#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ab4 s LEU 3 N 0.00 5.20 -0.11 0.00 2.96 -1.26 -0.92 118.68 124.56 3ab4 s LEU 3 Ca 0.00 -1.56 -0.02 0.00 -0.22 0.00 0.00 54.13 52.33 3ab4 s LEU 3 Cb 0.00 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 3ab4 s LEU 3 CO 0.00 -0.55 -0.03 0.68 -1.32 0.00 0.00 176.35 175.13 3ab4 s VAL 4 N 1.41 3.98 -0.07 1.68 -7.23 -0.81 -0.30 120.40 119.06 3ab4 s VAL 4 Ca 0.03 -0.35 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 3ab4 s VAL 4 Cb -0.23 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.98 3ab4 s VAL 4 CO 0.02 0.55 -0.06 -0.69 -0.31 0.00 0.00 175.10 174.61 3ab4 s VAL 5 N -0.32 3.74 0.01 1.32 1.01 0.12 -2.88 120.40 123.40 3ab4 s VAL 5 Ca 0.05 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.61 3ab4 s VAL 5 Cb -0.12 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 3ab4 s VAL 5 CO 0.02 0.59 -0.11 -1.10 0.00 0.00 0.00 175.10 174.50 3ab4 s GLN 6 N -0.74 0.86 -0.04 2.72 -0.21 -0.89 0.88 119.66 122.25 3ab4 s GLN 6 Ca 0.11 -0.50 0.03 0.00 0.02 0.00 0.00 55.36 55.03 3ab4 s GLN 6 Cb -0.11 -0.83 0.00 0.00 1.00 0.00 0.00 33.01 33.07 3ab4 s GLN 6 CO 0.02 0.22 -0.13 0.21 -2.12 0.00 0.00 175.29 173.48 3ab4 s LYS 7 N -0.55 1.42 -0.07 2.91 2.36 0.13 -1.16 119.74 124.77 3ab4 s LYS 7 Ca 0.03 -0.45 0.03 0.00 -2.55 0.00 0.00 55.97 53.02 3ab4 s LYS 7 Cb -0.05 -1.25 0.01 0.00 -1.05 0.00 0.00 37.83 35.48 3ab4 s LYS 7 CO 0.00 0.16 -0.15 0.71 1.55 0.00 0.00 175.35 177.62 3ab4 s TYR 8 N 0.19 1.73 0.59 4.03 2.02 -0.57 -0.70 117.35 124.63 3ab4 s TYR 8 Ca -0.05 -0.65 0.02 0.00 -0.37 0.00 0.00 57.07 56.02 3ab4 s TYR 8 Cb -0.11 -1.22 0.11 0.00 -0.40 0.00 0.00 41.96 40.34 3ab4 s TYR 8 CO 0.02 -0.30 0.80 0.41 -1.57 0.00 0.00 175.55 174.91 3ab4 n GLY 9 N 3.70 0.97 0.22 0.71 0.00 -1.24 -1.44 105.19 108.11 3ab4 n GLY 9 Ca -0.22 -2.06 -0.03 0.00 0.00 0.00 0.00 46.02 43.71 3ab4 n GLY 9 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ab4 h GLY 10 N -0.37 0.78 1.61 -0.02 0.00 -1.85 -2.41 103.07 100.81 3ab4 h GLY 10 Ca -0.27 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 46.84 3ab4 h GLY 10 CO 0.31 0.09 -0.01 1.76 0.00 0.00 0.00 176.54 178.69 3ab4 h SER 11 N 0.51 0.45 1.03 0.19 0.02 -1.90 0.52 113.55 114.36 3ab4 h SER 11 Ca 0.25 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 3ab4 h SER 11 Cb 0.19 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.61 3ab4 h SER 11 CO -0.19 0.53 0.00 -1.20 -1.14 0.00 0.00 176.83 174.83 3ab4 n SER 12 N -4.29 0.67 -1.46 3.07 7.64 -0.94 -3.42 113.62 114.89 3ab4 n SER 12 Ca 0.01 0.62 -0.02 0.00 1.01 0.00 0.00 58.87 60.48 3ab4 n SER 12 Cb 0.24 -0.77 0.10 0.00 -1.01 0.00 0.00 64.21 62.77 3ab4 n SER 12 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3ab4 n LEU 13 N -2.18 2.69 -0.03 -3.43 4.77 -0.58 -4.44 117.00 113.80 3ab4 n LEU 13 Ca 0.04 -3.55 0.15 0.00 -0.03 0.00 0.00 56.01 52.62 3ab4 n LEU 13 Cb 0.31 -0.22 0.88 0.00 -2.33 0.00 0.00 43.42 42.06 3ab4 n LEU 13 CO 0.24 1.32 1.07 -1.84 -1.33 0.00 0.00 177.39 176.84 3ab4 n GLU 14 N -0.58 1.04 -3.50 3.23 0.28 -0.65 -3.87 120.64 116.59 3ab4 n GLU 14 Ca 0.20 -0.06 -0.09 0.00 -0.16 0.00 0.00 57.16 57.05 3ab4 n GLU 14 Cb 0.88 -1.48 -0.03 0.00 1.43 0.00 0.00 31.44 32.25 3ab4 n GLU 14 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3ab4 s SER 15 N -1.95 -0.40 0.20 -1.84 0.15 -1.26 -4.71 113.70 103.89 3ab4 s SER 15 Ca 0.45 0.08 -0.06 0.00 0.70 0.00 0.00 55.95 57.12 3ab4 s SER 15 Cb 0.21 0.40 0.13 0.00 -1.71 0.00 0.00 66.02 65.05 3ab4 s SER 15 CO 0.35 -0.62 1.60 0.00 1.20 0.00 0.00 173.24 175.77 3ab4 h ALA 16 N 2.11 0.82 -0.68 5.45 0.00 -1.99 0.23 119.26 125.21 3ab4 h ALA 16 Ca -0.23 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 3ab4 h ALA 16 Cb 1.23 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 3ab4 h ALA 16 CO 0.32 0.65 0.25 1.49 0.00 0.00 0.00 179.25 181.96 3ab4 h GLU 17 N 0.73 1.01 -0.15 0.00 4.81 -1.99 -1.33 114.58 117.65 3ab4 h GLU 17 Ca 0.10 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 3ab4 h GLU 17 Cb 0.76 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 3ab4 h GLU 17 CO 0.06 0.83 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.98 3ab4 h ARG 18 N 0.98 0.34 -0.08 1.92 9.65 -1.77 -1.66 114.38 123.76 3ab4 h ARG 18 Ca 0.23 -0.16 0.01 0.00 -1.10 0.00 0.00 59.98 58.96 3ab4 h ARG 18 Cb 0.22 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 3ab4 h ARG 18 CO -0.02 0.68 0.00 0.82 2.80 0.00 0.00 179.97 184.26 3ab4 h ILE 19 N -0.01 0.95 -0.65 1.20 2.04 -0.33 0.20 117.51 120.91 3ab4 h ILE 19 Ca 0.03 -0.01 0.07 0.00 1.00 0.00 0.00 64.86 65.95 3ab4 h ILE 19 Cb 0.60 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.54 3ab4 h ILE 19 CO 0.03 0.01 0.33 0.03 0.00 0.00 0.00 178.15 178.55 3ab4 h ARG 20 N 0.03 0.58 -0.19 2.37 3.08 -1.28 0.38 114.38 119.35 3ab4 h ARG 20 Ca 0.04 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.07 3ab4 h ARG 20 Cb 0.04 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 3ab4 h ARG 20 CO -0.06 0.39 0.04 -0.97 -1.07 0.00 0.00 179.97 178.30 3ab4 h ASN 21 N 0.60 0.02 -0.80 7.04 -0.73 -0.29 -0.07 115.58 121.36 3ab4 h ASN 21 Ca 0.30 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.47 3ab4 h ASN 21 Cb 0.25 0.03 -0.04 0.00 0.27 0.00 0.00 38.32 38.84 3ab4 h ASN 21 CO -0.22 0.04 0.39 0.58 -0.37 0.00 0.00 177.43 177.85 3ab4 h VAL 22 N 0.12 1.25 -0.98 2.57 2.07 -0.37 -2.62 116.25 118.29 3ab4 h VAL 22 Ca 0.08 -0.70 0.08 0.00 0.82 0.00 0.00 66.70 66.98 3ab4 h VAL 22 Cb 0.07 0.22 -0.07 0.00 -1.52 0.00 0.00 31.29 29.99 3ab4 h VAL 22 CO -0.10 0.30 0.63 0.00 0.02 0.00 0.00 177.57 178.41 3ab4 h ALA 23 N 1.28 1.39 -0.50 1.67 0.00 0.86 -1.47 119.26 122.49 3ab4 h ALA 23 Ca 0.28 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.06 3ab4 h ALA 23 Cb 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ab4 h ALA 23 CO -0.04 0.37 -0.15 1.49 0.00 0.00 0.00 179.25 180.92 3ab4 h GLU 24 N 1.11 0.97 -0.47 0.00 4.22 -0.68 -1.78 114.58 117.95 3ab4 h GLU 24 Ca 0.44 -0.38 0.00 0.00 0.08 0.00 0.00 59.36 59.51 3ab4 h GLU 24 Cb 0.25 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3ab4 h GLU 24 CO -0.20 1.05 0.30 0.00 -2.18 0.00 0.00 179.01 177.98 3ab4 h ARG 25 N 0.86 0.62 -0.01 1.92 3.08 -1.18 0.20 114.38 119.88 3ab4 h ARG 25 Ca 0.13 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.14 3ab4 h ARG 25 Cb 0.71 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 3ab4 h ARG 25 CO 0.05 0.44 -0.06 0.82 -1.07 0.00 0.00 179.97 180.15 3ab4 h ILE 26 N 0.63 0.84 -0.47 2.04 2.04 -1.08 0.31 117.51 121.82 3ab4 h ILE 26 Ca 0.17 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.97 3ab4 h ILE 26 Cb -0.04 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3ab4 h ILE 26 CO -0.03 0.00 0.04 0.58 0.00 0.00 0.00 178.15 178.73 3ab4 h VAL 27 N -0.10 1.23 -0.41 1.67 2.07 -1.21 -1.97 116.25 117.53 3ab4 h VAL 27 Ca 0.03 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 3ab4 h VAL 27 Cb 0.14 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3ab4 h VAL 27 CO -0.07 0.32 0.17 0.00 0.02 0.00 0.00 177.57 178.02 3ab4 h ALA 28 N 1.33 1.55 -0.41 1.67 0.00 -0.02 -1.35 119.26 122.04 3ab4 h ALA 28 Ca 0.15 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3ab4 h ALA 28 Cb 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3ab4 h ALA 28 CO 0.01 0.36 -0.18 1.15 0.00 0.00 0.00 179.25 180.59 3ab4 h THR 29 N 0.57 1.27 -0.17 0.00 2.02 -0.20 -2.64 112.91 113.76 3ab4 h THR 29 Ca 0.14 -1.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.01 3ab4 h THR 29 Cb 0.10 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 3ab4 h THR 29 CO -0.02 0.43 -0.05 0.50 0.37 0.00 0.00 175.52 176.75 3ab4 h LYS 30 N 0.69 0.33 -0.59 6.66 3.64 -0.99 -3.17 116.57 123.14 3ab4 h LYS 30 Ca 0.10 -0.13 0.10 0.00 -1.27 0.00 0.00 60.65 59.46 3ab4 h LYS 30 Cb 0.68 -0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 32.37 3ab4 h LYS 30 CO 0.05 0.61 -0.33 0.87 -2.27 0.00 0.00 179.45 178.38 3ab4 h LYS 31 N 0.04 -0.15 0.00 1.90 1.57 -1.19 -1.15 116.57 117.58 3ab4 h LYS 31 Ca 0.04 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3ab4 h LYS 31 Cb 0.49 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3ab4 h LYS 31 CO 0.02 -0.10 0.00 0.00 -0.57 0.00 0.00 179.45 178.80 3ab4 n ALA 32 N -3.14 1.25 -0.99 3.86 0.00 -1.00 -4.63 120.51 115.85 3ab4 n ALA 32 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3ab4 n ALA 32 Cb 0.35 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.97 3ab4 n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ab4 n GLY 33 N -0.73 0.74 3.21 0.00 0.00 -0.46 -4.94 105.19 103.02 3ab4 n GLY 33 Ca 0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 3ab4 n GLY 33 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ab4 s ASN 34 N -2.52 -0.35 -0.11 1.61 -0.87 -1.07 -2.04 114.94 109.59 3ab4 s ASN 34 Ca 0.00 0.67 -0.24 0.00 -1.57 0.00 0.00 52.86 51.72 3ab4 s ASN 34 Cb 0.00 0.67 -0.03 0.00 -0.02 0.00 0.00 41.25 41.87 3ab4 s ASN 34 CO 0.00 -0.12 0.72 -1.81 -2.57 0.00 0.00 177.10 173.32 3ab4 s ASP 35 N 0.29 6.95 -0.07 -1.22 -0.00 -0.09 -4.23 116.67 118.28 3ab4 s ASP 35 Ca -0.01 1.15 0.03 0.00 -0.00 0.00 0.00 52.55 53.71 3ab4 s ASP 35 Cb -0.03 -2.42 0.01 0.00 -0.00 0.00 0.00 42.92 40.49 3ab4 s ASP 35 CO -0.01 -0.20 -0.15 0.54 -0.00 0.00 0.00 175.17 175.36 3ab4 s VAL 36 N 1.25 1.32 0.02 -1.27 0.11 -1.26 -1.93 120.40 118.63 3ab4 s VAL 36 Ca 0.37 -0.59 0.03 0.00 -2.93 0.00 0.00 61.98 58.86 3ab4 s VAL 36 Cb -0.17 -1.19 -0.04 0.00 -1.53 0.00 0.00 36.38 33.45 3ab4 s VAL 36 CO 0.16 0.40 -0.05 0.68 -3.33 0.00 0.00 175.10 172.96 3ab4 s VAL 37 N 0.62 3.78 -0.02 2.04 -7.23 -1.14 -1.92 120.40 116.53 3ab4 s VAL 37 Ca -0.15 -0.78 0.02 0.00 -1.81 0.00 0.00 61.98 59.25 3ab4 s VAL 37 Cb -0.16 -2.68 0.01 0.00 0.56 0.00 0.00 36.38 34.11 3ab4 s VAL 37 CO 0.04 0.35 -0.05 0.54 -0.31 0.00 0.00 175.10 175.67 3ab4 s VAL 38 N -1.06 0.48 -0.23 1.32 0.11 0.12 -2.10 120.40 119.04 3ab4 s VAL 38 Ca 0.19 -0.20 -0.08 0.00 -2.93 0.00 0.00 61.98 58.96 3ab4 s VAL 38 Cb -0.11 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.26 3ab4 s VAL 38 CO 0.09 0.16 0.08 -0.69 -3.33 0.00 0.00 175.10 171.41 3ab4 s VAL 39 N 0.24 4.54 -0.03 2.04 1.01 -0.31 -0.59 120.40 127.30 3ab4 s VAL 39 Ca -0.03 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.87 3ab4 s VAL 39 Cb -0.07 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 3ab4 s VAL 39 CO -0.00 0.37 -0.06 0.00 0.00 0.00 0.00 175.10 175.41 3ab4 s SER 41 N -1.15 3.96 0.67 0.00 0.01 -0.52 -4.68 113.70 112.01 3ab4 s SER 41 Ca 0.15 -0.22 -0.11 0.00 1.31 0.00 0.00 55.95 57.08 3ab4 s SER 41 Cb -0.11 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.08 3ab4 s SER 41 CO 0.05 -2.13 1.05 0.00 0.41 0.00 0.00 173.24 172.62 3ab4 s ALA 42 N -3.36 2.79 0.28 1.44 0.00 -1.26 -4.74 121.76 116.91 3ab4 s ALA 42 Ca 0.69 0.06 -0.30 0.00 0.00 0.00 0.00 51.96 52.40 3ab4 s ALA 42 Cb -0.05 -3.15 -0.11 0.00 0.00 0.00 0.00 23.12 19.81 3ab4 s ALA 42 CO 0.47 -1.07 1.57 -1.64 0.00 0.00 0.00 175.76 175.08 3ab4 s MET 43 N -5.03 4.15 -0.27 0.00 1.00 -1.26 -3.63 119.30 114.26 3ab4 s MET 43 Ca 0.57 2.53 -0.06 0.00 0.00 0.00 0.00 55.69 58.73 3ab4 s MET 43 Cb -0.13 -3.04 -0.07 0.00 0.00 0.00 0.00 34.83 31.59 3ab4 s MET 43 CO 0.54 -0.60 0.67 0.41 0.00 0.00 0.00 175.02 176.04 3ab4 n GLY 44 N 2.18 -0.13 0.24 -0.03 0.00 0.17 -0.92 105.19 106.70 3ab4 n GLY 44 Ca 0.08 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.30 3ab4 n GLY 44 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ab4 n ASP 45 N 2.35 0.00 0.08 1.61 8.00 -1.26 -4.90 116.55 122.42 3ab4 n ASP 45 Ca 0.18 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.69 3ab4 n ASP 45 Cb 0.02 0.00 0.33 0.00 -0.02 0.00 0.00 41.12 41.45 3ab4 n ASP 45 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 3ab4 h THR 46 N 0.00 1.21 -0.16 -3.53 1.35 -1.32 0.55 112.91 111.00 3ab4 h THR 46 Ca 0.00 -0.91 -0.01 0.00 -0.55 0.00 0.00 66.41 64.94 3ab4 h THR 46 Cb 0.00 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 3ab4 h THR 46 CO 0.00 0.29 0.07 0.74 -0.25 0.00 0.00 175.52 176.37 3ab4 h THR 47 N 0.31 1.14 -0.12 6.82 2.02 -1.89 0.59 112.91 121.77 3ab4 h THR 47 Ca 0.06 -0.40 -0.16 0.00 0.77 0.00 0.00 66.41 66.68 3ab4 h THR 47 Cb 0.44 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3ab4 h THR 47 CO 0.03 0.13 -0.61 -2.24 0.37 0.00 0.00 175.52 173.19 3ab4 h ASP 48 N 0.13 0.48 -0.77 4.18 3.04 -1.91 -0.65 116.42 120.92 3ab4 h ASP 48 Ca 0.06 -0.28 0.03 0.00 -3.24 0.00 0.00 57.03 53.60 3ab4 h ASP 48 Cb 0.13 -0.14 -0.04 0.00 -1.04 0.00 0.00 39.33 38.24 3ab4 h ASP 48 CO -0.01 0.98 0.51 -0.33 -2.04 0.00 0.00 179.24 178.35 3ab4 h GLU 49 N 0.31 0.92 -0.05 4.15 5.08 -0.46 -1.38 114.58 123.16 3ab4 h GLU 49 Ca -0.01 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3ab4 h GLU 49 Cb 1.15 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 3ab4 h GLU 49 CO 0.11 0.61 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.62 3ab4 h LEU 50 N 0.95 0.11 -1.45 1.33 4.07 0.47 -3.05 115.31 117.73 3ab4 h LEU 50 Ca 0.31 -0.44 0.23 0.00 0.08 0.00 0.00 57.88 58.05 3ab4 h LEU 50 Cb 0.04 -0.03 -0.08 0.00 1.08 0.00 0.00 40.66 41.67 3ab4 h LEU 50 CO -0.09 0.53 0.63 -0.07 -1.08 0.00 0.00 178.44 178.36 3ab4 h LEU 51 N -0.31 0.43 -0.18 1.67 -0.00 -0.64 -0.10 115.31 116.18 3ab4 h LEU 51 Ca 0.01 0.06 -0.02 0.00 -0.00 0.00 0.00 57.88 57.93 3ab4 h LEU 51 Cb 0.49 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.13 3ab4 h LEU 51 CO 0.01 0.14 0.04 -0.08 -0.00 0.00 0.00 178.44 178.54 3ab4 h GLU 52 N 0.41 0.29 -0.11 1.13 4.81 -1.22 -1.41 114.58 118.47 3ab4 h GLU 52 Ca 0.52 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.71 3ab4 h GLU 52 Cb 1.31 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.63 3ab4 h GLU 52 CO -0.22 0.44 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.37 3ab4 h LEU 53 N 0.09 -0.20 -0.55 1.64 4.07 -1.00 0.17 115.31 119.53 3ab4 h LEU 53 Ca 0.05 0.05 0.03 0.00 0.08 0.00 0.00 57.88 58.09 3ab4 h LEU 53 Cb 0.29 0.11 -0.04 0.00 1.08 0.00 0.00 40.66 42.10 3ab4 h LEU 53 CO 0.00 -0.09 0.33 0.00 -1.08 0.00 0.00 178.44 177.60 3ab4 h ALA 54 N 1.05 0.72 -0.87 1.53 0.00 -1.02 -1.51 119.26 119.15 3ab4 h ALA 54 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3ab4 h ALA 54 Cb 0.16 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3ab4 h ALA 54 CO -0.15 0.03 0.47 0.00 0.00 0.00 0.00 179.25 179.60 3ab4 h ALA 55 N 1.26 1.11 -0.44 0.00 0.00 -0.99 0.23 119.26 120.43 3ab4 h ALA 55 Ca 0.23 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.08 3ab4 h ALA 55 Cb 0.05 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3ab4 h ALA 55 CO -0.11 0.62 0.30 0.00 0.00 0.00 0.00 179.25 180.06 3ab4 h ALA 56 N 1.26 2.06 0.00 0.00 0.00 0.37 -3.23 119.26 119.72 3ab4 h ALA 56 Ca 0.31 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.96 3ab4 h ALA 56 Cb 0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3ab4 h ALA 56 CO -0.05 -0.15 -1.98 0.28 0.00 0.00 0.00 179.25 177.35 3ab4 n VAL 57 N -4.47 0.93 -3.21 0.00 0.31 -0.93 -4.95 118.33 106.01 3ab4 n VAL 57 Ca 0.06 -0.60 -0.01 0.00 -0.01 0.00 0.00 64.34 63.79 3ab4 n VAL 57 Cb 0.31 -0.56 -0.03 0.00 -0.91 0.00 0.00 33.84 32.66 3ab4 n VAL 57 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3ab4 s ASN 58 N -4.72 -0.87 0.45 4.52 3.04 0.77 -5.12 114.94 113.01 3ab4 s ASN 58 Ca -0.07 0.26 -0.22 0.00 0.04 0.00 0.00 52.86 52.87 3ab4 s ASN 58 Cb 0.05 1.75 -0.09 0.00 -1.54 0.00 0.00 41.25 41.42 3ab4 s ASN 58 CO 0.60 -0.30 1.05 -2.16 -3.04 0.00 0.00 177.10 173.25 3ab4 s PRO 59 N 2.74 3.95 -0.84 0.43 0.04 -1.26 -3.78 135.00 136.29 3ab4 s PRO 59 Ca 0.13 1.46 -0.03 0.00 0.04 0.00 0.00 61.00 62.61 3ab4 s PRO 59 Cb -0.13 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.10 3ab4 s PRO 59 CO -0.24 -0.32 0.65 1.33 0.04 0.00 0.00 177.00 178.46 3ab4 n VAL 60 N -0.53 -5.53 -3.43 -0.36 0.24 -1.26 -4.99 118.33 102.47 3ab4 n VAL 60 Ca 0.07 -0.17 -0.34 0.00 -2.04 0.00 0.00 64.34 61.86 3ab4 n VAL 60 Cb 0.51 -4.20 -0.06 0.00 -1.47 0.00 0.00 33.84 28.62 3ab4 n VAL 60 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3ab4 s PRO 61 N -4.54 3.86 0.56 7.34 0.04 -1.25 -5.04 135.00 135.97 3ab4 s PRO 61 Ca 0.05 0.33 -0.18 0.00 0.04 0.00 0.00 61.00 61.25 3ab4 s PRO 61 Cb -0.02 -2.85 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 3ab4 s PRO 61 CO 0.85 0.44 0.47 -2.30 0.04 0.00 0.00 177.00 176.50 3ab4 n PRO 62 N 0.48 0.46 -0.01 0.56 -0.02 -1.26 -4.69 135.00 130.53 3ab4 n PRO 62 Ca -0.04 0.18 -0.10 0.00 -2.02 0.00 0.00 63.50 61.52 3ab4 n PRO 62 Cb 0.52 -1.64 -0.05 0.00 -0.02 0.00 0.00 33.50 32.32 3ab4 n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ab4 h ALA 63 N 0.22 0.11 -0.87 3.55 0.00 -1.99 -1.94 119.26 118.34 3ab4 h ALA 63 Ca -0.45 0.02 0.14 0.00 0.00 0.00 0.00 54.91 54.62 3ab4 h ALA 63 Cb 1.40 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 19.12 3ab4 h ALA 63 CO 0.47 -0.43 0.46 0.07 0.00 0.00 0.00 179.25 179.82 3ab4 h ARG 64 N 0.08 0.65 -0.11 0.00 -0.00 -1.99 -0.97 114.38 112.03 3ab4 h ARG 64 Ca 0.05 -0.04 -0.21 0.00 -0.00 0.00 0.00 59.98 59.78 3ab4 h ARG 64 Cb 0.04 -0.15 0.00 0.00 -0.00 0.00 0.00 29.97 29.86 3ab4 h ARG 64 CO -0.06 0.43 -0.77 0.93 -0.00 0.00 0.00 179.97 180.50 3ab4 h GLU 65 N 0.67 0.60 -0.49 0.08 4.39 -1.83 -2.15 114.58 115.85 3ab4 h GLU 65 Ca 0.47 -0.50 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 3ab4 h GLU 65 Cb 0.64 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 3ab4 h GLU 65 CO -0.35 1.12 -0.02 1.98 -1.16 0.00 0.00 179.01 180.59 3ab4 h MET 66 N 0.41 0.87 0.00 2.33 4.05 -0.44 -2.22 114.93 119.93 3ab4 h MET 66 Ca -0.05 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 59.09 3ab4 h MET 66 Cb 1.38 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 32.10 3ab4 h MET 66 CO 0.15 0.92 -0.63 -0.40 0.23 0.00 0.00 176.91 177.17 3ab4 n ASP 67 N -4.32 0.58 -0.15 1.39 5.68 -0.61 -1.73 116.55 117.40 3ab4 n ASP 67 Ca 0.01 -0.16 -0.03 0.00 -0.50 0.00 0.00 54.79 54.11 3ab4 n ASP 67 Cb 0.33 0.33 0.19 0.00 -1.14 0.00 0.00 41.12 40.83 3ab4 n ASP 67 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 3ab4 h MET 68 N 0.00 0.86 0.17 0.11 4.05 -1.31 -1.41 114.93 117.40 3ab4 h MET 68 Ca 0.00 -0.16 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 3ab4 h MET 68 Cb 0.61 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 3ab4 h MET 68 CO 0.00 0.74 -0.08 1.25 0.23 0.00 0.00 176.91 179.05 3ab4 h LEU 69 N 0.84 -0.19 -1.03 3.39 5.85 -1.10 -2.88 115.31 120.19 3ab4 h LEU 69 Ca 0.19 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 3ab4 h LEU 69 Cb 0.24 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3ab4 h LEU 69 CO -0.01 0.35 0.23 -0.07 -0.34 0.00 0.00 178.44 178.61 3ab4 h LEU 70 N -0.85 0.85 -0.40 2.25 3.38 -1.42 -2.45 115.31 116.67 3ab4 h LEU 70 Ca -0.02 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.83 3ab4 h LEU 70 Cb 0.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3ab4 h LEU 70 CO 0.04 0.78 0.25 0.74 0.09 0.00 0.00 178.44 180.34 3ab4 h THR 71 N 0.91 1.08 -0.48 0.22 2.02 -1.36 -2.51 112.91 112.79 3ab4 h THR 71 Ca 0.21 -0.18 0.06 0.00 0.77 0.00 0.00 66.41 67.27 3ab4 h THR 71 Cb 0.20 0.52 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 3ab4 h THR 71 CO -0.02 0.09 0.18 0.00 0.37 0.00 0.00 175.52 176.15 3ab4 h ALA 72 N 1.16 0.58 -0.74 6.16 0.00 -1.22 0.39 119.26 125.59 3ab4 h ALA 72 Ca 0.15 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3ab4 h ALA 72 Cb -0.04 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3ab4 h ALA 72 CO -0.04 -0.21 0.39 0.78 0.00 0.00 0.00 179.25 180.17 3ab4 h GLY 73 N 0.36 1.10 2.00 0.00 0.00 -1.34 -2.33 103.07 102.85 3ab4 h GLY 73 Ca 0.23 -0.49 -0.16 0.00 0.00 0.00 0.00 47.33 46.91 3ab4 h GLY 73 CO -0.22 0.47 -0.75 0.83 0.00 0.00 0.00 176.54 176.87 3ab4 h GLU 74 N 1.03 0.00 -0.42 4.80 5.08 -0.88 -2.99 114.58 121.19 3ab4 h GLU 74 Ca 0.26 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.58 3ab4 h GLU 74 Cb 0.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3ab4 h GLU 74 CO -0.04 0.75 0.09 -0.09 -1.00 0.00 0.00 179.01 178.72 3ab4 h ARG 75 N 0.00 0.63 0.23 2.33 9.65 0.22 -1.89 114.38 125.55 3ab4 h ARG 75 Ca -0.01 -0.12 0.01 0.00 -1.10 0.00 0.00 59.98 58.77 3ab4 h ARG 75 Cb 1.40 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 29.84 3ab4 h ARG 75 CO 0.10 0.59 -0.41 0.82 2.80 0.00 0.00 179.97 183.87 3ab4 h ILE 76 N 0.62 0.18 -0.04 1.20 1.08 -1.28 0.34 117.51 119.60 3ab4 h ILE 76 Ca 0.14 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.50 3ab4 h ILE 76 Cb 0.25 0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 34.17 3ab4 h ILE 76 CO -0.00 0.00 -0.48 0.77 -0.69 0.00 0.00 178.15 177.75 3ab4 h SER 77 N -0.71 0.11 0.17 1.72 4.64 -1.64 -2.34 113.55 115.49 3ab4 h SER 77 Ca -0.00 -0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.28 3ab4 h SER 77 Cb 0.70 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 3ab4 h SER 77 CO -0.17 0.57 -0.24 -1.13 -0.87 0.00 0.00 176.83 174.99 3ab4 h ASN 78 N 0.08 -0.66 -0.59 4.97 -0.00 -0.83 -0.42 115.58 118.12 3ab4 h ASN 78 Ca 0.00 0.07 0.01 0.00 -0.00 0.00 0.00 56.30 56.38 3ab4 h ASN 78 Cb 0.87 0.24 -0.03 0.00 -0.00 0.00 0.00 38.32 39.40 3ab4 h ASN 78 CO 0.07 -0.34 0.39 0.00 -0.00 0.00 0.00 177.43 177.55 3ab4 h ALA 79 N 0.25 0.76 -0.22 1.57 0.00 -0.13 -1.76 119.26 119.73 3ab4 h ALA 79 Ca 0.01 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3ab4 h ALA 79 Cb 0.47 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ab4 h ALA 79 CO -0.10 0.18 -0.32 -0.07 0.00 0.00 0.00 179.25 178.94 3ab4 h LEU 80 N 0.79 0.65 -0.56 0.00 3.38 -1.24 -0.84 115.31 117.50 3ab4 h LEU 80 Ca 0.22 -0.52 0.07 0.00 0.09 0.00 0.00 57.88 57.74 3ab4 h LEU 80 Cb -0.08 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.43 3ab4 h LEU 80 CO -0.05 1.04 0.25 0.58 0.09 0.00 0.00 178.44 180.35 3ab4 h VAL 81 N 0.29 0.87 -0.69 1.22 2.07 -1.05 0.09 116.25 119.04 3ab4 h VAL 81 Ca 0.02 -0.16 0.08 0.00 0.82 0.00 0.00 66.70 67.47 3ab4 h VAL 81 Cb 0.90 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 30.97 3ab4 h VAL 81 CO 0.07 0.08 0.35 0.00 0.02 0.00 0.00 177.57 178.10 3ab4 h ALA 82 N 1.34 0.95 -0.72 1.67 0.00 -0.97 0.23 119.26 121.75 3ab4 h ALA 82 Ca 0.26 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 3ab4 h ALA 82 Cb 0.24 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3ab4 h ALA 82 CO -0.22 -0.03 0.41 0.52 0.00 0.00 0.00 179.25 179.93 3ab4 h MET 83 N 0.62 0.99 0.23 0.00 2.07 -0.08 -2.13 114.93 116.63 3ab4 h MET 83 Ca 0.33 -0.10 -0.01 0.00 -2.07 0.00 0.00 59.70 57.85 3ab4 h MET 83 Cb 0.32 -0.20 0.00 0.00 -1.87 0.00 0.00 31.60 29.85 3ab4 h MET 83 CO -0.25 0.73 -0.11 0.00 1.07 0.00 0.00 176.91 178.35 3ab4 h ALA 84 N 1.21 -0.31 -0.88 6.32 0.00 0.00 -1.17 119.26 124.43 3ab4 h ALA 84 Ca 0.26 -0.18 0.24 0.00 0.00 0.00 0.00 54.91 55.22 3ab4 h ALA 84 Cb 0.00 0.12 -0.15 0.00 0.00 0.00 0.00 17.79 17.77 3ab4 h ALA 84 CO -0.04 -0.51 0.19 0.82 0.00 0.00 0.00 179.25 179.71 3ab4 h ILE 85 N -0.64 0.27 -0.56 0.00 1.08 -1.00 0.06 117.51 116.72 3ab4 h ILE 85 Ca -0.03 -0.06 -0.08 0.00 -0.39 0.00 0.00 64.86 64.31 3ab4 h ILE 85 Cb 0.46 0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.28 3ab4 h ILE 85 CO 0.05 0.03 0.06 -0.33 -0.69 0.00 0.00 178.15 177.27 3ab4 h GLU 86 N 0.16 0.95 -0.28 2.37 5.08 -1.03 -1.93 114.58 119.90 3ab4 h GLU 86 Ca 0.55 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.56 3ab4 h GLU 86 Cb 1.11 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 3ab4 h GLU 86 CO -0.69 0.93 -0.15 0.66 -1.00 0.00 0.00 179.01 178.75 3ab4 h SER 87 N 0.84 0.47 -0.14 1.42 4.64 0.19 -1.67 113.55 119.31 3ab4 h SER 87 Ca 0.17 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3ab4 h SER 87 Cb 0.46 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3ab4 h SER 87 CO 0.02 0.65 0.00 0.18 -0.87 0.00 0.00 176.83 176.81 3ab4 n LEU 88 N -4.18 0.82 0.00 5.97 7.99 -0.17 -4.93 117.00 122.50 3ab4 n LEU 88 Ca 0.00 -0.40 0.00 0.00 -0.01 0.00 0.00 56.01 55.61 3ab4 n LEU 88 Cb 0.34 -0.09 0.00 0.00 -0.11 0.00 0.00 43.42 43.56 3ab4 n LEU 88 CO 0.41 0.20 0.00 0.61 -1.51 0.00 0.00 177.39 177.09 3ab4 n GLY 89 N 0.79 2.48 3.78 -0.72 0.00 -0.63 -5.04 105.19 105.86 3ab4 n GLY 89 Ca 0.07 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 3ab4 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ab4 s ALA 90 N -2.10 2.61 -0.10 4.61 0.00 -0.78 -4.93 121.76 121.08 3ab4 s ALA 90 Ca 0.00 0.51 -0.18 0.00 0.00 0.00 0.00 51.96 52.29 3ab4 s ALA 90 Cb 0.00 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 3ab4 s ALA 90 CO 0.00 -1.02 0.50 -1.21 0.00 0.00 0.00 175.76 174.03 3ab4 s GLU 91 N -3.99 4.32 0.06 0.00 2.02 -1.26 -3.70 118.70 116.15 3ab4 s GLU 91 Ca 0.66 0.50 0.04 0.00 0.02 0.00 0.00 54.97 56.19 3ab4 s GLU 91 Cb -0.19 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.59 3ab4 s GLU 91 CO 0.38 0.20 -0.03 0.00 0.02 0.00 0.00 175.26 175.83 3ab4 s ALA 92 N 0.45 3.19 -0.09 5.21 0.00 -1.26 -0.29 121.76 128.98 3ab4 s ALA 92 Ca 0.27 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 51.13 3ab4 s ALA 92 Cb -0.16 -1.16 0.03 0.00 0.00 0.00 0.00 23.12 21.83 3ab4 s ALA 92 CO 0.12 0.67 -0.04 -1.14 0.00 0.00 0.00 175.76 175.36 3ab4 s GLN 93 N -2.01 1.09 -0.09 0.00 2.00 -0.54 -4.89 119.66 115.21 3ab4 s GLN 93 Ca 0.22 -0.10 -0.10 0.00 -2.00 0.00 0.00 55.36 53.39 3ab4 s GLN 93 Cb -0.11 -1.25 -0.05 0.00 0.80 0.00 0.00 33.01 32.40 3ab4 s GLN 93 CO 0.14 -0.25 0.22 -1.12 -0.50 0.00 0.00 175.29 173.79 3ab4 s SER 94 N 1.68 6.50 -0.20 6.67 0.01 -1.26 -0.26 113.70 126.85 3ab4 s SER 94 Ca 0.02 0.60 -0.01 0.00 1.31 0.00 0.00 55.95 57.87 3ab4 s SER 94 Cb -0.13 -2.13 0.06 0.00 0.21 0.00 0.00 66.02 64.03 3ab4 s SER 94 CO -0.06 0.36 -0.01 -0.36 0.41 0.00 0.00 173.24 173.58 3ab4 s PHE 95 N -0.88 1.56 -0.28 2.43 0.08 0.40 -4.93 117.98 116.36 3ab4 s PHE 95 Ca 0.17 -1.17 0.21 0.00 0.12 0.00 0.00 56.93 56.26 3ab4 s PHE 95 Cb -0.13 -1.24 0.49 0.00 -0.57 0.00 0.00 43.02 41.57 3ab4 s PHE 95 CO 0.06 -0.66 1.14 0.25 -0.10 0.00 0.00 175.22 175.91 3ab4 n THR 96 N 4.90 1.11 -0.03 0.64 -2.24 -1.26 -2.86 114.28 114.54 3ab4 n THR 96 Ca -0.10 -2.74 -0.07 0.00 -2.27 0.00 0.00 64.05 58.87 3ab4 n THR 96 Cb 0.46 1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 69.88 3ab4 n THR 96 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3ab4 n PRO 118 N -0.63 0.23 0.18 -0.78 -0.04 -1.26 -4.90 135.00 127.80 3ab4 n PRO 118 Ca 0.05 0.10 0.05 0.00 -0.04 0.00 0.00 63.50 63.65 3ab4 n PRO 118 Cb 0.81 -0.90 0.48 0.00 -0.04 0.00 0.00 33.50 33.85 3ab4 n PRO 118 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3ab4 h GLY 119 N -0.42 0.12 1.23 0.55 0.00 -1.99 -1.69 103.07 100.87 3ab4 h GLY 119 Ca -0.11 -0.07 -0.19 0.00 0.00 0.00 0.00 47.33 46.96 3ab4 h GLY 119 CO -0.07 0.06 -0.63 3.21 0.00 0.00 0.00 176.54 179.12 3ab4 h ARG 120 N 0.11 0.79 0.04 4.80 -0.00 -2.06 -1.93 114.38 116.13 3ab4 h ARG 120 Ca 0.02 -0.55 -0.00 0.00 -0.50 0.00 0.00 59.98 58.95 3ab4 h ARG 120 Cb 0.26 0.08 0.00 0.00 0.00 0.00 0.00 29.97 30.32 3ab4 h ARG 120 CO 0.02 1.17 -0.02 0.28 0.00 0.00 0.00 179.97 181.42 3ab4 h VAL 121 N 0.58 1.09 -0.60 2.04 2.07 -1.96 -2.53 116.25 116.95 3ab4 h VAL 121 Ca -0.01 -0.44 0.09 0.00 0.82 0.00 0.00 66.70 67.16 3ab4 h VAL 121 Cb 1.23 1.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.32 3ab4 h VAL 121 CO 0.13 0.11 0.23 -0.09 0.02 0.00 0.00 177.57 177.98 3ab4 h ARG 122 N -0.25 0.41 -0.93 1.57 9.65 -1.27 0.60 114.38 124.16 3ab4 h ARG 122 Ca -0.01 -0.02 0.11 0.00 -1.10 0.00 0.00 59.98 58.96 3ab4 h ARG 122 Cb 0.22 -0.09 -0.07 0.00 -1.39 0.00 0.00 29.97 28.64 3ab4 h ARG 122 CO 0.01 0.27 0.60 0.93 2.80 0.00 0.00 179.97 184.58 3ab4 h GLU 123 N 0.42 0.87 -0.17 0.20 5.08 -1.26 -0.49 114.58 119.24 3ab4 h GLU 123 Ca 0.30 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.49 3ab4 h GLU 123 Cb 0.35 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3ab4 h GLU 123 CO -0.29 0.58 -0.36 0.00 -1.00 0.00 0.00 179.01 177.94 3ab4 h ALA 124 N 1.55 0.27 -0.09 3.43 0.00 -0.60 -3.27 119.26 120.56 3ab4 h ALA 124 Ca 0.45 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3ab4 h ALA 124 Cb 0.48 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3ab4 h ALA 124 CO -0.21 0.34 -0.22 -0.07 0.00 0.00 0.00 179.25 179.10 3ab4 h LEU 125 N 0.19 0.15 -1.83 0.00 3.38 -0.30 -2.55 115.31 114.35 3ab4 h LEU 125 Ca 0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 3ab4 h LEU 125 Cb 0.96 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 3ab4 h LEU 125 CO 0.08 0.37 -0.14 0.44 0.09 0.00 0.00 178.44 179.28 3ab4 h ASP 126 N 0.14 0.00 -4.07 -0.43 3.32 -1.16 -3.38 116.42 110.85 3ab4 h ASP 126 Ca 0.03 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.61 3ab4 h ASP 126 Cb 0.47 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.10 3ab4 h ASP 126 CO 0.03 0.14 0.29 -1.61 -1.72 0.00 0.00 179.24 176.38 3ab4 s GLU 127 N -4.31 2.34 0.00 3.56 2.02 -0.96 -4.96 118.70 116.39 3ab4 s GLU 127 Ca -0.03 -0.02 0.00 0.00 0.02 0.00 0.00 54.97 54.94 3ab4 s GLU 127 Cb 0.14 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.26 3ab4 s GLU 127 CO 0.62 -1.22 1.31 0.41 0.02 0.00 0.00 175.26 176.40 3ab4 n GLY 128 N -2.98 1.88 3.70 -1.39 0.00 -1.26 -4.87 105.19 100.26 3ab4 n GLY 128 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 3ab4 n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ab4 s LYS 129 N 0.43 4.26 -0.24 1.61 1.02 -1.21 -4.36 119.74 121.25 3ab4 s LYS 129 Ca 0.00 0.30 -0.29 0.00 0.02 0.00 0.00 55.97 56.00 3ab4 s LYS 129 Cb 0.00 -3.48 0.01 0.00 -0.52 0.00 0.00 37.83 33.84 3ab4 s LYS 129 CO 0.00 0.08 1.07 0.42 -0.92 0.00 0.00 175.35 176.00 3ab4 s ILE 130 N 0.92 4.60 -0.00 2.17 1.01 0.61 -4.25 121.20 126.26 3ab4 s ILE 130 Ca 0.22 1.92 -0.16 0.00 0.00 0.00 0.00 60.65 62.63 3ab4 s ILE 130 Cb -0.15 -4.30 -0.06 0.00 0.01 0.00 0.00 42.46 37.96 3ab4 s ILE 130 CO 0.08 -0.24 0.45 0.00 0.00 0.00 0.00 174.94 175.23 3ab4 s ILE 132 N -0.83 1.21 0.08 0.00 1.01 0.65 0.11 121.20 123.42 3ab4 s ILE 132 Ca 0.25 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.54 3ab4 s ILE 132 Cb -0.17 -1.19 -0.03 0.00 0.01 0.00 0.00 42.46 41.09 3ab4 s ILE 132 CO 0.14 0.40 -0.14 0.54 0.00 0.00 0.00 174.94 175.88 3ab4 s VAL 133 N 1.56 1.11 -0.00 2.92 0.11 0.25 -0.45 120.40 125.89 3ab4 s VAL 133 Ca 0.04 -1.35 -0.12 0.00 -2.93 0.00 0.00 61.98 57.61 3ab4 s VAL 133 Cb -0.13 -1.11 -0.07 0.00 -1.53 0.00 0.00 36.38 33.54 3ab4 s VAL 133 CO -0.08 -0.26 0.76 0.00 -3.33 0.00 0.00 175.10 172.19 3ab4 h ALA 134 N 4.20 -0.69 -0.36 1.54 0.00 -1.81 -2.98 119.26 119.15 3ab4 h ALA 134 Ca -0.41 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3ab4 h ALA 134 Cb 1.19 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3ab4 h ALA 134 CO 0.41 -0.66 0.00 0.41 0.00 0.00 0.00 179.25 179.41 3ab4 n GLY 135 N 0.00 -0.73 2.01 0.00 0.00 -1.26 -4.24 105.19 100.97 3ab4 n GLY 135 Ca -0.06 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.81 3ab4 n GLY 135 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ab4 n SER 154 N -0.98 -0.26 -0.00 1.61 2.88 -1.26 -5.03 113.62 110.58 3ab4 n SER 154 Ca 0.00 0.20 -0.12 0.00 -1.33 0.00 0.00 58.87 57.62 3ab4 n SER 154 Cb 0.00 0.35 -0.07 0.00 -0.75 0.00 0.00 64.21 63.75 3ab4 n SER 154 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3ab4 h ASP 155 N 0.00 0.09 0.43 -3.46 3.45 -1.98 -1.66 116.42 113.30 3ab4 h ASP 155 Ca 0.00 -0.18 -0.04 0.00 0.43 0.00 0.00 57.03 57.24 3ab4 h ASP 155 Cb 0.00 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 38.74 3ab4 h ASP 155 CO 0.00 0.25 -0.19 0.71 -1.57 0.00 0.00 179.24 178.44 3ab4 h THR 156 N -0.07 0.74 0.20 0.35 1.35 -1.91 -0.97 112.91 112.59 3ab4 h THR 156 Ca 0.02 -0.77 -0.33 0.00 -0.55 0.00 0.00 66.41 64.79 3ab4 h THR 156 Cb 0.19 1.47 0.02 0.00 -1.73 0.00 0.00 68.15 68.10 3ab4 h THR 156 CO -0.00 0.18 -1.54 0.71 -0.25 0.00 0.00 175.52 174.62 3ab4 h THR 157 N 0.00 1.18 -0.21 6.82 1.35 -1.98 -2.02 112.91 118.05 3ab4 h THR 157 Ca -0.00 -2.71 0.05 0.00 -0.55 0.00 0.00 66.41 63.20 3ab4 h THR 157 Cb 0.45 2.90 -0.06 0.00 -1.73 0.00 0.00 68.15 69.72 3ab4 h THR 157 CO 0.02 0.84 -0.16 0.00 -0.25 0.00 0.00 175.52 175.97 3ab4 h ALA 158 N 0.26 -0.01 0.00 6.62 0.00 -0.61 -1.78 119.26 123.74 3ab4 h ALA 158 Ca -0.27 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 3ab4 h ALA 158 Cb 2.10 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 20.23 3ab4 h ALA 158 CO 0.22 -0.58 -0.41 0.28 0.00 0.00 0.00 179.25 178.76 3ab4 h VAL 159 N -0.16 1.28 -0.07 0.00 2.07 -1.27 -2.01 116.25 116.08 3ab4 h VAL 159 Ca 0.12 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.24 3ab4 h VAL 159 Cb 0.35 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 3ab4 h VAL 159 CO -0.31 0.40 0.04 0.00 0.02 0.00 0.00 177.57 177.71 3ab4 h ALA 160 N 1.59 0.10 -0.82 1.67 0.00 -0.88 -1.94 119.26 118.99 3ab4 h ALA 160 Ca -0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3ab4 h ALA 160 Cb 0.72 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 3ab4 h ALA 160 CO 0.05 -0.35 0.42 -0.07 0.00 0.00 0.00 179.25 179.31 3ab4 h LEU 161 N 0.00 1.05 -1.74 0.00 4.07 -1.10 -0.44 115.31 117.15 3ab4 h LEU 161 Ca 0.03 -0.12 -0.03 0.00 0.08 0.00 0.00 57.88 57.84 3ab4 h LEU 161 Cb 0.11 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.58 3ab4 h LEU 161 CO -0.00 0.87 -0.13 0.00 -1.08 0.00 0.00 178.44 178.10 3ab4 h ALA 162 N 1.22 1.78 0.00 1.53 0.00 -1.19 -0.66 119.26 121.94 3ab4 h ALA 162 Ca 0.28 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3ab4 h ALA 162 Cb 0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3ab4 h ALA 162 CO -0.04 0.16 -0.03 0.00 0.00 0.00 0.00 179.25 179.34 3ab4 h ALA 163 N 1.87 0.01 -0.72 0.00 0.00 -0.84 0.44 119.26 120.02 3ab4 h ALA 163 Ca -0.00 -0.51 0.14 0.00 0.00 0.00 0.00 54.91 54.54 3ab4 h ALA 163 Cb 0.23 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.94 3ab4 h ALA 163 CO 0.02 0.02 0.24 0.00 0.00 0.00 0.00 179.25 179.53 3ab4 h ALA 164 N -0.03 0.97 -0.00 0.00 0.00 -1.02 -1.82 119.26 117.34 3ab4 h ALA 164 Ca -0.01 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ab4 h ALA 164 Cb 0.98 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3ab4 h ALA 164 CO -0.00 -0.26 -0.12 1.28 0.00 0.00 0.00 179.25 180.15 3ab4 n LEU 165 N -5.06 0.59 -3.57 0.00 4.77 -0.26 -4.94 117.00 108.53 3ab4 n LEU 165 Ca 0.13 -0.06 -0.22 0.00 -0.03 0.00 0.00 56.01 55.83 3ab4 n LEU 165 Cb 0.40 -0.16 0.08 0.00 -2.33 0.00 0.00 43.42 41.42 3ab4 n LEU 165 CO 0.17 0.11 0.20 -0.46 -1.33 0.00 0.00 177.39 176.08 3ab4 n ASN 166 N -0.84 -5.16 -4.63 -1.43 0.23 -0.69 -4.97 115.26 97.77 3ab4 n ASN 166 Ca 0.15 -0.57 -0.30 0.00 -0.53 0.00 0.00 54.58 53.33 3ab4 n ASN 166 Cb 0.28 -5.00 0.19 0.00 -2.08 0.00 0.00 39.78 33.17 3ab4 n ASN 166 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ab4 s ALA 167 N -3.33 0.87 0.01 -2.53 0.00 0.15 -4.98 121.76 111.95 3ab4 s ALA 167 Ca 0.43 0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3ab4 s ALA 167 Cb -0.19 -3.32 -0.25 0.00 0.00 0.00 0.00 23.12 19.36 3ab4 s ALA 167 CO 0.74 -3.00 0.89 -0.44 0.00 0.00 0.00 175.76 173.94 3ab4 h ASP 168 N -2.03 0.19 -3.27 0.00 5.19 -0.97 -3.47 116.42 112.06 3ab4 h ASP 168 Ca -0.51 -0.28 0.03 0.00 -0.62 0.00 0.00 57.03 55.65 3ab4 h ASP 168 Cb 1.29 -0.06 -0.23 0.00 0.18 0.00 0.00 39.33 40.51 3ab4 h ASP 168 CO 0.48 1.24 0.22 0.54 -3.12 0.00 0.00 179.24 178.59 3ab4 s VAL 169 N -2.63 0.00 -0.30 -1.35 0.11 -1.24 -4.31 120.40 110.68 3ab4 s VAL 169 Ca -0.06 0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 58.89 3ab4 s VAL 169 Cb 0.08 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.91 3ab4 s VAL 169 CO 0.83 0.00 0.16 0.00 -3.33 0.00 0.00 175.10 172.76 3ab4 s GLU 171 N 1.64 4.14 -0.42 0.00 2.02 0.26 -2.07 118.70 124.26 3ab4 s GLU 171 Ca 0.05 -0.15 -0.12 0.00 0.02 0.00 0.00 54.97 54.78 3ab4 s GLU 171 Cb -0.17 -3.50 0.06 0.00 0.10 0.00 0.00 34.13 30.62 3ab4 s GLU 171 CO 0.07 0.12 0.29 0.42 0.02 0.00 0.00 175.26 176.18 3ab4 s ILE 172 N 0.87 4.71 -0.11 -1.63 1.09 0.84 -0.69 121.20 126.28 3ab4 s ILE 172 Ca 0.10 -1.11 -0.17 0.00 -1.10 0.00 0.00 60.65 58.37 3ab4 s ILE 172 Cb -0.13 -3.78 -0.04 0.00 -1.06 0.00 0.00 42.46 37.45 3ab4 s ILE 172 CO 0.03 -0.45 0.45 -0.31 -0.10 0.00 0.00 174.94 174.56 3ab4 s TYR 173 N 1.54 3.53 0.00 3.97 2.02 0.12 -1.66 117.35 126.88 3ab4 s TYR 173 Ca 0.03 0.87 0.00 0.00 -0.37 0.00 0.00 57.07 57.60 3ab4 s TYR 173 Cb -0.22 -2.50 0.00 0.00 -0.40 0.00 0.00 41.96 38.84 3ab4 s TYR 173 CO 0.05 0.23 0.00 -1.13 -1.57 0.00 0.00 175.55 173.13 3ab4 n SER 174 N 3.44 1.41 0.00 2.29 3.41 -0.70 -3.71 113.62 119.76 3ab4 n SER 174 Ca -0.08 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.63 3ab4 n SER 174 Cb 0.52 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.36 3ab4 n SER 174 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3ab4 n ASP 175 N 0.00 0.50 -4.71 4.04 3.85 -1.26 -0.62 116.55 118.35 3ab4 n ASP 175 Ca 0.00 -0.40 -0.41 0.00 -0.71 0.00 0.00 54.79 53.27 3ab4 n ASP 175 Cb 0.00 1.37 -0.04 0.00 -1.35 0.00 0.00 41.12 41.10 3ab4 n ASP 175 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3ab4 s VAL 176 N -3.26 4.97 -2.07 2.12 0.11 -1.26 -4.84 120.40 116.17 3ab4 s VAL 176 Ca 0.00 1.64 0.28 0.00 -2.93 0.00 0.00 61.98 60.97 3ab4 s VAL 176 Cb 0.15 -4.13 0.48 0.00 -1.53 0.00 0.00 36.38 31.34 3ab4 s VAL 176 CO 0.87 0.19 1.75 -0.90 -3.33 0.00 0.00 175.10 173.69 3ab4 n ASP 177 N 4.02 1.04 0.00 3.54 5.75 -1.26 -3.19 116.55 126.45 3ab4 n ASP 177 Ca 0.02 -1.10 0.00 0.00 -0.01 0.00 0.00 54.79 53.70 3ab4 n ASP 177 Cb 0.51 0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 3ab4 n ASP 177 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ab4 n GLY 178 N 1.23 -1.22 3.53 6.12 0.00 -1.26 -4.03 105.19 109.56 3ab4 n GLY 178 Ca 0.16 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 3ab4 n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ab4 s VAL 179 N -2.78 4.01 0.34 1.61 0.11 -1.26 -4.97 120.40 117.46 3ab4 s VAL 179 Ca 0.00 -0.32 0.08 0.00 -2.93 0.00 0.00 61.98 58.80 3ab4 s VAL 179 Cb 0.00 -2.75 -0.03 0.00 -1.53 0.00 0.00 36.38 32.07 3ab4 s VAL 179 CO 0.00 0.51 0.26 -0.31 -3.33 0.00 0.00 175.10 172.22 3ab4 s TYR 180 N 0.17 2.84 0.25 1.54 2.02 -1.26 -1.77 117.35 121.13 3ab4 s TYR 180 Ca -0.01 -0.33 0.27 0.00 -0.37 0.00 0.00 57.07 56.63 3ab4 s TYR 180 Cb -0.14 -1.77 1.23 0.00 -0.40 0.00 0.00 41.96 40.88 3ab4 s TYR 180 CO 0.03 0.21 1.95 1.79 -1.57 0.00 0.00 175.55 177.96 3ab4 h THR 181 N 1.32 0.47 -2.96 -0.71 1.35 -1.62 -3.45 112.91 107.30 3ab4 h THR 181 Ca -0.44 -0.80 -0.06 0.00 -0.55 0.00 0.00 66.41 64.56 3ab4 h THR 181 Cb 1.25 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 69.23 3ab4 h THR 181 CO 0.60 0.15 0.17 0.00 -0.25 0.00 0.00 175.52 176.18 3ab4 n ALA 182 N -2.22 -1.25 -2.15 6.62 0.00 -1.26 0.68 120.51 120.93 3ab4 n ALA 182 Ca -0.01 -1.09 -0.43 0.00 0.00 0.00 0.00 53.44 51.92 3ab4 n ALA 182 Cb 0.33 0.87 -0.03 0.00 0.00 0.00 0.00 19.45 20.63 3ab4 n ALA 182 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3ab4 s ASP 183 N -2.71 6.64 0.52 0.00 3.68 -1.26 -4.85 116.67 118.69 3ab4 s ASP 183 Ca 0.15 1.89 0.21 0.00 2.13 0.00 0.00 52.55 56.93 3ab4 s ASP 183 Cb -0.03 -2.53 1.38 0.00 -1.45 0.00 0.00 42.92 40.28 3ab4 s ASP 183 CO 0.11 -0.99 2.13 -0.65 0.13 0.00 0.00 175.17 175.89 3ab4 h PRO 184 N 9.58 0.00 -0.42 4.34 0.11 -1.91 0.87 132.00 144.57 3ab4 h PRO 184 Ca -0.34 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.73 3ab4 h PRO 184 Cb 1.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3ab4 h PRO 184 CO 0.97 0.06 0.09 0.00 -0.21 0.00 0.00 178.00 178.92 3ab4 h ARG 185 N 0.00 0.68 0.00 1.05 -0.00 -1.92 -3.30 114.38 110.89 3ab4 h ARG 185 Ca -0.00 -0.17 -0.01 0.00 -0.50 0.00 0.00 59.98 59.30 3ab4 h ARG 185 Cb 0.13 -0.09 -0.00 0.00 0.00 0.00 0.00 29.97 30.01 3ab4 h ARG 185 CO 0.01 0.70 -0.07 0.82 0.00 0.00 0.00 179.97 181.43 3ab4 h ILE 186 N 0.55 0.38 -3.56 2.04 1.08 -1.73 -3.44 117.51 112.84 3ab4 h ILE 186 Ca 0.13 -1.29 -0.71 0.00 -0.39 0.00 0.00 64.86 62.60 3ab4 h ILE 186 Cb 0.33 0.73 -0.20 0.00 -3.07 0.00 0.00 36.82 34.61 3ab4 h ILE 186 CO 0.00 0.13 -0.41 -0.69 -0.69 0.00 0.00 178.15 176.49 3ab4 s VAL 187 N -1.75 5.24 0.04 1.67 1.01 0.29 -4.97 120.40 121.94 3ab4 s VAL 187 Ca -0.06 -0.50 -0.20 0.00 0.00 0.00 0.00 61.98 61.23 3ab4 s VAL 187 Cb -0.00 -3.89 -0.14 0.00 0.00 0.00 0.00 36.38 32.34 3ab4 s VAL 187 CO 0.17 -0.25 1.35 1.55 0.00 0.00 0.00 175.10 177.91 3ab4 h PRO 188 N 8.60 0.38 -0.93 2.72 0.13 -1.81 -3.02 132.00 138.07 3ab4 h PRO 188 Ca -0.28 -0.20 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 3ab4 h PRO 188 Cb 1.13 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 3ab4 h PRO 188 CO 0.72 0.76 0.02 0.27 -0.23 0.00 0.00 178.00 179.53 3ab4 n ASN 189 N -4.54 2.06 -4.76 1.44 2.04 -1.26 -4.90 115.26 105.34 3ab4 n ASN 189 Ca -0.06 -2.19 -0.41 0.00 -0.44 0.00 0.00 54.58 51.47 3ab4 n ASN 189 Cb 0.37 -0.54 -0.01 0.00 -2.53 0.00 0.00 39.78 37.07 3ab4 n ASN 189 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3ab4 n ALA 190 N 0.13 2.54 -2.76 -2.53 0.00 -1.14 -5.00 120.51 111.74 3ab4 n ALA 190 Ca 0.06 0.36 -0.25 0.00 0.00 0.00 0.00 53.44 53.61 3ab4 n ALA 190 Cb 0.47 -2.46 -0.06 0.00 0.00 0.00 0.00 19.45 17.40 3ab4 n ALA 190 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3ab4 s GLN 191 N -1.12 2.75 -0.34 0.00 -1.52 -1.26 -4.87 119.66 113.30 3ab4 s GLN 191 Ca 0.60 -0.99 -0.27 0.00 -1.95 0.00 0.00 55.36 52.75 3ab4 s GLN 191 Cb -0.48 -2.54 0.01 0.00 -0.22 0.00 0.00 33.01 29.79 3ab4 s GLN 191 CO 0.54 0.46 0.97 0.21 -0.25 0.00 0.00 175.29 177.22 3ab4 s LYS 192 N -3.24 3.95 0.29 2.91 2.20 -1.26 -1.84 119.74 122.75 3ab4 s LYS 192 Ca 0.30 0.78 -0.29 0.00 -0.36 0.00 0.00 55.97 56.40 3ab4 s LYS 192 Cb -0.09 -3.77 -0.10 0.00 -1.51 0.00 0.00 37.83 32.36 3ab4 s LYS 192 CO 0.22 -0.90 1.45 -0.51 -0.36 0.00 0.00 175.35 175.25 3ab4 s LEU 193 N 3.49 4.38 -0.07 5.43 1.02 -0.73 -4.93 118.68 127.27 3ab4 s LEU 193 Ca 0.40 2.77 -0.26 0.00 0.02 0.00 0.00 54.13 57.07 3ab4 s LEU 193 Cb -0.12 -3.64 -0.24 0.00 0.02 0.00 0.00 46.19 42.21 3ab4 s LEU 193 CO 0.17 -0.73 0.99 -0.08 0.02 0.00 0.00 176.35 176.72 3ab4 h GLU 194 N 4.44 0.12 -3.05 1.70 4.57 -1.89 -3.40 114.58 117.06 3ab4 h GLU 194 Ca -0.47 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 57.57 3ab4 h GLU 194 Cb 1.22 0.04 -0.11 0.00 -0.16 0.00 0.00 28.75 29.74 3ab4 h GLU 194 CO 0.74 0.90 0.18 -1.59 -1.18 0.00 0.00 179.01 178.06 3ab4 s LYS 195 N -3.01 1.35 0.13 1.92 -2.85 -1.26 -2.07 119.74 113.95 3ab4 s LYS 195 Ca -0.17 -0.60 -0.06 0.00 -1.00 0.00 0.00 55.97 54.14 3ab4 s LYS 195 Cb 0.00 0.58 -0.02 0.00 -2.06 0.00 0.00 37.83 36.33 3ab4 s LYS 195 CO 0.72 -0.59 0.17 -0.48 0.10 0.00 0.00 175.35 175.28 3ab4 s LEU 196 N -2.79 1.40 0.72 2.77 0.05 -1.06 -5.00 118.68 114.77 3ab4 s LEU 196 Ca 0.03 -0.95 -0.11 0.00 0.05 0.00 0.00 54.13 53.16 3ab4 s LEU 196 Cb -0.02 0.82 0.02 0.00 -2.05 0.00 0.00 46.19 44.96 3ab4 s LEU 196 CO -0.09 -0.79 1.07 -0.94 -0.55 0.00 0.00 176.35 175.05 3ab4 s SER 197 N -2.97 5.19 0.21 1.48 1.04 -1.26 -2.78 113.70 114.61 3ab4 s SER 197 Ca 0.16 1.54 -0.09 0.00 0.48 0.00 0.00 55.95 58.05 3ab4 s SER 197 Cb 0.05 -2.39 0.31 0.00 0.10 0.00 0.00 66.02 64.09 3ab4 s SER 197 CO -0.02 -1.56 1.74 -0.26 0.98 0.00 0.00 173.24 174.12 3ab4 h PHE 198 N -0.80 0.38 0.00 5.02 0.04 -1.31 -2.25 116.94 118.03 3ab4 h PHE 198 Ca -0.45 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.27 3ab4 h PHE 198 Cb 1.22 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 39.29 3ab4 h PHE 198 CO 0.58 0.07 -0.40 1.05 -0.60 0.00 0.00 178.31 179.02 3ab4 h GLU 199 N 0.39 0.00 -0.63 1.51 9.09 -1.93 -0.43 114.58 122.58 3ab4 h GLU 199 Ca 0.33 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.67 3ab4 h GLU 199 Cb 0.43 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.51 3ab4 h GLU 199 CO -0.34 0.40 0.12 0.93 0.05 0.00 0.00 179.01 180.18 3ab4 h GLU 200 N 0.00 1.03 -0.36 1.06 5.08 -1.86 -1.62 114.58 117.91 3ab4 h GLU 200 Ca -0.00 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 57.97 3ab4 h GLU 200 Cb 1.28 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 3ab4 h GLU 200 CO 0.05 0.95 -0.25 1.98 -1.00 0.00 0.00 179.01 180.74 3ab4 h MET 201 N 0.95 0.80 -0.98 2.33 4.05 -1.11 -0.00 114.93 120.97 3ab4 h MET 201 Ca 0.19 -0.38 0.13 0.00 -0.28 0.00 0.00 59.70 59.36 3ab4 h MET 201 Cb 0.40 -0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.11 3ab4 h MET 201 CO 0.01 1.01 0.60 -0.07 0.23 0.00 0.00 176.91 178.69 3ab4 h LEU 202 N 0.59 0.85 0.17 3.39 -0.00 -1.00 -0.22 115.31 119.09 3ab4 h LEU 202 Ca 0.07 0.06 -0.30 0.00 -0.00 0.00 0.00 57.88 57.71 3ab4 h LEU 202 Cb 0.82 -0.11 0.02 0.00 -0.00 0.00 0.00 40.66 41.39 3ab4 h LEU 202 CO 0.07 0.42 -1.33 -0.08 -0.00 0.00 0.00 178.44 177.52 3ab4 h GLU 203 N 0.91 0.40 -0.41 1.13 4.57 -1.02 -2.47 114.58 117.68 3ab4 h GLU 203 Ca 0.50 -0.66 -0.05 0.00 -1.18 0.00 0.00 59.36 57.97 3ab4 h GLU 203 Cb 0.57 0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 29.38 3ab4 h GLU 203 CO -0.29 1.31 0.04 -0.07 -1.18 0.00 0.00 179.01 178.82 3ab4 h LEU 204 N 0.12 0.60 -0.56 1.64 3.38 -0.74 -2.94 115.31 116.81 3ab4 h LEU 204 Ca -0.18 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.61 3ab4 h LEU 204 Cb 2.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.62 3ab4 h LEU 204 CO 0.23 0.65 -0.31 0.00 0.09 0.00 0.00 178.44 179.10 3ab4 h ALA 205 N 1.43 0.88 0.00 1.53 0.00 -0.99 -2.08 119.26 120.03 3ab4 h ALA 205 Ca 0.13 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3ab4 h ALA 205 Cb 0.33 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3ab4 h ALA 205 CO 0.01 0.38 -0.73 0.00 0.00 0.00 0.00 179.25 178.91 3ab4 h ALA 206 N 1.69 0.61 -0.08 0.00 0.00 -1.26 -3.37 119.26 116.86 3ab4 h ALA 206 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3ab4 h ALA 206 Cb 1.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3ab4 h ALA 206 CO 0.04 0.80 0.00 1.33 0.00 0.00 0.00 179.25 181.42 3ab4 n VAL 207 N -3.20 0.90 0.00 0.00 0.24 -1.20 -4.98 118.33 110.09 3ab4 n VAL 207 Ca -0.00 -0.95 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 3ab4 n VAL 207 Cb 0.79 0.56 0.00 0.00 -1.47 0.00 0.00 33.84 33.72 3ab4 n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ab4 n GLY 208 N -0.21 -0.70 3.68 7.63 0.00 -1.20 -4.22 105.19 110.17 3ab4 n GLY 208 Ca 0.03 0.28 -0.46 0.00 0.00 0.00 0.00 46.02 45.87 3ab4 n GLY 208 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ab4 n SER 209 N 0.00 3.60 -1.73 1.61 2.88 -0.79 -4.83 113.62 114.36 3ab4 n SER 209 Ca 0.00 0.98 0.09 0.00 -1.33 0.00 0.00 58.87 58.60 3ab4 n SER 209 Cb 0.00 -1.43 0.38 0.00 -0.75 0.00 0.00 64.21 62.42 3ab4 n SER 209 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 3ab4 n LYS 210 N 6.27 4.23 0.00 -1.46 0.00 -1.26 -4.51 118.16 121.43 3ab4 n LYS 210 Ca 0.21 -3.02 0.00 0.00 -0.00 0.00 0.00 58.31 55.50 3ab4 n LYS 210 Cb 0.32 -2.05 0.00 0.00 -0.00 0.00 0.00 35.03 33.30 3ab4 n LYS 210 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 3ab4 n ILE 211 N 0.95 0.00 -2.73 0.58 2.08 -1.26 -4.80 119.36 114.17 3ab4 n ILE 211 Ca 0.27 0.98 -0.27 0.00 0.56 0.00 0.00 62.75 64.29 3ab4 n ILE 211 Cb 1.02 -1.85 0.00 0.00 -0.75 0.00 0.00 39.64 38.06 3ab4 n ILE 211 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 3ab4 s LEU 212 N -2.89 3.65 -0.17 1.39 2.96 -1.26 -5.06 118.68 117.31 3ab4 s LEU 212 Ca 0.00 0.82 -0.21 0.00 -0.22 0.00 0.00 54.13 54.52 3ab4 s LEU 212 Cb 0.00 -3.75 -0.03 0.00 0.50 0.00 0.00 46.19 42.91 3ab4 s LEU 212 CO 0.00 -0.58 0.61 0.68 -1.32 0.00 0.00 176.35 175.74 3ab4 s VAL 213 N -2.70 5.05 0.27 1.68 -7.23 -1.26 -4.98 120.40 111.24 3ab4 s VAL 213 Ca 0.47 1.18 -0.09 0.00 -1.81 0.00 0.00 61.98 61.73 3ab4 s VAL 213 Cb -0.10 -3.94 0.42 0.00 0.56 0.00 0.00 36.38 33.32 3ab4 s VAL 213 CO 0.43 0.16 1.56 0.25 -0.31 0.00 0.00 175.10 177.20 3ab4 h LEU 214 N 7.77 -0.95 -1.25 1.32 6.46 -1.94 0.13 115.31 126.85 3ab4 h LEU 214 Ca -0.34 0.29 0.01 0.00 -0.12 0.00 0.00 57.88 57.72 3ab4 h LEU 214 Cb 1.16 0.61 -0.04 0.00 -0.73 0.00 0.00 40.66 41.66 3ab4 h LEU 214 CO 0.77 -0.32 0.51 0.03 -0.62 0.00 0.00 178.44 178.81 3ab4 h ARG 215 N -0.00 1.01 -0.68 1.25 3.08 -1.99 -1.70 114.38 115.35 3ab4 h ARG 215 Ca 0.45 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 3ab4 h ARG 215 Cb 0.70 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 3ab4 h ARG 215 CO -1.00 0.67 0.34 0.66 -1.07 0.00 0.00 179.97 179.57 3ab4 h SER 216 N 1.04 0.88 0.68 7.04 4.64 -1.08 -1.83 113.55 124.92 3ab4 h SER 216 Ca 0.29 -0.12 -0.08 0.00 -0.47 0.00 0.00 61.79 61.40 3ab4 h SER 216 Cb -0.10 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.75 3ab4 h SER 216 CO -0.07 0.75 -0.40 0.58 -0.87 0.00 0.00 176.83 176.83 3ab4 h VAL 217 N 0.94 1.02 -0.51 0.95 2.07 -1.34 -2.50 116.25 116.88 3ab4 h VAL 217 Ca 0.24 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 3ab4 h VAL 217 Cb 0.10 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 3ab4 h VAL 217 CO -0.03 0.39 0.24 -0.33 0.02 0.00 0.00 177.57 177.86 3ab4 h GLU 218 N 0.00 0.72 -0.03 1.57 5.08 -0.48 -1.96 114.58 119.48 3ab4 h GLU 218 Ca -0.00 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.06 3ab4 h GLU 218 Cb 0.85 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 3ab4 h GLU 218 CO 0.05 0.56 -0.87 1.88 -1.00 0.00 0.00 179.01 179.63 3ab4 h TYR 219 N 0.72 0.58 -0.60 4.33 0.99 -1.20 -3.16 116.97 118.63 3ab4 h TYR 219 Ca 0.18 -0.30 0.04 0.00 2.00 0.00 0.00 58.73 60.65 3ab4 h TYR 219 Cb 0.08 -0.07 -0.04 0.00 1.00 0.00 0.00 36.73 37.70 3ab4 h TYR 219 CO 0.01 1.10 0.36 0.00 -0.00 0.00 0.00 178.16 179.62 3ab4 h ALA 220 N 0.81 0.79 -0.16 3.88 0.00 -0.93 -0.57 119.26 123.07 3ab4 h ALA 220 Ca -0.06 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 3ab4 h ALA 220 Cb 1.49 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.13 3ab4 h ALA 220 CO 0.15 0.07 -0.56 0.07 0.00 0.00 0.00 179.25 178.98 3ab4 h ARG 221 N 0.69 0.66 0.01 0.00 0.11 -1.56 -1.95 114.38 112.35 3ab4 h ARG 221 Ca 0.25 -0.50 0.02 0.00 0.10 0.00 0.00 59.98 59.86 3ab4 h ARG 221 Cb 0.07 0.09 -0.03 0.00 1.11 0.00 0.00 29.97 31.20 3ab4 h ARG 221 CO -0.12 1.12 -0.18 0.00 0.10 0.00 0.00 179.97 180.89 3ab4 h ALA 222 N 0.55 -0.23 -2.82 0.08 0.00 -1.44 -3.33 119.26 112.05 3ab4 h ALA 222 Ca -0.02 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.22 3ab4 h ALA 222 Cb 1.19 0.32 -0.21 0.00 0.00 0.00 0.00 17.79 19.09 3ab4 h ALA 222 CO 0.12 -0.68 -0.53 -0.06 0.00 0.00 0.00 179.25 178.10 3ab4 s PHE 223 N -6.12 3.20 -0.48 0.00 0.08 -0.25 -4.98 117.98 109.43 3ab4 s PHE 223 Ca -0.15 -0.36 -0.24 0.00 0.12 0.00 0.00 56.93 56.30 3ab4 s PHE 223 Cb 0.09 -2.39 -0.26 0.00 -0.57 0.00 0.00 43.02 39.89 3ab4 s PHE 223 CO 0.66 -0.38 1.69 -1.71 -0.10 0.00 0.00 175.22 175.38 3ab4 n ASN 224 N 5.03 0.73 -4.04 1.36 4.05 -1.25 -4.47 115.26 116.67 3ab4 n ASN 224 Ca -0.14 -2.25 -0.33 0.00 0.45 0.00 0.00 54.58 52.32 3ab4 n ASN 224 Cb 0.50 -1.02 -0.13 0.00 1.23 0.00 0.00 39.78 40.36 3ab4 n ASN 224 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3ab4 s VAL 225 N 10.78 2.75 0.34 3.44 1.01 -0.73 -5.06 120.40 132.93 3ab4 s VAL 225 Ca 0.64 -2.48 -0.27 0.00 0.00 0.00 0.00 61.98 59.87 3ab4 s VAL 225 Cb 0.04 -2.94 -0.13 0.00 0.00 0.00 0.00 36.38 33.35 3ab4 s VAL 225 CO 0.22 -0.68 1.12 -2.65 0.00 0.00 0.00 175.10 173.11 3ab4 n PRO 226 N 4.10 1.65 -4.31 2.72 -0.02 -1.26 -4.74 135.00 133.13 3ab4 n PRO 226 Ca 0.03 0.58 -0.29 0.00 -2.02 0.00 0.00 63.50 61.80 3ab4 n PRO 226 Cb 0.40 -2.07 -0.11 0.00 -0.02 0.00 0.00 33.50 31.70 3ab4 n PRO 226 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ab4 s LEU 227 N -0.32 2.72 -0.08 2.45 1.43 -1.12 -1.56 118.68 122.20 3ab4 s LEU 227 Ca 0.58 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 53.09 3ab4 s LEU 227 Cb -0.62 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.09 3ab4 s LEU 227 CO 0.60 0.16 -0.08 -0.13 0.23 0.00 0.00 176.35 177.13 3ab4 s ARG 228 N -2.33 1.44 -0.31 1.70 0.52 -0.88 0.06 118.95 119.15 3ab4 s ARG 228 Ca 0.20 -0.27 -0.21 0.00 -0.52 0.00 0.00 55.73 54.93 3ab4 s ARG 228 Cb -0.10 -1.38 -0.01 0.00 0.52 0.00 0.00 34.95 33.98 3ab4 s ARG 228 CO 0.11 -0.13 0.65 0.08 0.02 0.00 0.00 175.30 176.03 3ab4 s VAL 229 N 1.23 4.91 0.05 3.52 1.01 -0.61 -0.11 120.40 130.39 3ab4 s VAL 229 Ca -0.05 0.85 0.02 0.00 0.00 0.00 0.00 61.98 62.81 3ab4 s VAL 229 Cb -0.14 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 3ab4 s VAL 229 CO -0.02 -0.18 -0.07 -0.13 0.00 0.00 0.00 175.10 174.69 3ab4 s ARG 230 N 2.67 0.58 0.05 2.72 0.52 -0.66 -1.90 118.95 122.92 3ab4 s ARG 230 Ca 0.26 -0.87 -0.27 0.00 -0.52 0.00 0.00 55.73 54.33 3ab4 s ARG 230 Cb -0.15 -0.25 -0.05 0.00 0.52 0.00 0.00 34.95 35.03 3ab4 s ARG 230 CO 0.12 0.03 0.86 0.45 0.02 0.00 0.00 175.30 176.78 3ab4 s SER 231 N -1.88 7.32 0.00 0.23 0.15 -1.19 -1.72 113.70 116.60 3ab4 s SER 231 Ca -0.06 1.58 0.26 0.00 0.70 0.00 0.00 55.95 58.43 3ab4 s SER 231 Cb -0.07 -2.52 1.42 0.00 -1.71 0.00 0.00 66.02 63.14 3ab4 s SER 231 CO -0.01 -0.07 1.93 -1.54 1.20 0.00 0.00 173.24 174.75 3ab4 n SER 232 N 3.05 0.37 -0.15 5.45 3.41 0.20 -3.76 113.62 122.20 3ab4 n SER 232 Ca 0.01 -1.28 0.05 0.00 -0.26 0.00 0.00 58.87 57.39 3ab4 n SER 232 Cb 0.50 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.42 3ab4 n SER 232 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3ab4 n TYR 233 N -0.64 0.00 -4.18 7.33 4.02 -1.26 -4.93 117.16 117.51 3ab4 n TYR 233 Ca 0.19 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.98 3ab4 n TYR 233 Cb 0.15 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.37 3ab4 n TYR 233 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3ab4 s SER 234 N -1.62 0.97 -0.09 7.72 1.04 -1.25 -5.03 113.70 115.44 3ab4 s SER 234 Ca 0.07 -1.07 0.12 0.00 0.48 0.00 0.00 55.95 55.55 3ab4 s SER 234 Cb 0.08 0.14 0.51 0.00 0.10 0.00 0.00 66.02 66.85 3ab4 s SER 234 CO 0.33 -0.54 1.36 0.59 0.98 0.00 0.00 173.24 175.96 3ab4 n ASN 235 N -0.08 3.56 -4.75 7.02 3.02 -1.26 -4.71 115.26 118.06 3ab4 n ASN 235 Ca -0.10 -2.35 -0.41 0.00 -0.03 0.00 0.00 54.58 51.68 3ab4 n ASN 235 Cb 0.62 -0.50 -0.02 0.00 -0.61 0.00 0.00 39.78 39.27 3ab4 n ASN 235 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ab4 s ASP 236 N -0.74 6.42 0.44 6.41 2.15 -1.26 -4.90 116.67 125.19 3ab4 s ASP 236 Ca 0.36 2.90 0.31 0.00 0.43 0.00 0.00 52.55 56.55 3ab4 s ASP 236 Cb 0.24 -2.63 1.40 0.00 -0.30 0.00 0.00 42.92 41.62 3ab4 s ASP 236 CO 0.16 -0.88 1.91 1.55 -0.17 0.00 0.00 175.17 177.75 3ab4 h PRO 237 N 4.88 0.00 0.00 4.34 0.14 -1.93 -3.42 132.00 136.01 3ab4 h PRO 237 Ca -0.47 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.67 3ab4 h PRO 237 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.36 3ab4 h PRO 237 CO 0.79 0.00 0.00 0.41 0.14 0.00 0.00 178.00 179.34 3ab4 n GLY 238 N -0.37 -0.81 3.26 1.56 0.00 -1.26 -4.81 105.19 102.76 3ab4 n GLY 238 Ca 0.00 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 3ab4 n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ab4 s THR 239 N 0.00 2.66 0.22 2.61 2.01 -0.80 -4.84 115.64 117.49 3ab4 s THR 239 Ca 0.00 -0.77 -0.27 0.00 0.31 0.00 0.00 61.69 60.96 3ab4 s THR 239 Cb 0.00 -2.13 -0.09 0.00 0.01 0.00 0.00 72.50 70.30 3ab4 s THR 239 CO 0.00 0.51 0.86 -0.22 -0.69 0.00 0.00 174.62 175.08 3ab4 s LEU 240 N 0.88 4.58 -0.78 4.42 2.96 -0.88 -1.58 118.68 128.29 3ab4 s LEU 240 Ca -0.04 1.78 0.03 0.00 -0.22 0.00 0.00 54.13 55.68 3ab4 s LEU 240 Cb -0.15 -3.52 0.19 0.00 0.50 0.00 0.00 46.19 43.21 3ab4 s LEU 240 CO -0.01 0.15 0.62 -0.38 -1.32 0.00 0.00 176.35 175.41 3ab4 n ILE 241 N 1.39 2.18 0.00 6.68 -0.00 0.11 -2.56 119.36 127.16 3ab4 n ILE 241 Ca -0.03 -4.98 0.00 0.00 -0.00 0.00 0.00 62.75 57.74 3ab4 n ILE 241 Cb 0.48 -2.25 0.00 0.00 -0.00 0.00 0.00 39.64 37.87 3ab4 n ILE 241 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3ab4 n ALA 242 N 2.01 0.00 -1.24 -1.39 0.00 -1.12 -2.78 120.51 116.00 3ab4 n ALA 242 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3ab4 n ALA 242 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 3ab4 n ALA 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ab4 n GLY 243 N 5.00 -0.58 3.86 0.00 0.00 -1.26 -3.88 105.19 108.33 3ab4 n GLY 243 Ca 0.00 -1.72 -0.35 0.00 0.00 0.00 0.00 46.02 43.95 3ab4 n GLY 243 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ab4 s SER 244 N -1.00 6.71 0.00 1.61 0.15 -1.26 -1.31 113.70 118.60 3ab4 s SER 244 Ca 0.00 0.89 0.31 0.00 0.70 0.00 0.00 55.95 57.85 3ab4 s SER 244 Cb 0.00 -2.22 1.59 0.00 -1.71 0.00 0.00 66.02 63.68 3ab4 s SER 244 CO 0.00 0.16 2.07 1.15 1.20 0.00 0.00 173.24 177.82 3ab4 n MET 245 N 0.93 0.78 0.18 5.44 0.00 -1.26 -2.25 117.12 120.95 3ab4 n MET 245 Ca -0.08 -0.11 0.03 0.00 0.00 0.00 0.00 57.70 57.55 3ab4 n MET 245 Cb 0.52 -1.50 0.41 0.00 0.00 0.00 0.00 33.22 32.65 3ab4 n MET 245 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 3ab4 h GLU 246 N 0.26 0.07 -0.45 3.17 4.39 -2.01 -3.12 114.58 116.89 3ab4 h GLU 246 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3ab4 h GLU 246 Cb 0.20 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 3ab4 h GLU 246 CO 0.00 0.32 0.00 -0.25 -1.16 0.00 0.00 179.01 177.92 3ab4 n ASP 247 N -4.22 2.70 -4.73 1.42 8.00 -0.95 -4.91 116.55 113.86 3ab4 n ASP 247 Ca -0.02 -1.96 -0.38 0.00 0.71 0.00 0.00 54.79 53.14 3ab4 n ASP 247 Cb 0.32 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 41.06 3ab4 n ASP 247 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ab4 s ILE 248 N -1.40 5.14 -0.10 0.53 -1.09 -1.18 -5.05 121.20 118.05 3ab4 s ILE 248 Ca 0.35 1.03 -0.30 0.00 -2.23 0.00 0.00 60.65 59.50 3ab4 s ILE 248 Cb 0.19 -3.85 -0.02 0.00 -1.58 0.00 0.00 42.46 37.20 3ab4 s ILE 248 CO 0.25 0.34 1.08 -2.16 -1.23 0.00 0.00 174.94 173.22 3ab4 s PRO 249 N 0.50 4.38 -0.83 2.79 0.04 -1.26 -4.72 135.00 135.90 3ab4 s PRO 249 Ca 0.28 1.49 -0.25 0.00 0.04 0.00 0.00 61.00 62.55 3ab4 s PRO 249 Cb -0.16 -3.56 -0.01 0.00 0.04 0.00 0.00 34.50 30.81 3ab4 s PRO 249 CO 0.12 -0.40 1.72 0.54 0.04 0.00 0.00 177.00 179.02 3ab4 s VAL 250 N 2.23 3.56 0.00 -0.36 0.11 -1.26 -4.96 120.40 119.72 3ab4 s VAL 250 Ca 0.51 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.37 3ab4 s VAL 250 Cb -0.20 -4.34 0.00 0.00 -1.53 0.00 0.00 36.38 30.30 3ab4 s VAL 250 CO 0.18 -1.28 0.00 0.00 -3.33 0.00 0.00 175.10 170.67 3ab4 n ALA 253 N 11.91 -1.57 -2.26 1.54 0.00 -1.26 -5.17 120.51 123.70 3ab4 n ALA 253 Ca 0.28 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.57 3ab4 n ALA 253 Cb 0.49 -0.26 -0.10 0.00 0.00 0.00 0.00 19.45 19.58 3ab4 n ALA 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ab4 s VAL 254 N -0.35 0.26 -0.11 0.00 0.11 -1.26 -4.28 120.40 114.76 3ab4 s VAL 254 Ca 0.00 -2.00 -0.26 0.00 -2.93 0.00 0.00 61.98 56.79 3ab4 s VAL 254 Cb 0.00 -2.56 -0.02 0.00 -1.53 0.00 0.00 36.38 32.27 3ab4 s VAL 254 CO 0.00 0.00 0.86 -0.76 -3.33 0.00 0.00 175.10 171.87 3ab4 s LEU 255 N -3.25 4.25 -0.12 2.54 1.43 -1.26 -1.77 118.68 120.50 3ab4 s LEU 255 Ca 0.38 1.32 -0.06 0.00 -1.03 0.00 0.00 54.13 54.75 3ab4 s LEU 255 Cb 0.07 -3.32 -0.26 0.00 0.03 0.00 0.00 46.19 42.71 3ab4 s LEU 255 CO 0.14 -0.33 0.35 0.41 0.23 0.00 0.00 176.35 177.15 3ab4 n THR 256 N 4.37 1.77 0.00 5.49 -1.04 0.86 -4.95 114.28 120.78 3ab4 n THR 256 Ca 0.04 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.40 3ab4 n THR 256 Cb 0.50 -1.70 0.00 0.00 -1.82 0.00 0.00 70.33 67.30 3ab4 n THR 256 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ab4 n GLY 257 N 2.00 0.93 3.86 3.41 0.00 -0.91 -4.62 105.19 109.86 3ab4 n GLY 257 Ca -0.32 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 3ab4 n GLY 257 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ab4 s VAL 258 N -2.00 5.47 0.16 1.61 1.01 0.21 -1.67 120.40 125.20 3ab4 s VAL 258 Ca 0.00 0.20 0.09 0.00 0.00 0.00 0.00 61.98 62.27 3ab4 s VAL 258 Cb 0.00 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 3ab4 s VAL 258 CO 0.00 0.60 -0.21 0.00 0.00 0.00 0.00 175.10 175.49 3ab4 s ALA 259 N -0.86 2.14 0.02 5.51 0.00 -0.43 -4.24 121.76 123.91 3ab4 s ALA 259 Ca 0.14 -1.49 -0.04 0.00 0.00 0.00 0.00 51.96 50.57 3ab4 s ALA 259 Cb -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 3ab4 s ALA 259 CO 0.03 0.32 0.05 0.99 0.00 0.00 0.00 175.76 177.16 3ab4 s THR 260 N -1.75 0.12 -0.30 0.00 2.01 -1.26 -0.60 115.64 113.86 3ab4 s THR 260 Ca 0.16 -1.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.08 3ab4 s THR 260 Cb -0.07 -0.62 0.15 0.00 0.01 0.00 0.00 72.50 71.96 3ab4 s THR 260 CO 0.07 -0.55 0.64 -0.62 -0.69 0.00 0.00 174.62 173.47 3ab4 s ASP 261 N -1.79 -1.21 -0.08 3.53 2.15 -0.47 -4.38 116.67 114.42 3ab4 s ASP 261 Ca -0.10 1.37 0.12 0.00 0.43 0.00 0.00 52.55 54.37 3ab4 s ASP 261 Cb -0.05 2.26 0.26 0.00 -0.30 0.00 0.00 42.92 45.10 3ab4 s ASP 261 CO -0.02 -0.23 1.18 2.29 -0.17 0.00 0.00 175.17 178.22 3ab4 n LYS 262 N 5.44 2.36 -0.13 4.34 2.85 -1.26 -0.91 118.16 130.84 3ab4 n LYS 262 Ca -0.09 -2.26 0.11 0.00 -1.05 0.00 0.00 58.31 55.03 3ab4 n LYS 262 Cb 0.50 -1.40 0.28 0.00 -0.65 0.00 0.00 35.03 33.76 3ab4 n LYS 262 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3ab4 n SER 263 N -0.67 2.62 -4.64 -5.58 3.41 -1.26 -4.94 113.62 102.56 3ab4 n SER 263 Ca 0.12 -1.87 -0.24 0.00 -0.26 0.00 0.00 58.87 56.62 3ab4 n SER 263 Cb 0.55 -0.17 -0.08 0.00 -0.26 0.00 0.00 64.21 64.25 3ab4 n SER 263 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3ab4 s GLU 264 N -1.65 2.18 0.03 4.33 0.41 -1.26 -2.00 118.70 120.74 3ab4 s GLU 264 Ca 0.35 -1.59 0.08 0.00 -0.41 0.00 0.00 54.97 53.40 3ab4 s GLU 264 Cb 0.20 -2.05 -0.02 0.00 -1.78 0.00 0.00 34.13 30.48 3ab4 s GLU 264 CO 0.29 0.24 -0.22 0.00 -0.49 0.00 0.00 175.26 175.08 3ab4 s ALA 265 N -2.43 1.87 -0.20 5.21 0.00 0.20 -4.48 121.76 121.93 3ab4 s ALA 265 Ca 0.34 -1.08 -0.11 0.00 0.00 0.00 0.00 51.96 51.10 3ab4 s ALA 265 Cb -0.03 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.65 3ab4 s ALA 265 CO 0.20 0.43 0.19 0.21 0.00 0.00 0.00 175.76 176.79 3ab4 s LYS 266 N -1.07 4.17 -0.06 0.00 2.20 0.01 -2.02 119.74 122.97 3ab4 s LYS 266 Ca 0.09 -0.14 0.04 0.00 -0.36 0.00 0.00 55.97 55.59 3ab4 s LYS 266 Cb -0.09 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.77 3ab4 s LYS 266 CO 0.01 0.20 -0.17 0.08 -0.36 0.00 0.00 175.35 175.11 3ab4 s VAL 267 N 0.63 1.46 -0.12 4.02 1.01 -0.68 -1.07 120.40 125.66 3ab4 s VAL 267 Ca 0.10 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.39 3ab4 s VAL 267 Cb -0.12 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 35.00 3ab4 s VAL 267 CO 0.02 0.42 -0.14 -0.89 0.00 0.00 0.00 175.10 174.51 3ab4 s THR 268 N 0.30 1.42 -0.28 3.92 2.01 -0.43 -1.54 115.64 121.04 3ab4 s THR 268 Ca -0.10 -0.58 -0.17 0.00 0.31 0.00 0.00 61.69 61.15 3ab4 s THR 268 Cb -0.14 -1.33 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 3ab4 s THR 268 CO 0.04 0.43 0.46 -0.69 -0.69 0.00 0.00 174.62 174.17 3ab4 s VAL 269 N 1.21 5.10 0.06 3.82 1.01 -0.43 0.46 120.40 131.63 3ab4 s VAL 269 Ca -0.02 0.68 -0.09 0.00 0.00 0.00 0.00 61.98 62.55 3ab4 s VAL 269 Cb -0.14 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 3ab4 s VAL 269 CO -0.05 0.06 0.36 -0.76 0.00 0.00 0.00 175.10 174.71 3ab4 s LEU 270 N 2.24 4.35 -0.26 3.92 1.43 0.33 -1.70 118.68 128.99 3ab4 s LEU 270 Ca 0.19 0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 53.98 3ab4 s LEU 270 Cb -0.16 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.17 3ab4 s LEU 270 CO 0.10 0.19 0.13 0.61 0.23 0.00 0.00 176.35 177.61 3ab4 n GLY 271 N 0.93 0.53 3.72 -3.19 0.00 -1.12 -1.17 105.19 104.91 3ab4 n GLY 271 Ca -0.09 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 3ab4 n GLY 271 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ab4 s ILE 272 N -2.75 4.73 0.23 -0.61 1.09 0.22 -3.86 121.20 120.25 3ab4 s ILE 272 Ca 0.06 1.90 -0.30 0.00 -1.10 0.00 0.00 60.65 61.22 3ab4 s ILE 272 Cb -0.03 -4.25 -0.10 0.00 -1.06 0.00 0.00 42.46 37.03 3ab4 s ILE 272 CO 0.08 0.27 1.46 -0.94 -0.10 0.00 0.00 174.94 175.71 3ab4 s SER 273 N 0.40 6.65 -1.29 3.58 1.04 -1.26 0.11 113.70 122.94 3ab4 s SER 273 Ca 0.46 2.64 -0.08 0.00 0.48 0.00 0.00 55.95 59.44 3ab4 s SER 273 Cb -0.21 -2.62 -0.09 0.00 0.10 0.00 0.00 66.02 63.20 3ab4 s SER 273 CO 0.26 -0.72 2.75 -0.67 0.98 0.00 0.00 173.24 175.85 3ab4 n ASP 274 N 2.72 7.34 -4.49 7.02 4.64 -1.26 -4.81 116.55 127.71 3ab4 n ASP 274 Ca 0.08 -2.48 -0.25 0.00 -1.38 0.00 0.00 54.79 50.76 3ab4 n ASP 274 Cb 0.40 -1.40 -0.10 0.00 -1.04 0.00 0.00 41.12 38.98 3ab4 n ASP 274 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 3ab4 s LYS 275 N 2.43 1.77 0.53 -0.67 -0.14 -1.26 -4.95 119.74 117.44 3ab4 s LYS 275 Ca 0.60 -1.57 -0.22 0.00 -1.36 0.00 0.00 55.97 53.42 3ab4 s LYS 275 Cb 0.17 -1.91 -0.05 0.00 -1.68 0.00 0.00 37.83 34.36 3ab4 s LYS 275 CO -0.05 0.37 1.35 -2.14 -0.76 0.00 0.00 175.35 174.13 3ab4 s PRO 276 N -3.16 3.25 0.00 -1.68 0.02 -1.26 -3.23 135.00 128.94 3ab4 s PRO 276 Ca 0.26 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.51 3ab4 s PRO 276 Cb -0.07 -2.32 0.00 0.00 0.02 0.00 0.00 34.50 32.13 3ab4 s PRO 276 CO 0.14 -1.10 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 3ab4 n GLY 277 N 0.69 2.75 0.33 0.52 0.00 -1.26 -4.91 105.19 103.30 3ab4 n GLY 277 Ca 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 3ab4 n GLY 277 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ab4 h GLU 278 N 0.00 1.05 -0.26 1.61 4.39 -1.87 0.35 114.58 119.85 3ab4 h GLU 278 Ca 0.00 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 3ab4 h GLU 278 Cb 0.00 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.40 3ab4 h GLU 278 CO 0.00 0.69 -0.02 0.00 -1.16 0.00 0.00 179.01 178.52 3ab4 h ALA 279 N 1.35 1.47 0.00 3.43 0.00 -1.91 -1.67 119.26 121.94 3ab4 h ALA 279 Ca 0.34 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3ab4 h ALA 279 Cb -0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3ab4 h ALA 279 CO -0.11 0.37 -0.10 0.00 0.00 0.00 0.00 179.25 179.41 3ab4 h ALA 280 N 1.60 1.59 -0.20 0.00 0.00 -0.75 -2.46 119.26 119.04 3ab4 h ALA 280 Ca 0.09 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3ab4 h ALA 280 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3ab4 h ALA 280 CO 0.01 0.13 -0.04 0.87 0.00 0.00 0.00 179.25 180.22 3ab4 h LYS 281 N 0.00 0.38 0.57 0.00 1.57 -0.49 -2.79 116.57 115.82 3ab4 h LYS 281 Ca -0.00 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 3ab4 h LYS 281 Cb 0.22 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.51 3ab4 h LYS 281 CO 0.01 0.63 -0.27 0.28 -0.57 0.00 0.00 179.45 179.53 3ab4 h VAL 282 N 0.11 0.43 0.00 0.50 2.07 -1.38 -2.88 116.25 115.09 3ab4 h VAL 282 Ca 0.05 -0.09 -0.17 0.00 0.82 0.00 0.00 66.70 67.31 3ab4 h VAL 282 Cb 0.48 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3ab4 h VAL 282 CO 0.02 0.01 -0.84 -0.26 0.02 0.00 0.00 177.57 176.53 3ab4 h PHE 283 N -0.82 0.00 -0.26 1.57 0.04 -1.55 -1.24 116.94 114.68 3ab4 h PHE 283 Ca -0.08 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.66 3ab4 h PHE 283 Cb 0.61 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.75 3ab4 h PHE 283 CO -0.02 0.82 0.03 -0.09 -0.60 0.00 0.00 178.31 178.45 3ab4 h ARG 284 N 0.00 0.43 -0.73 1.51 9.65 -1.62 1.66 114.38 125.28 3ab4 h ARG 284 Ca -0.01 -0.12 0.10 0.00 -1.10 0.00 0.00 59.98 58.85 3ab4 h ARG 284 Cb 1.63 -0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 30.09 3ab4 h ARG 284 CO 0.11 0.56 0.36 0.00 2.80 0.00 0.00 179.97 183.79 3ab4 h ALA 285 N 0.85 1.02 -0.13 2.80 0.00 -1.32 1.22 119.26 123.70 3ab4 h ALA 285 Ca 0.08 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 3ab4 h ALA 285 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3ab4 h ALA 285 CO 0.01 -0.07 -0.30 -0.07 0.00 0.00 0.00 179.25 178.82 3ab4 h LEU 286 N 0.59 0.49 -1.09 0.00 3.38 -1.04 -3.26 115.31 114.38 3ab4 h LEU 286 Ca 0.37 -0.57 0.05 0.00 0.09 0.00 0.00 57.88 57.82 3ab4 h LEU 286 Cb 0.42 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 3ab4 h LEU 286 CO -0.29 0.97 0.62 0.00 0.09 0.00 0.00 178.44 179.82 3ab4 h ALA 287 N 0.53 1.44 0.00 1.53 0.00 0.35 -0.30 119.26 122.81 3ab4 h ALA 287 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ab4 h ALA 287 Cb 0.90 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3ab4 h ALA 287 CO 0.07 0.44 0.00 -0.44 0.00 0.00 0.00 179.25 179.32 3ab4 h ASP 288 N 1.13 0.00 -0.38 0.00 3.32 0.14 -2.86 116.42 117.78 3ab4 h ASP 288 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3ab4 h ASP 288 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 3ab4 h ASP 288 CO -0.14 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.38 3ab4 n ALA 289 N -1.88 2.31 -1.34 3.45 0.00 -0.13 -4.97 120.51 117.94 3ab4 n ALA 289 Ca -0.01 -1.06 -0.10 0.00 0.00 0.00 0.00 53.44 52.27 3ab4 n ALA 289 Cb 0.08 -0.60 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 3ab4 n ALA 289 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ab4 n GLU 290 N 0.93 -0.70 -2.53 0.00 -0.58 -1.08 -4.95 120.64 111.73 3ab4 n GLU 290 Ca 0.15 0.84 -0.41 0.00 -0.42 0.00 0.00 57.16 57.31 3ab4 n GLU 290 Cb 0.48 -4.77 -0.03 0.00 -0.57 0.00 0.00 31.44 26.55 3ab4 n GLU 290 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 3ab4 s ILE 291 N -2.38 3.81 -0.01 -3.67 -5.25 -1.20 -4.97 121.20 107.53 3ab4 s ILE 291 Ca 0.00 0.58 -0.30 0.00 -0.99 0.00 0.00 60.65 59.94 3ab4 s ILE 291 Cb 0.00 -4.79 -0.06 0.00 2.95 0.00 0.00 42.46 40.56 3ab4 s ILE 291 CO 0.00 -1.61 1.58 0.54 -1.79 0.00 0.00 174.94 173.66 3ab4 s ASN 292 N 3.68 6.70 -0.17 4.36 4.22 -1.26 -4.72 114.94 127.74 3ab4 s ASN 292 Ca 0.40 2.26 -0.04 0.00 -2.14 0.00 0.00 52.86 53.33 3ab4 s ASN 292 Cb -0.08 -2.55 -0.03 0.00 1.28 0.00 0.00 41.25 39.87 3ab4 s ASN 292 CO 0.19 -0.86 -0.02 0.27 -2.04 0.00 0.00 177.10 174.64 3ab4 s ILE 293 N 3.22 3.93 -0.20 0.54 -0.00 -1.26 -4.22 121.20 123.20 3ab4 s ILE 293 Ca 0.71 -0.33 -0.03 0.00 -0.00 0.00 0.00 60.65 60.99 3ab4 s ILE 293 Cb -0.34 -2.75 -0.21 0.00 -0.00 0.00 0.00 42.46 39.16 3ab4 s ILE 293 CO 0.29 0.47 0.05 -0.67 -0.00 0.00 0.00 174.94 175.07 3ab4 n ASP 294 N 3.83 2.04 -3.78 4.36 -0.08 0.42 -4.96 116.55 118.39 3ab4 n ASP 294 Ca -0.17 0.05 -0.13 0.00 -1.51 0.00 0.00 54.79 53.03 3ab4 n ASP 294 Cb 0.52 -0.64 -0.12 0.00 2.34 0.00 0.00 41.12 43.22 3ab4 n ASP 294 CO 0.00 0.00 0.00 -0.32 0.12 0.00 0.00 177.20 177.00 3ab4 s MET 295 N -2.53 0.24 -0.02 -0.67 0.00 -1.09 -4.95 119.30 110.27 3ab4 s MET 295 Ca -0.29 0.35 0.03 0.00 0.00 0.00 0.00 55.69 55.78 3ab4 s MET 295 Cb 0.08 0.06 -0.00 0.00 0.00 0.00 0.00 34.83 34.97 3ab4 s MET 295 CO 0.67 -0.06 -0.11 0.54 0.00 0.00 0.00 175.02 176.06 3ab4 s VAL 296 N 0.40 0.92 -0.02 10.11 0.11 -1.26 0.11 120.40 130.78 3ab4 s VAL 296 Ca -0.02 -0.46 0.00 0.00 -2.93 0.00 0.00 61.98 58.57 3ab4 s VAL 296 Cb -0.04 -0.80 0.02 0.00 -1.53 0.00 0.00 36.38 34.04 3ab4 s VAL 296 CO -0.02 0.27 0.02 -0.76 -3.33 0.00 0.00 175.10 171.28 3ab4 s LEU 297 N 0.00 1.33 -0.25 2.54 1.02 0.13 -4.99 118.68 118.47 3ab4 s LEU 297 Ca -0.00 0.02 -0.17 0.00 0.02 0.00 0.00 54.13 53.99 3ab4 s LEU 297 Cb -0.07 -0.08 0.07 0.00 0.02 0.00 0.00 46.19 46.12 3ab4 s LEU 297 CO 0.00 -0.09 0.62 -1.58 0.02 0.00 0.00 176.35 175.33 3ab4 s GLN 298 N 0.78 0.67 -0.06 1.70 0.74 -1.26 -0.95 119.66 121.28 3ab4 s GLN 298 Ca -0.07 1.02 -0.03 0.00 0.05 0.00 0.00 55.36 56.33 3ab4 s GLN 298 Cb -0.10 0.20 0.04 0.00 1.10 0.00 0.00 33.01 34.26 3ab4 s GLN 298 CO -0.02 -0.13 0.13 1.21 -0.55 0.00 0.00 175.29 175.94 3ab4 s ASN 299 N 1.07 0.25 -0.17 6.67 3.84 -1.26 -5.10 114.94 120.23 3ab4 s ASN 299 Ca -0.06 0.27 -0.16 0.00 0.21 0.00 0.00 52.86 53.12 3ab4 s ASN 299 Cb -0.05 0.17 -0.04 0.00 -0.55 0.00 0.00 41.25 40.77 3ab4 s ASN 299 CO -0.10 -0.18 0.39 0.54 -2.79 0.00 0.00 177.10 174.95 3ab4 s VAL 300 N 1.57 5.23 -0.29 -5.21 0.11 -1.26 -4.81 120.40 115.74 3ab4 s VAL 300 Ca -0.05 0.71 0.01 0.00 -2.93 0.00 0.00 61.98 59.72 3ab4 s VAL 300 Cb -0.12 -3.72 0.06 0.00 -1.53 0.00 0.00 36.38 31.07 3ab4 s VAL 300 CO -0.05 0.30 -0.04 -0.36 -3.33 0.00 0.00 175.10 171.62 3ab4 s PHE 301 N 0.95 3.29 0.00 1.54 0.40 -1.26 -5.19 117.98 117.71 3ab4 s PHE 301 Ca 0.20 -2.14 0.00 0.00 -0.60 0.00 0.00 56.93 54.39 3ab4 s PHE 301 Cb -0.14 -2.09 0.00 0.00 0.51 0.00 0.00 43.02 41.30 3ab4 s PHE 301 CO 0.07 -0.85 0.00 0.43 0.70 0.00 0.00 175.22 175.57 3ab4 n SER 302 N 4.52 0.00 -0.60 1.36 7.64 -1.26 -5.09 113.62 120.19 3ab4 n SER 302 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 3ab4 n SER 302 Cb 0.43 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 3ab4 n SER 302 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3ab4 n THR 307 N 0.00 0.00 -4.33 0.44 5.66 -1.26 -5.35 114.28 109.44 3ab4 n THR 307 Ca 0.00 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.81 3ab4 n THR 307 Cb 0.00 -0.25 -0.09 0.00 -1.55 0.00 0.00 70.33 68.44 3ab4 n THR 307 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3ab4 s THR 308 N 0.00 0.30 0.04 1.09 -1.32 0.30 -4.84 115.64 111.22 3ab4 s THR 308 Ca 0.00 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.57 3ab4 s THR 308 Cb 0.00 -2.51 -0.03 0.00 -1.51 0.00 0.00 72.50 68.45 3ab4 s THR 308 CO 0.00 0.00 -0.25 -1.81 -2.21 0.00 0.00 174.62 170.35 3ab4 s ASP 309 N -3.37 3.24 -0.12 8.08 -0.00 -1.26 0.69 116.67 123.93 3ab4 s ASP 309 Ca 0.36 -0.57 0.02 0.00 -0.00 0.00 0.00 52.55 52.36 3ab4 s ASP 309 Cb 0.05 -0.33 0.01 0.00 -0.00 0.00 0.00 42.92 42.65 3ab4 s ASP 309 CO 0.18 0.26 -0.19 -0.63 -0.00 0.00 0.00 175.17 174.79 3ab4 s ILE 310 N -0.82 1.79 -0.10 0.77 1.01 -0.69 -4.47 121.20 118.69 3ab4 s ILE 310 Ca 0.12 -0.83 -0.03 0.00 0.00 0.00 0.00 60.65 59.91 3ab4 s ILE 310 Cb -0.10 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 3ab4 s ILE 310 CO 0.02 0.50 0.01 -0.89 0.00 0.00 0.00 174.94 174.59 3ab4 s THR 311 N 0.78 4.42 0.05 2.92 2.01 -0.12 -1.31 115.64 124.38 3ab4 s THR 311 Ca -0.10 -0.20 0.00 0.00 0.31 0.00 0.00 61.69 61.70 3ab4 s THR 311 Cb -0.16 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.44 3ab4 s THR 311 CO 0.01 0.59 -0.04 0.72 -0.69 0.00 0.00 174.62 175.20 3ab4 s PHE 312 N -0.72 0.53 -0.04 4.92 -0.12 -0.59 0.22 117.98 122.18 3ab4 s PHE 312 Ca 0.11 -0.80 0.06 0.00 -0.05 0.00 0.00 56.93 56.25 3ab4 s PHE 312 Cb -0.12 -0.35 -0.01 0.00 -0.63 0.00 0.00 43.02 41.91 3ab4 s PHE 312 CO 0.02 -0.24 -0.22 -0.08 -0.05 0.00 0.00 175.22 174.65 3ab4 s THR 313 N -2.78 1.82 0.26 -4.49 -1.32 0.31 -1.69 115.64 107.76 3ab4 s THR 313 Ca -0.01 -0.95 -0.07 0.00 -1.21 0.00 0.00 61.69 59.44 3ab4 s THR 313 Cb -0.00 -1.53 -0.01 0.00 -1.51 0.00 0.00 72.50 69.44 3ab4 s THR 313 CO -0.05 0.51 0.40 0.00 -2.21 0.00 0.00 174.62 173.27 3ab4 s PRO 315 N -3.79 3.15 0.35 0.00 0.02 -1.26 0.59 135.00 134.05 3ab4 s PRO 315 Ca 0.28 1.79 0.07 0.00 0.02 0.00 0.00 61.00 63.17 3ab4 s PRO 315 Cb 0.01 -2.01 0.77 0.00 0.02 0.00 0.00 34.50 33.30 3ab4 s PRO 315 CO 0.13 -1.06 1.90 0.00 -0.33 0.00 0.00 177.00 177.64 3ab4 h ARG 316 N 1.10 0.72 0.00 5.54 3.08 -1.65 -0.29 114.38 122.88 3ab4 h ARG 316 Ca -0.50 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.49 3ab4 h ARG 316 Cb 1.28 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 31.17 3ab4 h ARG 316 CO 0.56 0.47 -0.05 0.66 -1.07 0.00 0.00 179.97 180.55 3ab4 h SER 317 N 0.74 0.00 0.27 7.04 4.64 -1.91 -1.55 113.55 122.78 3ab4 h SER 317 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3ab4 h SER 317 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3ab4 h SER 317 CO -0.17 0.05 -0.65 0.47 -0.87 0.00 0.00 176.83 175.65 3ab4 n ASP 318 N -4.03 0.81 -0.18 4.97 9.92 -0.20 -4.60 116.55 123.25 3ab4 n ASP 318 Ca -0.03 -0.65 -0.05 0.00 -0.53 0.00 0.00 54.79 53.53 3ab4 n ASP 318 Cb 0.13 0.52 0.04 0.00 -0.64 0.00 0.00 41.12 41.17 3ab4 n ASP 318 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 3ab4 h GLY 319 N 4.98 0.74 0.74 0.44 0.00 -0.38 0.11 103.07 109.70 3ab4 h GLY 319 Ca 0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.06 3ab4 h GLY 319 CO 0.00 0.20 -0.35 0.07 0.00 0.00 0.00 176.54 176.46 3ab4 h ARG 320 N 0.62 -0.95 -0.58 4.80 0.11 -1.81 -1.33 114.38 115.24 3ab4 h ARG 320 Ca 0.21 0.07 0.12 0.00 0.10 0.00 0.00 59.98 60.47 3ab4 h ARG 320 Cb 0.02 0.22 -0.10 0.00 1.11 0.00 0.00 29.97 31.22 3ab4 h ARG 320 CO -0.09 -0.64 -0.04 0.07 0.10 0.00 0.00 179.97 179.37 3ab4 h ARG 321 N -1.09 0.08 -0.65 0.08 0.11 -1.85 0.49 114.38 111.54 3ab4 h ARG 321 Ca -0.10 -0.00 0.11 0.00 0.10 0.00 0.00 59.98 60.09 3ab4 h ARG 321 Cb 0.76 -0.02 -0.12 0.00 1.11 0.00 0.00 29.97 31.70 3ab4 h ARG 321 CO 0.17 0.05 -0.32 0.00 0.10 0.00 0.00 179.97 179.97 3ab4 h ALA 322 N 1.54 0.04 -0.18 0.08 0.00 -0.63 0.20 119.26 120.30 3ab4 h ALA 322 Ca 0.29 0.19 -0.20 0.00 0.00 0.00 0.00 54.91 55.20 3ab4 h ALA 322 Cb 0.46 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3ab4 h ALA 322 CO -0.52 -0.64 -0.67 1.98 0.00 0.00 0.00 179.25 179.40 3ab4 h MET 323 N -0.13 0.72 -0.74 0.00 4.05 0.11 -2.57 114.93 116.38 3ab4 h MET 323 Ca 0.26 -0.53 0.03 0.00 -0.28 0.00 0.00 59.70 59.18 3ab4 h MET 323 Cb 0.55 0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 31.40 3ab4 h MET 323 CO -0.72 1.15 0.46 0.93 0.23 0.00 0.00 176.91 178.96 3ab4 h GLU 324 N 0.52 0.87 -0.12 0.39 5.08 0.90 -0.61 114.58 121.61 3ab4 h GLU 324 Ca -0.02 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 3ab4 h GLU 324 Cb 1.28 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3ab4 h GLU 324 CO 0.14 0.58 -0.22 0.97 -1.00 0.00 0.00 179.01 179.47 3ab4 h ILE 325 N 0.90 1.37 -0.02 3.13 6.09 -0.57 -3.12 117.51 125.29 3ab4 h ILE 325 Ca 0.30 -1.48 -0.04 0.00 -1.37 0.00 0.00 64.86 62.28 3ab4 h ILE 325 Cb 0.03 2.03 -0.01 0.00 0.47 0.00 0.00 36.82 39.35 3ab4 h ILE 325 CO -0.12 0.43 -0.17 -0.07 -3.07 0.00 0.00 178.15 175.15 3ab4 h LEU 326 N -0.05 0.03 -1.70 2.19 4.07 -1.36 -2.61 115.31 115.89 3ab4 h LEU 326 Ca 0.01 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.93 3ab4 h LEU 326 Cb 0.80 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.53 3ab4 h LEU 326 CO 0.05 0.21 -0.14 0.11 -1.08 0.00 0.00 178.44 177.59 3ab4 h LYS 327 N 0.03 0.00 0.02 1.13 1.79 -1.05 -2.02 116.57 116.48 3ab4 h LYS 327 Ca 0.01 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 58.24 3ab4 h LYS 327 Cb 0.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 3ab4 h LYS 327 CO 0.02 0.14 -0.98 0.87 -1.08 0.00 0.00 179.45 178.42 3ab4 h LYS 328 N 0.00 0.43 0.00 3.15 1.79 -1.47 -3.02 116.57 117.45 3ab4 h LYS 328 Ca -0.00 -0.48 -0.05 0.00 -2.18 0.00 0.00 60.65 57.94 3ab4 h LYS 328 Cb 0.45 0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 3ab4 h LYS 328 CO 0.02 1.14 -0.23 -0.07 -1.08 0.00 0.00 179.45 179.23 3ab4 h LEU 329 N 0.23 0.00 -0.15 2.94 -0.00 -1.37 0.63 115.31 117.59 3ab4 h LEU 329 Ca -0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.71 3ab4 h LEU 329 Cb 1.63 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 42.29 3ab4 h LEU 329 CO 0.17 0.23 -0.20 -0.61 -0.00 0.00 0.00 178.44 178.03 3ab4 h GLN 330 N 0.00 0.40 -0.29 1.13 4.15 -1.44 -3.29 115.11 115.77 3ab4 h GLN 330 Ca -0.00 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.18 3ab4 h GLN 330 Cb 0.55 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 3ab4 h GLN 330 CO 0.03 0.81 0.13 0.28 -1.93 0.00 0.00 178.83 178.15 3ab4 h VAL 331 N 0.02 1.16 -0.39 2.39 2.07 -1.34 -3.27 116.25 116.89 3ab4 h VAL 331 Ca 0.02 -0.47 -0.21 0.00 0.82 0.00 0.00 66.70 66.86 3ab4 h VAL 331 Cb 0.76 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 3ab4 h VAL 331 CO 0.05 0.17 0.64 -1.10 0.02 0.00 0.00 177.57 177.34 3ab4 s GLN 332 N -5.65 2.03 0.00 1.57 1.11 0.18 -4.77 119.66 114.14 3ab4 s GLN 332 Ca -0.13 -0.70 0.00 0.00 0.01 0.00 0.00 55.36 54.54 3ab4 s GLN 332 Cb 0.09 -5.10 0.00 0.00 -1.01 0.00 0.00 33.01 26.98 3ab4 s GLN 332 CO 0.72 -4.40 0.00 0.41 0.01 0.00 0.00 175.29 172.03 3ab4 n GLY 333 N 6.13 0.00 0.00 3.09 0.00 -1.23 -4.83 105.19 108.34 3ab4 n GLY 333 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3ab4 n GLY 333 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ab4 n ASN 334 N 0.00 0.00 -4.84 1.61 2.85 -1.24 -4.99 115.26 108.65 3ab4 n ASN 334 Ca 0.00 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.25 3ab4 n ASN 334 Cb 0.00 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 40.98 3ab4 n ASN 334 CO 0.00 0.00 0.00 -1.66 -2.11 0.00 0.00 177.26 173.49 3ab4 s TRP 335 N 0.80 2.60 -0.04 1.20 -2.14 -1.26 -4.93 118.94 115.16 3ab4 s TRP 335 Ca 0.00 -0.54 -0.19 0.00 2.66 0.00 0.00 56.10 58.03 3ab4 s TRP 335 Cb 0.00 -2.10 -0.32 0.00 -3.10 0.00 0.00 33.47 27.95 3ab4 s TRP 335 CO 0.00 -0.07 0.85 1.79 -2.66 0.00 0.00 176.95 176.86 3ab4 h THR 336 N 1.11 1.35 -2.61 0.66 1.35 -1.25 -3.45 112.91 110.07 3ab4 h THR 336 Ca -0.41 -2.55 0.02 0.00 -0.55 0.00 0.00 66.41 62.92 3ab4 h THR 336 Cb 1.27 3.07 -0.14 0.00 -1.73 0.00 0.00 68.15 70.61 3ab4 h THR 336 CO 0.61 0.74 0.31 0.21 -0.25 0.00 0.00 175.52 177.14 3ab4 s ASN 337 N -7.15 -0.50 -0.12 5.36 2.47 -1.12 -4.99 114.94 108.89 3ab4 s ASN 337 Ca -0.14 0.08 0.01 0.00 0.42 0.00 0.00 52.86 53.24 3ab4 s ASN 337 Cb 0.02 0.51 0.02 0.00 -1.45 0.00 0.00 41.25 40.35 3ab4 s ASN 337 CO 0.85 -0.80 -0.14 0.54 -3.72 0.00 0.00 177.10 173.83 3ab4 s VAL 338 N -3.20 1.45 0.13 -5.21 0.11 -1.26 0.12 120.40 112.55 3ab4 s VAL 338 Ca 0.01 -0.59 0.05 0.00 -2.93 0.00 0.00 61.98 58.52 3ab4 s VAL 338 Cb -0.01 -1.35 -0.04 0.00 -1.53 0.00 0.00 36.38 33.45 3ab4 s VAL 338 CO -0.09 0.43 0.05 -0.76 -3.33 0.00 0.00 175.10 171.40 3ab4 s LEU 339 N 1.20 3.57 0.01 2.54 1.43 0.17 -4.92 118.68 122.68 3ab4 s LEU 339 Ca -0.02 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 3ab4 s LEU 339 Cb -0.14 -2.24 -0.01 0.00 0.03 0.00 0.00 46.19 43.83 3ab4 s LEU 339 CO -0.05 0.12 -0.09 -0.47 0.23 0.00 0.00 176.35 176.10 3ab4 s TYR 340 N -1.54 0.75 -0.28 0.29 5.04 -1.26 -1.32 117.35 119.03 3ab4 s TYR 340 Ca 0.28 -0.22 0.01 0.00 -2.44 0.00 0.00 57.07 54.71 3ab4 s TYR 340 Cb -0.11 -0.47 0.17 0.00 0.35 0.00 0.00 41.96 41.90 3ab4 s TYR 340 CO 0.20 -0.02 0.48 0.34 -1.34 0.00 0.00 175.55 175.22 3ab4 s ASP 341 N -0.53 -0.46 -0.38 4.32 3.68 -0.23 -5.00 116.67 118.07 3ab4 s ASP 341 Ca 0.01 0.12 0.06 0.00 2.13 0.00 0.00 52.55 54.87 3ab4 s ASP 341 Cb -0.05 1.53 0.52 0.00 -1.45 0.00 0.00 42.92 43.47 3ab4 s ASP 341 CO 0.00 -0.31 1.58 -0.90 0.13 0.00 0.00 175.17 175.67 3ab4 n ASP 342 N 5.39 3.86 -0.87 -0.34 5.68 -1.26 -0.81 116.55 128.19 3ab4 n ASP 342 Ca 0.00 -3.76 0.05 0.00 -0.50 0.00 0.00 54.79 50.58 3ab4 n ASP 342 Cb 0.51 -0.68 0.09 0.00 -1.14 0.00 0.00 41.12 39.90 3ab4 n ASP 342 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ab4 n GLN 343 N -1.03 0.65 -3.74 0.11 6.02 -1.26 -4.95 117.38 113.17 3ab4 n GLN 343 Ca 0.44 -2.30 -0.32 0.00 -0.01 0.00 0.00 57.00 54.80 3ab4 n GLN 343 Cb 1.07 -0.77 -0.05 0.00 1.02 0.00 0.00 30.24 31.51 3ab4 n GLN 343 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3ab4 s VAL 344 N -1.35 5.24 0.10 5.09 -7.23 -1.26 -1.25 120.40 119.74 3ab4 s VAL 344 Ca 0.29 0.00 0.04 0.00 -1.81 0.00 0.00 61.98 60.50 3ab4 s VAL 344 Cb 0.30 -3.61 -0.04 0.00 0.56 0.00 0.00 36.38 33.59 3ab4 s VAL 344 CO -0.09 0.15 -0.11 -0.83 -0.31 0.00 0.00 175.10 173.91 3ab4 s GLY 345 N -2.25 0.88 -0.18 2.32 0.00 -0.33 -4.55 107.32 103.22 3ab4 s GLY 345 Ca 0.36 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.89 3ab4 s GLY 345 CO 0.23 -1.26 -0.16 1.25 0.00 0.00 0.00 173.10 173.15 3ab4 s LYS 346 N -2.72 3.10 -0.05 2.90 2.20 -0.09 -1.30 119.74 123.78 3ab4 s LYS 346 Ca 0.06 -0.78 0.06 0.00 -0.36 0.00 0.00 55.97 54.94 3ab4 s LYS 346 Cb -0.04 -2.65 -0.02 0.00 -1.51 0.00 0.00 37.83 33.62 3ab4 s LYS 346 CO 0.01 -0.16 -0.23 0.54 -0.36 0.00 0.00 175.35 175.15 3ab4 s VAL 347 N 1.22 2.30 0.05 4.02 0.11 -0.75 -1.37 120.40 125.98 3ab4 s VAL 347 Ca 0.03 -0.99 0.01 0.00 -2.93 0.00 0.00 61.98 58.10 3ab4 s VAL 347 Cb -0.14 -1.85 -0.03 0.00 -1.53 0.00 0.00 36.38 32.84 3ab4 s VAL 347 CO -0.08 0.57 -0.05 -0.44 -3.33 0.00 0.00 175.10 171.77 3ab4 s SER 348 N -0.34 0.65 -0.07 3.54 0.01 0.23 -1.56 113.70 116.16 3ab4 s SER 348 Ca 0.02 -0.69 0.04 0.00 1.31 0.00 0.00 55.95 56.62 3ab4 s SER 348 Cb -0.12 0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 3ab4 s SER 348 CO 0.02 -0.35 -0.17 -0.22 0.41 0.00 0.00 173.24 172.93 3ab4 s LEU 349 N -2.03 2.53 0.01 2.44 2.96 0.27 -1.31 118.68 123.55 3ab4 s LEU 349 Ca -0.05 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 53.58 3ab4 s LEU 349 Cb -0.04 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.12 3ab4 s LEU 349 CO -0.03 0.28 -0.12 0.68 -1.32 0.00 0.00 176.35 175.83 3ab4 s VAL 350 N -0.32 0.97 0.00 1.68 -7.23 -0.67 -1.00 120.40 113.83 3ab4 s VAL 350 Ca 0.02 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.53 3ab4 s VAL 350 Cb -0.13 -0.84 0.00 0.00 0.56 0.00 0.00 36.38 35.97 3ab4 s VAL 350 CO 0.02 0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 3ab4 n GLY 351 N 2.50 1.96 0.35 2.32 0.00 -0.66 -0.10 105.19 111.56 3ab4 n GLY 351 Ca -0.15 0.12 0.07 0.00 0.00 0.00 0.00 46.02 46.07 3ab4 n GLY 351 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ab4 h ALA 352 N 0.00 1.77 -1.06 4.61 0.00 -1.81 -2.78 119.26 119.98 3ab4 h ALA 352 Ca 0.00 -0.02 0.29 0.00 0.00 0.00 0.00 54.91 55.19 3ab4 h ALA 352 Cb 0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 17.79 17.51 3ab4 h ALA 352 CO 0.00 0.12 0.66 0.78 0.00 0.00 0.00 179.25 180.80 3ab4 h GLY 353 N 0.67 1.57 2.00 0.00 0.00 -1.53 -1.29 103.07 104.49 3ab4 h GLY 353 Ca 0.29 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3ab4 h GLY 353 CO -0.09 -0.27 0.00 1.15 0.00 0.00 0.00 176.54 177.33 3ab4 n MET 354 N -4.78 0.16 -0.27 4.80 3.85 -1.05 -3.63 117.12 116.19 3ab4 n MET 354 Ca 0.29 0.16 -0.05 0.00 -1.00 0.00 0.00 57.70 57.09 3ab4 n MET 354 Cb 0.94 -1.69 0.06 0.00 -1.05 0.00 0.00 33.22 31.48 3ab4 n MET 354 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 3ab4 h LYS 355 N 0.00 1.00 0.00 3.17 3.64 -1.37 -3.23 116.57 119.78 3ab4 h LYS 355 Ca 0.00 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3ab4 h LYS 355 Cb 0.61 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3ab4 h LYS 355 CO 0.00 0.71 -0.16 -1.13 -2.27 0.00 0.00 179.45 176.60 3ab4 n SER 356 N -4.51 2.02 -4.29 4.20 3.41 -1.26 -4.99 113.62 108.21 3ab4 n SER 356 Ca 0.07 -3.15 -0.35 0.00 -0.26 0.00 0.00 58.87 55.18 3ab4 n SER 356 Cb 0.06 -0.43 -0.14 0.00 -0.26 0.00 0.00 64.21 63.44 3ab4 n SER 356 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3ab4 s HIS 357 N -2.68 2.96 0.25 7.33 2.46 -1.22 -5.02 115.29 119.36 3ab4 s HIS 357 Ca 0.31 -1.04 0.24 0.00 0.47 0.00 0.00 55.06 55.04 3ab4 s HIS 357 Cb 0.28 -2.09 1.08 0.00 -0.13 0.00 0.00 32.58 31.71 3ab4 s HIS 357 CO 0.00 -0.58 1.90 -1.35 -2.47 0.00 0.00 174.74 172.24 3ab4 h PRO 358 N 8.10 0.00 0.00 2.88 0.11 -1.93 -3.33 132.00 137.82 3ab4 h PRO 358 Ca -0.41 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.65 3ab4 h PRO 358 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3ab4 h PRO 358 CO 0.60 0.21 -0.22 0.78 -0.21 0.00 0.00 178.00 179.16 3ab4 h GLY 359 N 1.60 0.00 0.82 -0.55 0.00 -1.95 -3.40 103.07 99.59 3ab4 h GLY 359 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 3ab4 h GLY 359 CO 0.03 0.00 0.02 -0.24 0.00 0.00 0.00 176.54 176.35 3ab4 h VAL 360 N 0.00 1.16 -0.88 4.60 3.04 -1.93 -2.46 116.25 119.78 3ab4 h VAL 360 Ca -0.00 -0.49 0.02 0.00 -1.01 0.00 0.00 66.70 65.22 3ab4 h VAL 360 Cb 0.47 1.39 -0.05 0.00 -2.01 0.00 0.00 31.29 31.09 3ab4 h VAL 360 CO 0.03 0.14 0.58 0.74 -1.01 0.00 0.00 177.57 178.04 3ab4 h THR 361 N -0.10 1.19 -0.73 3.17 2.02 -1.88 -0.70 112.91 115.88 3ab4 h THR 361 Ca 0.02 -0.40 0.04 0.00 0.77 0.00 0.00 66.41 66.84 3ab4 h THR 361 Cb 0.20 -0.07 -0.05 0.00 -1.74 0.00 0.00 68.15 66.49 3ab4 h THR 361 CO -0.00 0.21 0.45 0.00 0.37 0.00 0.00 175.52 176.55 3ab4 h ALA 362 N 1.34 0.97 -0.17 6.16 0.00 -1.75 -1.72 119.26 124.08 3ab4 h ALA 362 Ca 0.33 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.09 3ab4 h ALA 362 Cb -0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3ab4 h ALA 362 CO -0.09 0.19 -0.51 0.93 0.00 0.00 0.00 179.25 179.78 3ab4 h GLU 363 N 0.85 0.48 0.28 0.00 5.08 -0.90 -0.48 114.58 119.88 3ab4 h GLU 363 Ca 0.31 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3ab4 h GLU 363 Cb 0.09 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3ab4 h GLU 363 CO -0.14 0.87 -0.17 0.35 -1.00 0.00 0.00 179.01 178.93 3ab4 h PHE 364 N 0.38 -0.43 -0.22 4.33 3.57 -0.71 0.11 116.94 123.95 3ab4 h PHE 364 Ca 0.02 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3ab4 h PHE 364 Cb 1.02 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 3ab4 h PHE 364 CO 0.04 -0.26 0.03 0.52 -2.23 0.00 0.00 178.31 176.40 3ab4 h MET 365 N -0.43 0.37 -0.96 1.11 2.86 -1.29 -1.19 114.93 115.41 3ab4 h MET 365 Ca -0.03 -0.11 0.16 0.00 -2.06 0.00 0.00 59.70 57.66 3ab4 h MET 365 Cb 0.35 -0.04 -0.10 0.00 0.06 0.00 0.00 31.60 31.88 3ab4 h MET 365 CO 0.03 0.53 0.57 0.93 1.06 0.00 0.00 176.91 180.03 3ab4 h GLU 366 N 0.17 0.78 -0.69 1.72 5.08 -1.03 0.16 114.58 120.76 3ab4 h GLU 366 Ca 0.07 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 3ab4 h GLU 366 Cb 0.34 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 3ab4 h GLU 366 CO 0.01 0.51 0.19 0.00 -1.00 0.00 0.00 179.01 178.72 3ab4 h ALA 367 N 1.59 0.91 -0.44 3.43 0.00 -0.44 -2.61 119.26 121.69 3ab4 h ALA 367 Ca 0.52 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 3ab4 h ALA 367 Cb 0.70 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3ab4 h ALA 367 CO -0.34 0.61 0.23 1.37 0.00 0.00 0.00 179.25 181.12 3ab4 h LEU 368 N 1.02 0.56 0.23 0.00 -0.00 0.28 -3.24 115.31 114.17 3ab4 h LEU 368 Ca 0.22 -0.10 0.00 0.00 -0.00 0.00 0.00 57.88 58.00 3ab4 h LEU 368 Cb 0.34 -0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 40.83 3ab4 h LEU 368 CO -0.00 0.51 -0.25 -0.09 -0.00 0.00 0.00 178.44 178.60 3ab4 h ARG 369 N 0.57 -0.51 0.00 0.17 2.43 -0.63 -3.04 114.38 113.37 3ab4 h ARG 369 Ca 0.15 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3ab4 h ARG 369 Cb 0.08 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3ab4 h ARG 369 CO -0.02 -0.34 0.26 -0.44 -1.51 0.00 0.00 179.97 177.92 3ab4 h ASP 370 N -0.53 0.00 -3.68 -3.80 3.32 -1.49 -3.12 116.42 107.12 3ab4 h ASP 370 Ca -0.00 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.37 3ab4 h ASP 370 Cb 0.50 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 39.74 3ab4 h ASP 370 CO -0.07 0.00 -0.68 -0.69 -1.72 0.00 0.00 179.24 176.08 3ab4 s VAL 371 N -4.02 3.27 -0.01 -1.35 1.01 -1.15 -5.00 120.40 113.15 3ab4 s VAL 371 Ca -0.03 -1.17 -0.03 0.00 0.00 0.00 0.00 61.98 60.74 3ab4 s VAL 371 Cb 0.09 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 3ab4 s VAL 371 CO 0.28 -0.04 0.64 -3.20 0.00 0.00 0.00 175.10 172.78 3ab4 n ASN 372 N 4.71 -0.81 -4.03 3.32 5.15 -1.18 -4.75 115.26 117.67 3ab4 n ASN 372 Ca -0.14 -0.76 -0.31 0.00 -0.60 0.00 0.00 54.58 52.78 3ab4 n ASN 372 Cb 0.45 -0.08 -0.16 0.00 -0.53 0.00 0.00 39.78 39.45 3ab4 n ASN 372 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3ab4 s VAL 373 N 3.39 1.71 0.02 3.44 1.01 -1.21 -5.10 120.40 123.66 3ab4 s VAL 373 Ca 0.08 -0.89 -0.23 0.00 0.00 0.00 0.00 61.98 60.93 3ab4 s VAL 373 Cb 0.02 -1.68 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 3ab4 s VAL 373 CO 0.04 0.33 0.71 0.21 0.00 0.00 0.00 175.10 176.38 3ab4 s ASN 374 N 1.40 7.12 0.10 3.32 2.47 -1.26 -4.42 114.94 123.65 3ab4 s ASN 374 Ca 0.02 1.33 -0.28 0.00 0.42 0.00 0.00 52.86 54.35 3ab4 s ASN 374 Cb -0.15 -2.43 -0.06 0.00 -1.45 0.00 0.00 41.25 37.16 3ab4 s ASN 374 CO -0.10 0.03 0.89 -0.63 -3.72 0.00 0.00 177.10 173.57 3ab4 s ILE 375 N -0.00 4.55 -0.11 -5.21 -1.09 -1.26 -4.78 121.20 113.30 3ab4 s ILE 375 Ca 0.36 1.91 -0.05 0.00 -2.23 0.00 0.00 60.65 60.64 3ab4 s ILE 375 Cb -0.19 -4.25 -0.05 0.00 -1.58 0.00 0.00 42.46 36.39 3ab4 s ILE 375 CO 0.21 0.35 -0.14 -0.62 -1.23 0.00 0.00 174.94 173.51 3ab4 n GLU 376 N 2.67 0.24 -4.31 2.79 1.02 -0.92 -5.03 120.64 117.10 3ab4 n GLU 376 Ca 0.00 0.10 -0.22 0.00 -0.02 0.00 0.00 57.16 57.02 3ab4 n GLU 376 Cb 0.49 -0.93 -0.12 0.00 -0.02 0.00 0.00 31.44 30.87 3ab4 n GLU 376 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3ab4 s LEU 377 N -6.52 2.38 -0.03 -4.62 2.01 -1.18 -4.99 118.68 105.72 3ab4 s LEU 377 Ca -0.16 -0.79 0.05 0.00 0.01 0.00 0.00 54.13 53.25 3ab4 s LEU 377 Cb 0.06 -0.83 -0.01 0.00 0.01 0.00 0.00 46.19 45.42 3ab4 s LEU 377 CO 0.20 -0.00 -0.19 -0.63 1.01 0.00 0.00 176.35 176.73 3ab4 s ILE 378 N -1.70 1.56 0.14 -0.59 1.01 -1.26 -2.52 121.20 117.83 3ab4 s ILE 378 Ca 0.12 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 59.98 3ab4 s ILE 378 Cb -0.07 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 3ab4 s ILE 378 CO 0.05 0.44 -0.06 -0.55 0.00 0.00 0.00 174.94 174.83 3ab4 s SER 379 N -0.21 1.40 -0.28 3.58 0.15 0.69 -4.99 113.70 114.04 3ab4 s SER 379 Ca 0.01 -1.05 -0.17 0.00 0.70 0.00 0.00 55.95 55.44 3ab4 s SER 379 Cb -0.10 0.06 0.09 0.00 -1.71 0.00 0.00 66.02 64.36 3ab4 s SER 379 CO 0.01 -0.44 0.75 -0.89 1.20 0.00 0.00 173.24 173.86 3ab4 s THR 380 N -3.52 0.00 0.43 6.45 2.01 -1.26 -0.88 115.64 118.87 3ab4 s THR 380 Ca 0.17 0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.23 3ab4 s THR 380 Cb 0.05 -1.00 0.07 0.00 0.01 0.00 0.00 72.50 71.62 3ab4 s THR 380 CO -0.01 0.00 0.56 -1.54 -0.69 0.00 0.00 174.62 172.94 3ab4 n SER 381 N 4.01 1.69 0.27 3.53 3.41 -1.09 -4.99 113.62 120.45 3ab4 n SER 381 Ca -0.19 -2.19 0.13 0.00 -0.26 0.00 0.00 58.87 56.35 3ab4 n SER 381 Cb 0.58 -0.28 0.78 0.00 -0.26 0.00 0.00 64.21 65.04 3ab4 n SER 381 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3ab4 h GLU 382 N 0.00 0.00 0.00 4.33 4.81 -2.00 -3.10 114.58 118.62 3ab4 h GLU 382 Ca -0.21 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.98 3ab4 h GLU 382 Cb 0.94 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.23 3ab4 h GLU 382 CO 0.31 0.08 -0.55 0.44 -0.73 0.00 0.00 179.01 178.56 3ab4 n ILE 383 N -3.80 1.54 -3.75 2.32 -5.35 -1.26 -4.07 119.36 104.98 3ab4 n ILE 383 Ca -0.02 -2.41 -0.13 0.00 -0.27 0.00 0.00 62.75 59.92 3ab4 n ILE 383 Cb 0.17 0.08 -0.11 0.00 -1.74 0.00 0.00 39.64 38.04 3ab4 n ILE 383 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3ab4 s ARG 384 N -2.27 0.35 -0.17 6.28 3.52 -1.17 -1.65 118.95 123.84 3ab4 s ARG 384 Ca 0.34 0.50 -0.03 0.00 -0.13 0.00 0.00 55.73 56.42 3ab4 s ARG 384 Cb 0.34 0.12 -0.02 0.00 -1.56 0.00 0.00 34.95 33.83 3ab4 s ARG 384 CO -0.07 -0.08 -0.07 0.42 -0.81 0.00 0.00 175.30 174.69 3ab4 s ILE 385 N 0.48 3.40 0.02 4.11 1.01 -0.17 -2.68 121.20 127.37 3ab4 s ILE 385 Ca -0.02 -0.51 0.07 0.00 0.00 0.00 0.00 60.65 60.18 3ab4 s ILE 385 Cb -0.04 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 3ab4 s ILE 385 CO -0.02 0.47 -0.22 -0.44 0.00 0.00 0.00 174.94 174.73 3ab4 s SER 386 N 0.82 2.56 -0.11 3.58 0.01 -0.06 -0.56 113.70 119.93 3ab4 s SER 386 Ca -0.02 -0.48 -0.04 0.00 1.31 0.00 0.00 55.95 56.72 3ab4 s SER 386 Cb -0.15 -0.24 0.06 0.00 0.21 0.00 0.00 66.02 65.90 3ab4 s SER 386 CO 0.01 0.21 0.19 -0.69 0.41 0.00 0.00 173.24 173.37 3ab4 s VAL 387 N -0.70 -0.30 0.03 3.43 1.01 -0.60 -0.22 120.40 123.04 3ab4 s VAL 387 Ca 0.08 0.28 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 3ab4 s VAL 387 Cb -0.09 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 3ab4 s VAL 387 CO 0.01 0.10 0.82 -0.76 0.00 0.00 0.00 175.10 175.27 3ab4 s LEU 388 N 2.33 4.42 0.00 3.92 1.43 -1.05 -1.81 118.68 127.92 3ab4 s LEU 388 Ca 0.03 1.49 0.03 0.00 -1.03 0.00 0.00 54.13 54.65 3ab4 s LEU 388 Cb -0.12 -3.32 -0.01 0.00 0.03 0.00 0.00 46.19 42.76 3ab4 s LEU 388 CO -0.07 -0.07 0.30 2.30 0.23 0.00 0.00 176.35 179.04 3ab4 n ILE 389 N 3.18 0.00 -2.06 -0.59 -5.35 -0.42 -2.17 119.36 111.94 3ab4 n ILE 389 Ca 0.00 -1.76 -0.41 0.00 -0.27 0.00 0.00 62.75 60.31 3ab4 n ILE 389 Cb 0.50 0.95 -0.02 0.00 -1.74 0.00 0.00 39.64 39.34 3ab4 n ILE 389 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 3ab4 s ARG 390 N -2.91 4.31 0.48 6.28 1.81 -1.26 -1.19 118.95 126.47 3ab4 s ARG 390 Ca 0.29 2.26 0.25 0.00 -1.72 0.00 0.00 55.73 56.81 3ab4 s ARG 390 Cb 0.01 -3.09 1.31 0.00 -0.45 0.00 0.00 34.95 32.73 3ab4 s ARG 390 CO 0.20 -0.30 1.87 1.05 -0.68 0.00 0.00 175.30 177.45 3ab4 h GLU 391 N 4.07 0.17 0.00 3.54 4.11 -1.44 -0.59 114.58 124.45 3ab4 h GLU 391 Ca -0.48 -0.01 -0.04 0.00 0.07 0.00 0.00 59.36 58.90 3ab4 h GLU 391 Cb 1.22 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 3ab4 h GLU 391 CO 0.70 0.11 -0.19 -0.44 0.07 0.00 0.00 179.01 179.27 3ab4 h ASP 392 N 0.18 0.00 0.25 3.06 5.19 -1.90 -2.78 116.42 120.40 3ab4 h ASP 392 Ca 0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.86 3ab4 h ASP 392 Cb 1.47 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.98 3ab4 h ASP 392 CO -0.09 0.19 -0.37 0.47 -3.12 0.00 0.00 179.24 176.32 3ab4 n ASP 393 N -4.04 1.04 -0.26 6.45 8.00 -0.23 -4.50 116.55 123.00 3ab4 n ASP 393 Ca -0.02 -0.84 0.04 0.00 0.71 0.00 0.00 54.79 54.68 3ab4 n ASP 393 Cb 0.27 0.24 0.18 0.00 -0.02 0.00 0.00 41.12 41.78 3ab4 n ASP 393 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3ab4 h LEU 394 N 1.05 0.41 0.13 0.64 5.85 -1.43 -1.50 115.31 120.46 3ab4 h LEU 394 Ca 0.00 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3ab4 h LEU 394 Cb 0.53 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3ab4 h LEU 394 CO 0.00 0.20 -0.06 0.44 -0.34 0.00 0.00 178.44 178.68 3ab4 h ASP 395 N 0.55 -0.15 -0.71 1.25 5.19 -1.81 -1.08 116.42 119.66 3ab4 h ASP 395 Ca 0.40 -0.39 0.10 0.00 -0.62 0.00 0.00 57.03 56.52 3ab4 h ASP 395 Cb 0.53 0.04 -0.07 0.00 0.18 0.00 0.00 39.33 40.00 3ab4 h ASP 395 CO -0.34 0.37 0.35 0.00 -3.12 0.00 0.00 179.24 176.49 3ab4 h ALA 396 N 0.01 0.98 0.11 3.45 0.00 -1.86 -1.14 119.26 120.81 3ab4 h ALA 396 Ca -0.02 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3ab4 h ALA 396 Cb 0.53 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3ab4 h ALA 396 CO 0.03 -0.06 -0.34 0.00 0.00 0.00 0.00 179.25 178.88 3ab4 h ALA 397 N 1.44 -0.58 -0.90 0.00 0.00 -0.93 0.51 119.26 118.80 3ab4 h ALA 397 Ca 0.35 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.26 3ab4 h ALA 397 Cb 0.39 0.56 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 3ab4 h ALA 397 CO -0.28 -0.89 0.59 0.00 0.00 0.00 0.00 179.25 178.68 3ab4 h ALA 398 N 0.07 1.46 -0.20 0.00 0.00 -1.02 -0.71 119.26 118.86 3ab4 h ALA 398 Ca 0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3ab4 h ALA 398 Cb 0.60 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3ab4 h ALA 398 CO -0.21 0.44 -0.03 -0.09 0.00 0.00 0.00 179.25 179.37 3ab4 h ARG 399 N 1.09 0.37 -0.38 0.00 2.43 0.17 0.64 114.38 118.69 3ab4 h ARG 399 Ca 0.37 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.32 3ab4 h ARG 399 Cb 0.08 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3ab4 h ARG 399 CO -0.12 0.60 -0.12 0.00 -1.51 0.00 0.00 179.97 178.82 3ab4 h ALA 400 N 0.76 0.53 -0.89 2.80 0.00 0.07 -2.25 119.26 120.29 3ab4 h ALA 400 Ca 0.05 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3ab4 h ALA 400 Cb 0.45 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3ab4 h ALA 400 CO 0.02 0.41 0.49 1.25 0.00 0.00 0.00 179.25 181.42 3ab4 h LEU 401 N 0.56 1.10 0.67 0.00 5.85 -0.99 -1.98 115.31 120.52 3ab4 h LEU 401 Ca 0.09 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 3ab4 h LEU 401 Cb 0.64 -0.28 0.01 0.00 0.37 0.00 0.00 40.66 41.40 3ab4 h LEU 401 CO 0.04 0.88 -0.32 -0.74 -0.34 0.00 0.00 178.44 177.96 3ab4 h HIS 402 N 1.24 -0.83 -0.99 1.25 2.76 -0.80 -3.16 115.15 114.61 3ab4 h HIS 402 Ca 0.31 -0.02 0.19 0.00 -2.20 0.00 0.00 60.37 58.65 3ab4 h HIS 402 Cb 0.02 0.28 -0.11 0.00 1.55 0.00 0.00 27.41 29.15 3ab4 h HIS 402 CO 0.01 -0.48 0.59 0.93 -1.30 0.00 0.00 177.93 177.68 3ab4 h GLU 403 N -1.10 0.73 -0.76 5.26 5.08 -1.30 -2.51 114.58 119.99 3ab4 h GLU 403 Ca -0.09 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 3ab4 h GLU 403 Cb 0.73 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 3ab4 h GLU 403 CO 0.15 0.48 0.34 0.37 -1.00 0.00 0.00 179.01 179.35 3ab4 h GLN 404 N 0.75 1.10 -0.02 2.33 5.75 -1.34 -3.24 115.11 120.44 3ab4 h GLN 404 Ca 0.57 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.90 3ab4 h GLN 404 Cb 0.88 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 29.24 3ab4 h GLN 404 CO -0.38 0.87 -0.26 1.19 -2.65 0.00 0.00 178.83 177.60 3ab4 n PHE 405 N -4.37 0.00 1.99 3.99 3.72 -1.01 -5.13 117.46 116.65 3ab4 n PHE 405 Ca 0.07 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.63 3ab4 n PHE 405 Cb 0.15 0.00 0.94 0.00 -0.94 0.00 0.00 39.48 39.63 3ab4 n PHE 405 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75