ALA 166 Ca 0.38 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 55.06 2ra3 h ALA 166 Cb -0.05 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.42 2ra3 h ALA 166 CO -0.11 0.47 -0.54 0.87 0.00 0.00 0.00 179.25 179.95 2ra3 h LYS 167 N 1.16 0.82 -0.12 0.00 1.57 -1.75 -1.36 116.57 116.89 2ra3 h LYS 167 Ca 0.35 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2ra3 h LYS 167 Cb -0.03 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2ra3 h LYS 167 CO -0.11 1.14 0.08 0.00 -0.57 0.00 0.00 179.45 180.00 2ra3 h GLU 169 N 0.16 0.87 -0.20 0.00 4.39 -0.91 -2.01 114.58 116.89 2ra3 h GLU 169 Ca 0.04 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 2ra3 h GLU 169 Cb -0.01 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.45 2ra3 h GLU 169 CO -0.01 0.66 -0.13 0.00 -1.16 0.00 0.00 179.01 178.38 2ra3 h ALA 170 N 1.16 1.42 -0.10 3.43 0.00 -1.09 -2.21 119.26 121.88 2ra3 h ALA 170 Ca 0.22 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 2ra3 h ALA 170 Cb 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2ra3 h ALA 170 CO -0.04 0.40 -0.64 0.77 0.00 0.00 0.00 179.25 179.75 2ra3 h SER 171 N 0.30 0.43 -2.04 0.00 0.02 -0.88 -3.38 113.55 108.00 2ra3 h SER 171 Ca 0.06 -0.25 -0.54 0.00 -0.84 0.00 0.00 61.79 60.22 2ra3 h SER 171 Cb 0.41 -0.13 -0.40 0.00 0.14 0.00 0.00 62.40 62.43 2ra3 h SER 171 CO 0.02 0.95 -1.06 -1.22 -1.14 0.00 0.00 176.83 174.39 2ra3 n TYR 172 N -3.88 0.47 -1.67 3.45 4.01 -0.79 -4.88 117.16 113.87 2ra3 n TYR 172 Ca -0.03 -3.73 -0.47 0.00 -0.16 0.00 0.00 57.90 53.51 2ra3 n TYR 172 Cb 0.65 -0.40 -0.04 0.00 -0.31 0.00 0.00 39.34 39.23 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 0.87 2.19 -0.67 -0.72 -0.02 -0.86 -1.63 135.00 134.16 2ra3 n PRO 173 Ca 0.24 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 2ra3 n PRO 173 Cb 0.55 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 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 3.76 1.29 0.31 -1.23 0.00 -1.26 -4.85 105.19 103.19 2ra3 n GLY 174 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 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 -2.00 1.79 -3.31 1.61 5.02 -0.65 -4.91 118.16 115.71 2ra3 n LYS 175 Ca 0.00 -0.69 -0.41 0.00 -2.02 0.00 0.00 58.31 55.19 2ra3 n LYS 175 Cb 0.00 -1.24 -0.08 0.00 -0.02 0.00 0.00 35.03 33.68 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 -1.89 5.08 0.75 -0.18 -1.09 -1.25 -5.03 121.20 117.59 2ra3 s ILE 176 Ca 0.12 0.26 -0.06 0.00 -2.23 0.00 0.00 60.65 58.73 2ra3 s ILE 176 Cb 0.12 -3.90 0.11 0.00 -1.58 0.00 0.00 42.46 37.21 2ra3 s ILE 176 CO 0.41 -0.15 1.06 0.42 -1.23 0.00 0.00 174.94 175.45 2ra3 s THR 177 N 2.24 2.20 -0.96 2.92 -4.23 -1.26 -4.96 115.64 111.59 2ra3 s THR 177 Ca 0.16 -0.34 0.12 0.00 -1.18 0.00 0.00 61.69 60.45 2ra3 s THR 177 Cb -0.16 -2.86 0.10 0.00 1.34 0.00 0.00 72.50 70.92 2ra3 s THR 177 CO 0.12 0.00 1.37 -1.54 -0.54 0.00 0.00 174.62 174.04 2ra3 n SER 178 N -3.04 0.05 -1.41 3.99 3.41 -1.26 -1.90 113.62 113.46 2ra3 n SER 178 Ca 0.12 0.51 0.11 0.00 -0.26 0.00 0.00 58.87 59.35 2ra3 n SER 178 Cb 0.60 -0.52 0.33 0.00 -0.26 0.00 0.00 64.21 64.36 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 -1.55 4.17 -4.33 4.04 3.02 -1.26 -4.96 115.26 114.40 2ra3 n ASN 179 Ca 0.03 -2.13 -0.27 0.00 -0.03 0.00 0.00 54.58 52.17 2ra3 n ASN 179 Cb 0.13 -0.51 -0.14 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 -1.24 1.43 0.09 3.52 -1.94 -0.80 -0.63 119.30 119.73 2ra3 s MET 180 Ca 0.49 -1.17 -0.11 0.00 -1.71 0.00 0.00 55.69 53.20 2ra3 s MET 180 Cb 0.27 -1.72 0.01 0.00 2.01 0.00 0.00 34.83 35.40 2ra3 s MET 180 CO 0.31 0.42 0.25 -0.59 -0.01 0.00 0.00 175.02 175.40 2ra3 s PHE 181 N -0.97 0.04 -0.01 -0.03 -0.71 -0.04 -4.80 117.98 111.46 2ra3 s PHE 181 Ca 0.10 -0.42 0.02 0.00 -1.04 0.00 0.00 56.93 55.59 2ra3 s PHE 181 Cb -0.10 0.03 -0.03 0.00 -1.21 0.00 0.00 43.02 41.71 2ra3 s PHE 181 CO 0.04 -0.57 -0.02 0.00 -1.34 0.00 0.00 175.22 173.33 2ra3 s VAL 183 N -1.03 0.22 -2.53 0.00 1.01 -1.12 -1.16 120.40 115.77 2ra3 s VAL 183 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2ra3 s VAL 183 Cb -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 36.04 2ra3 s VAL 183 CO 0.08 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.88 2ra3 n GLY 184 N 3.33 0.55 2.81 4.51 0.00 -0.61 -3.66 105.19 112.12 2ra3 n GLY 184 Ca -0.17 -1.56 -0.20 0.00 0.00 0.00 0.00 46.02 44.08 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 -3.31 0.56 0.34 1.61 0.40 -1.26 -4.25 117.98 112.06 2ra3 s PHE 184 Ca 0.00 -0.11 0.31 0.00 -0.60 0.00 0.00 56.93 56.54 2ra3 s PHE 184 Cb 0.00 -0.64 1.52 0.00 0.51 0.00 0.00 43.02 44.41 2ra3 s PHE 184 CO 0.00 -0.23 2.07 -0.07 0.70 0.00 0.00 175.22 177.68 2ra3 h LEU 185 N 7.76 0.00 0.00 -0.37 3.38 -1.97 -0.92 115.31 123.19 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 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2ra3 h LEU 185 CO 0.36 0.08 0.00 -0.62 0.09 0.00 0.00 178.44 178.36 2ra3 n GLU 186 N -3.37 0.51 0.00 1.13 -0.58 -1.26 -0.07 120.64 117.00 2ra3 n GLU 186 Ca -0.01 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 2ra3 n GLU 186 Cb 0.25 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.62 2ra3 n GLU 186 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ra3 n GLY 187 N 0.51 -0.12 2.77 0.62 0.00 -0.35 -4.43 105.19 104.19 2ra3 n GLY 187 Ca 0.14 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 2.90 2.89 -0.02 0.00 -0.18 -4.80 105.19 105.97 2ra3 n GLY 188 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.15 0.06 0.06 1.61 1.02 -1.26 -4.15 119.74 116.93 2ra3 s LYS 188 Ca 0.00 0.35 -0.28 0.00 0.02 0.00 0.00 55.97 56.06 2ra3 s LYS 188 Cb 0.00 -0.20 0.09 0.00 -0.52 0.00 0.00 37.83 37.20 2ra3 s LYS 188 CO 0.00 -0.18 1.12 0.34 -0.92 0.00 0.00 175.35 175.71 2ra3 s ASP 189 N 1.23 -0.13 0.51 2.83 -1.08 -0.57 -4.53 116.67 114.93 2ra3 s ASP 189 Ca -0.08 -0.25 -0.06 0.00 -0.52 0.00 0.00 52.55 51.64 2ra3 s ASP 189 Cb -0.12 0.32 -0.03 0.00 -1.46 0.00 0.00 42.92 41.63 2ra3 s ASP 189 CO -0.05 -0.59 0.82 -0.94 0.52 0.00 0.00 175.17 174.92 2ra3 s SER 190 N -2.91 6.16 0.36 -0.34 1.04 -1.26 -0.38 113.70 116.37 2ra3 s SER 190 Ca 0.13 0.92 -0.00 0.00 0.48 0.00 0.00 55.95 57.48 2ra3 s SER 190 Cb 0.02 -2.18 0.00 0.00 0.10 0.00 0.00 66.02 63.96 2ra3 s SER 190 CO -0.01 -0.67 0.47 0.00 0.98 0.00 0.00 173.24 174.01 2ra3 n GLN 192 N -0.61 1.87 0.00 0.00 3.00 -1.26 -0.81 117.38 119.58 2ra3 n GLN 192 Ca 0.02 0.67 0.00 0.00 -0.01 0.00 0.00 57.00 57.68 2ra3 n GLN 192 Cb 0.61 -2.40 0.00 0.00 0.00 0.00 0.00 30.24 28.46 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 3.06 2.95 0.13 1.08 0.00 -1.26 -0.43 105.19 110.73 2ra3 n GLY 193 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 2ra3 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2ra3 h ASP 194 N 0.00 0.00 -2.63 1.61 3.32 -1.29 -3.31 116.42 114.13 2ra3 h ASP 194 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 2ra3 h ASP 194 Cb 0.00 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.68 2ra3 h ASP 194 CO 0.00 0.11 0.02 0.00 -1.72 0.00 0.00 179.24 177.65 2ra3 n ALA 195 N -2.20 -0.39 0.00 3.45 0.00 -1.26 -1.72 120.51 118.39 2ra3 n ALA 195 Ca -0.01 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2ra3 n ALA 195 Cb 0.60 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.06 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 1.34 3.21 3.84 0.00 0.00 -0.17 -0.31 105.19 113.10 2ra3 n GLY 196 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.13 1.72 0.20 -0.02 0.00 -0.70 -3.30 107.32 103.08 2ra3 s GLY 197 Ca 0.00 -1.10 -0.17 0.00 0.00 0.00 0.00 44.72 43.45 2ra3 s GLY 197 CO 0.00 -0.31 0.66 2.56 0.00 0.00 0.00 173.10 176.01 2ra3 s PRO 198 N -5.74 4.14 -0.30 2.90 0.04 -1.26 -1.41 135.00 133.37 2ra3 s PRO 198 Ca 0.72 0.72 0.01 0.00 0.04 0.00 0.00 61.00 62.49 2ra3 s PRO 198 Cb -0.06 -2.87 0.07 0.00 0.04 0.00 0.00 34.50 31.68 2ra3 s PRO 198 CO 0.54 0.41 -0.02 0.08 0.04 0.00 0.00 177.00 178.04 2ra3 s VAL 199 N -1.53 2.54 -0.16 -0.36 1.01 -0.50 -3.17 120.40 118.22 2ra3 s VAL 199 Ca 0.42 -1.72 -0.04 0.00 0.00 0.00 0.00 61.98 60.64 2ra3 s VAL 199 Cb -0.16 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 2ra3 s VAL 199 CO 0.20 -0.21 -0.03 -0.69 0.00 0.00 0.00 175.10 174.37 2ra3 s VAL 200 N 1.12 3.94 -0.12 2.92 1.01 -0.38 -0.95 120.40 127.93 2ra3 s VAL 200 Ca -0.03 -0.34 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 2ra3 s VAL 200 Cb -0.20 -2.73 0.03 0.00 0.00 0.00 0.00 36.38 33.48 2ra3 s VAL 200 CO -0.04 0.49 -0.08 0.00 0.00 0.00 0.00 175.10 175.47 2ra3 n ASN 202 N 4.93 -1.76 -0.06 0.00 3.02 -1.26 -1.82 115.26 118.30 2ra3 n ASN 202 Ca -0.13 -0.93 -0.01 0.00 -0.03 0.00 0.00 54.58 53.48 2ra3 n ASN 202 Cb 0.50 -3.33 -0.00 0.00 -0.61 0.00 0.00 39.78 36.34 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 -1.75 0.46 3.19 7.41 0.00 -1.26 -5.01 105.19 108.22 2ra3 n GLY 203 Ca -0.18 -0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.78 1.30 -0.63 1.61 -0.21 -0.76 -3.99 119.66 116.21 2ra3 s GLN 204 Ca 0.00 -0.76 -0.27 0.00 0.02 0.00 0.00 55.36 54.35 2ra3 s GLN 204 Cb 0.00 -1.32 0.01 0.00 1.00 0.00 0.00 33.01 32.70 2ra3 s GLN 204 CO 0.00 0.35 1.44 -1.17 -2.12 0.00 0.00 175.29 173.79 2ra3 s LEU 209 N -0.82 3.30 -0.14 2.90 2.96 -0.22 -1.38 118.68 125.28 2ra3 s LEU 209 Ca 0.06 0.04 0.15 0.00 -0.22 0.00 0.00 54.13 54.16 2ra3 s LEU 209 Cb -0.08 -2.80 -0.24 0.00 0.50 0.00 0.00 46.19 43.57 2ra3 s LEU 209 CO 0.01 -1.86 0.31 0.00 -1.32 0.00 0.00 176.35 173.48 2ra3 n GLN 210 N 8.99 0.67 -4.10 1.98 1.13 -0.13 -3.87 117.38 122.05 2ra3 n GLN 210 Ca 0.10 0.13 -0.12 0.00 -1.94 0.00 0.00 57.00 55.18 2ra3 n GLN 210 Cb 0.50 -1.64 -0.11 0.00 0.11 0.00 0.00 30.24 29.10 2ra3 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2ra3 s GLY 211 N -5.37 0.58 -0.16 1.08 0.00 -0.90 -1.75 107.32 100.80 2ra3 s GLY 211 Ca -0.09 -0.98 -0.02 0.00 0.00 0.00 0.00 44.72 43.63 2ra3 s GLY 211 CO 0.82 -1.06 -0.10 0.14 0.00 0.00 0.00 173.10 172.90 2ra3 s VAL 212 N -2.29 3.15 0.16 1.40 1.01 -0.94 -1.41 120.40 121.47 2ra3 s VAL 212 Ca -0.02 -0.60 -0.32 0.00 0.00 0.00 0.00 61.98 61.04 2ra3 s VAL 212 Cb -0.04 -2.37 -0.12 0.00 0.00 0.00 0.00 36.38 33.86 2ra3 s VAL 212 CO -0.02 0.49 1.74 0.52 0.00 0.00 0.00 175.10 177.83 2ra3 n VAL 213 N 4.02 0.15 0.00 2.92 0.31 -0.50 -1.44 118.33 123.78 2ra3 n VAL 213 Ca -0.18 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 2ra3 n VAL 213 Cb 0.52 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.52 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 4.52 0.00 -3.83 4.52 2.88 -1.02 -1.00 113.62 119.69 2ra3 n SER 214 Ca 0.17 0.00 -0.10 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 -0.33 0.48 0.06 0.66 1.48 -0.89 -4.89 118.94 115.51 2ra3 s TRP 215 Ca 0.00 -0.84 -0.26 0.00 -1.06 0.00 0.00 56.10 53.94 2ra3 s TRP 215 Cb 0.00 0.16 0.09 0.00 -1.16 0.00 0.00 33.47 32.56 2ra3 s TRP 215 CO 0.00 -1.04 1.19 0.20 -4.06 0.00 0.00 176.95 173.24 2ra3 s GLY 216 N -3.06 -0.09 -0.79 3.67 0.00 -1.26 -0.57 107.32 105.22 2ra3 s GLY 216 Ca 0.24 0.01 -0.21 0.00 0.00 0.00 0.00 44.72 44.76 2ra3 s GLY 216 CO 0.11 3.44 1.06 -0.35 0.00 0.00 0.00 173.10 177.36 2ra3 s ASP 217 N -3.51 6.37 0.86 1.64 2.15 -1.26 -4.87 116.67 118.05 2ra3 s ASP 217 Ca 0.24 -1.42 0.00 0.00 0.43 0.00 0.00 52.55 51.80 2ra3 s ASP 217 Cb -0.00 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 2ra3 s ASP 217 CO 0.01 -1.31 0.00 0.61 -0.17 0.00 0.00 175.17 174.31 2ra3 n GLY 219 N 5.50 0.81 2.91 2.66 0.00 -1.26 -4.67 105.19 111.14 2ra3 n GLY 219 Ca 0.09 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 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 3.31 -0.34 -1.89 0.00 0.00 -1.26 -4.74 120.51 115.58 2ra3 n ALA 221 Ca -0.16 0.30 -0.35 0.00 0.00 0.00 0.00 53.44 53.23 2ra3 n ALA 221 Cb 0.58 -2.00 -0.06 0.00 0.00 0.00 0.00 19.45 17.96 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 -3.85 4.37 0.18 0.00 -0.21 -1.26 -1.01 119.66 117.87 2ra3 s GLN 221 Ca 0.00 1.12 -0.33 0.00 0.02 0.00 0.00 55.36 56.16 2ra3 s GLN 221 Cb 0.00 -2.61 -0.14 0.00 1.00 0.00 0.00 33.01 31.26 2ra3 s GLN 221 CO 0.00 0.21 1.49 1.17 -2.12 0.00 0.00 175.29 176.04 2ra3 n LYS 222 N 0.18 1.98 -1.31 2.91 4.81 -1.26 -1.79 118.16 123.68 2ra3 n LYS 222 Ca 0.03 0.71 -0.11 0.00 -0.87 0.00 0.00 58.31 58.07 2ra3 n LYS 222 Cb 0.52 -2.43 -0.05 0.00 0.02 0.00 0.00 35.03 33.09 2ra3 n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2ra3 n ASN 223 N 2.89 -4.55 -3.20 3.14 3.02 0.90 -4.91 115.26 112.54 2ra3 n ASN 223 Ca 0.15 0.27 -0.23 0.00 -0.03 0.00 0.00 54.58 54.74 2ra3 n ASN 223 Cb 0.28 -3.00 -0.06 0.00 -0.61 0.00 0.00 39.78 36.39 2ra3 n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ra3 n LYS 224 N -2.35 1.03 -1.48 3.52 4.76 -0.74 -4.59 118.16 118.31 2ra3 n LYS 224 Ca -0.11 -3.45 -0.32 0.00 -2.87 0.00 0.00 58.31 51.56 2ra3 n LYS 224 Cb 0.40 -1.46 0.07 0.00 -1.84 0.00 0.00 35.03 32.20 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 -1.67 2.44 0.58 1.97 0.04 -1.26 -4.31 135.00 132.78 2ra3 s PRO 225 Ca 0.37 1.34 -0.20 0.00 0.04 0.00 0.00 61.00 62.54 2ra3 s PRO 225 Cb 0.21 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.81 2ra3 s PRO 225 CO -0.09 -1.52 1.30 0.20 0.04 0.00 0.00 177.00 176.92 2ra3 s GLY 226 N -2.87 2.85 -0.10 0.56 0.00 -1.24 -4.74 107.32 101.78 2ra3 s GLY 226 Ca 0.65 1.21 -0.02 0.00 0.00 0.00 0.00 44.72 46.56 2ra3 s GLY 226 CO 0.48 1.68 0.00 0.14 0.00 0.00 0.00 173.10 175.41 2ra3 s VAL 227 N -1.40 4.32 0.02 1.40 1.01 0.27 -2.81 120.40 123.20 2ra3 s VAL 227 Ca 0.75 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.52 2ra3 s VAL 227 Cb -0.37 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 2ra3 s VAL 227 CO 0.42 0.59 -0.09 -0.31 0.00 0.00 0.00 175.10 175.71 2ra3 s TYR 228 N -0.74 0.75 0.10 5.22 1.51 0.61 -2.10 117.35 122.71 2ra3 s TYR 228 Ca 0.12 -0.28 -0.30 0.00 -1.01 0.00 0.00 57.07 55.60 2ra3 s TYR 228 Cb -0.12 -0.46 -0.06 0.00 -0.11 0.00 0.00 41.96 41.21 2ra3 s TYR 228 CO 0.02 -0.02 1.14 0.99 -1.11 0.00 0.00 175.55 176.57 2ra3 s THR 229 N -0.67 4.05 -0.85 -0.71 2.01 -0.52 -0.86 115.64 118.10 2ra3 s THR 229 Ca -0.01 1.58 -0.25 0.00 0.31 0.00 0.00 61.69 63.32 2ra3 s THR 229 Cb -0.06 -4.01 0.01 0.00 0.01 0.00 0.00 72.50 68.45 2ra3 s THR 229 CO 0.00 0.19 1.59 -0.54 -0.69 0.00 0.00 174.62 175.17 2ra3 s LYS 230 N 0.46 3.08 0.33 4.92 1.02 0.20 -2.22 119.74 127.53 2ra3 s LYS 230 Ca 0.54 -0.39 0.06 0.00 0.02 0.00 0.00 55.97 56.20 2ra3 s LYS 230 Cb -0.29 -4.81 0.71 0.00 -0.52 0.00 0.00 37.83 32.93 2ra3 s LYS 230 CO 0.32 -2.55 1.86 0.28 -0.92 0.00 0.00 175.35 174.34 2ra3 h VAL 231 N 6.72 0.88 -0.38 3.17 2.07 -1.63 -1.83 116.25 125.25 2ra3 h VAL 231 Ca -0.03 -0.28 0.11 0.00 0.82 0.00 0.00 66.70 67.32 2ra3 h VAL 231 Cb 1.05 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2ra3 h VAL 231 CO 1.30 0.15 0.28 0.22 0.02 0.00 0.00 177.57 179.54 2ra3 h TYR 232 N 0.81 0.00 0.00 1.57 3.20 -1.83 -0.26 116.97 120.46 2ra3 h TYR 232 Ca 0.45 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.32 2ra3 h TYR 232 Cb 0.59 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.86 2ra3 h TYR 232 CO -0.00 0.00 0.00 0.09 -1.64 0.00 0.00 178.16 176.61 2ra3 n ASN 233 N -4.38 0.00 -0.01 -2.11 4.13 -0.69 -3.28 115.26 108.92 2ra3 n ASN 233 Ca 0.06 0.19 0.01 0.00 1.68 0.00 0.00 54.58 56.52 2ra3 n ASN 233 Cb 0.47 -0.36 0.01 0.00 -1.54 0.00 0.00 39.78 38.36 2ra3 n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2ra3 n TYR 234 N -1.36 0.00 -0.30 3.10 4.01 -0.11 -4.80 117.16 117.70 2ra3 n TYR 234 Ca 0.07 -0.50 -0.05 0.00 -0.16 0.00 0.00 57.90 57.27 2ra3 n TYR 234 Cb 0.16 -0.05 0.07 0.00 -0.31 0.00 0.00 39.34 39.21 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 0.24 1.25 -0.43 -0.72 2.07 -1.53 0.79 116.25 117.91 2ra3 h VAL 235 Ca 0.00 -0.66 -0.12 0.00 0.82 0.00 0.00 66.70 66.74 2ra3 h VAL 235 Cb 0.57 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2ra3 h VAL 235 CO 0.00 0.29 -0.19 0.50 0.02 0.00 0.00 177.57 178.18 2ra3 h LYS 236 N 1.16 0.89 -0.46 1.57 3.64 -1.87 -1.12 116.57 120.38 2ra3 h LYS 236 Ca 0.29 -0.38 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2ra3 h LYS 236 Cb 0.07 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 2ra3 h LYS 236 CO -0.04 1.03 0.29 2.35 -2.27 0.00 0.00 179.45 180.81 2ra3 h TRP 237 N 0.71 0.55 -0.03 1.91 7.01 -1.75 0.10 115.95 124.46 2ra3 h TRP 237 Ca 0.10 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 2ra3 h TRP 237 Cb 0.76 -0.18 -0.00 0.00 -2.10 0.00 0.00 29.16 27.63 2ra3 h TRP 237 CO 0.06 0.34 0.02 0.82 -2.79 0.00 0.00 178.44 176.88 2ra3 h ILE 238 N 0.59 1.05 -0.60 2.65 2.04 -0.65 0.17 117.51 122.76 2ra3 h ILE 238 Ca 0.17 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 2ra3 h ILE 238 Cb -0.04 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2ra3 h ILE 238 CO -0.05 0.04 0.26 0.11 0.00 0.00 0.00 178.15 178.50 2ra3 h LYS 239 N -0.00 0.88 -0.56 2.37 1.57 -0.90 -0.70 116.57 119.23 2ra3 h LYS 239 Ca 0.01 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.58 2ra3 h LYS 239 Cb 0.05 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2ra3 h LYS 239 CO -0.00 0.74 0.11 -0.91 -0.57 0.00 0.00 179.45 178.82 2ra3 h ASN 240 N 0.82 0.88 -0.25 0.86 -0.26 -0.73 -1.37 115.58 115.52 2ra3 h ASN 240 Ca 0.20 -0.25 -0.04 0.00 -0.56 0.00 0.00 56.30 55.65 2ra3 h ASN 240 Cb 0.17 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.19 2ra3 h ASN 240 CO -0.02 0.90 0.00 0.74 -1.06 0.00 0.00 177.43 177.99 2ra3 h THR 241 N 0.82 1.25 -0.79 2.81 2.02 -0.66 -0.41 112.91 117.95 2ra3 h THR 241 Ca 0.17 -0.90 0.02 0.00 0.77 0.00 0.00 66.41 66.48 2ra3 h THR 241 Cb 0.38 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 2ra3 h THR 241 CO 0.01 0.28 0.51 0.40 0.37 0.00 0.00 175.52 177.09 2ra3 h ILE 242 N 0.23 1.15 -0.48 3.11 2.04 -0.98 -2.30 117.51 120.28 2ra3 h ILE 242 Ca 0.07 -0.35 -0.11 0.00 1.00 0.00 0.00 64.86 65.48 2ra3 h ILE 242 Cb 0.41 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2ra3 h ILE 242 CO 0.01 0.18 -0.13 0.00 0.00 0.00 0.00 178.15 178.22 2ra3 h ALA 243 N 1.31 0.87 0.00 1.87 0.00 -1.04 -2.60 119.26 119.68 2ra3 h ALA 243 Ca 0.30 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ra3 h ALA 243 Cb -0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2ra3 h ALA 243 CO -0.09 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.80 2ra3 n ALA 244 N -2.50 2.01 -2.07 0.00 0.00 -0.18 -3.56 120.51 114.22 2ra3 n ALA 244 Ca 0.01 0.02 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 2ra3 n ALA 244 Cb 0.39 -1.43 0.07 0.00 0.00 0.00 0.00 19.45 18.48 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 -2.25 3.54 -0.21 0.00 3.02 -0.89 -5.09 115.26 113.39 2ra3 n ASN 245 Ca 0.04 -3.45 0.03 0.00 -0.03 0.00 0.00 54.58 51.17 2ra3 n ASN 245 Cb 0.34 -0.40 0.02 0.00 -0.61 0.00 0.00 39.78 39.13 2ra3 n ASN 245 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44