#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hj4 s LYS 18 N 0.00 2.86 -0.14 -0.41 -0.14 -1.26 -2.45 119.74 118.20 1hj4 s LYS 18 Ca 0.00 -0.84 -0.29 0.00 -1.36 0.00 0.00 55.97 53.48 1hj4 s LYS 18 Cb 0.00 -2.64 -0.05 0.00 -1.68 0.00 0.00 37.83 33.46 1hj4 s LYS 18 CO 0.00 0.50 1.79 0.99 -0.76 0.00 0.00 175.35 177.87 1hj4 s THR 19 N -1.65 3.44 0.54 2.17 2.01 -1.26 -4.58 115.64 116.30 1hj4 s THR 19 Ca 0.30 0.50 0.05 0.00 0.31 0.00 0.00 61.69 62.86 1hj4 s THR 19 Cb -0.11 -3.42 0.04 0.00 0.01 0.00 0.00 72.50 69.02 1hj4 s THR 19 CO 0.23 -0.15 0.40 -0.60 -0.69 0.00 0.00 174.62 173.81 1hj4 s ARG 20 N 4.79 2.26 0.19 4.92 3.52 -1.26 -4.95 118.95 128.42 1hj4 s ARG 20 Ca 0.80 -2.01 0.25 0.00 -0.13 0.00 0.00 55.73 54.64 1hj4 s ARG 20 Cb -0.31 -2.10 0.62 0.00 -1.56 0.00 0.00 34.95 31.60 1hj4 s ARG 20 CO 0.33 -0.61 1.61 1.79 -0.81 0.00 0.00 175.30 177.61 1hj4 h THR 21 N 0.76 0.00 -0.01 4.11 1.35 -1.92 -3.33 112.91 113.87 1hj4 h THR 21 Ca -0.37 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 1hj4 h THR 21 Cb 1.30 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1hj4 h THR 21 CO 0.57 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.94 1hj4 n ASP 22 N -2.26 2.29 -0.80 5.36 5.75 -1.25 -4.49 116.55 121.14 1hj4 n ASP 22 Ca 0.05 -2.74 0.06 0.00 -0.01 0.00 0.00 54.79 52.14 1hj4 n ASP 22 Cb 0.44 -0.30 0.14 0.00 -1.03 0.00 0.00 41.12 40.37 1hj4 n ASP 22 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1hj4 n ASN 23 N -1.10 1.48 -0.03 -1.12 6.94 -1.25 -4.61 115.26 115.57 1hj4 n ASN 23 Ca 0.11 -3.17 0.06 0.00 -0.02 0.00 0.00 54.58 51.56 1hj4 n ASN 23 Cb 0.52 -0.44 -0.06 0.00 -2.36 0.00 0.00 39.78 37.45 1hj4 n ASN 23 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1hj4 n ARG 24 N -0.62 2.75 -1.45 -3.83 1.74 -1.26 -4.52 116.66 109.47 1hj4 n ARG 24 Ca 0.14 -0.07 -0.35 0.00 -0.77 0.00 0.00 57.85 56.80 1hj4 n ARG 24 Cb 0.82 -1.10 0.06 0.00 -1.02 0.00 0.00 32.46 31.22 1hj4 n ARG 24 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1hj4 n TYR 25 N -1.18 3.02 -4.11 -1.55 9.36 -1.26 -3.38 117.16 118.06 1hj4 n TYR 25 Ca 0.03 -2.76 -0.35 0.00 3.32 0.00 0.00 57.90 58.13 1hj4 n TYR 25 Cb 0.20 -1.36 -0.07 0.00 -0.63 0.00 0.00 39.34 37.48 1hj4 n TYR 25 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1hj4 s GLU 26 N -3.70 3.20 0.09 2.98 0.41 -1.26 -5.04 118.70 115.37 1hj4 s GLU 26 Ca 0.59 -0.30 -0.36 0.00 -0.41 0.00 0.00 54.97 54.49 1hj4 s GLU 26 Cb 0.47 -2.98 -0.17 0.00 -1.78 0.00 0.00 34.13 29.67 1hj4 s GLU 26 CO -0.12 0.73 1.17 -2.30 -0.49 0.00 0.00 175.26 174.25 1hj4 n PRO 27 N 1.89 0.74 -3.81 0.39 -0.02 -1.26 -4.92 135.00 128.01 1hj4 n PRO 27 Ca -0.18 0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 61.20 1hj4 n PRO 27 Cb 0.54 -1.79 -0.13 0.00 -0.02 0.00 0.00 33.50 32.10 1hj4 n PRO 27 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1hj4 s SER 28 N 0.13 5.09 -1.26 2.55 0.15 -1.26 -3.27 113.70 115.83 1hj4 s SER 28 Ca 0.82 -1.05 -0.06 0.00 0.70 0.00 0.00 55.95 56.36 1hj4 s SER 28 Cb -1.02 -1.82 0.17 0.00 -1.71 0.00 0.00 66.02 61.64 1hj4 s SER 28 CO 0.52 -0.27 2.09 0.18 1.20 0.00 0.00 173.24 176.96 1hj4 n LEU 29 N 4.77 7.41 0.14 3.45 4.32 -0.93 -4.69 117.00 131.47 1hj4 n LEU 29 Ca -0.13 -4.89 0.12 0.00 -0.02 0.00 0.00 56.01 51.08 1hj4 n LEU 29 Cb 0.45 -1.37 0.24 0.00 -1.62 0.00 0.00 43.42 41.13 1hj4 n LEU 29 CO 0.30 1.82 0.69 -2.24 -1.22 0.00 0.00 177.39 176.73 1hj4 h ASP 30 N 4.99 0.00 0.14 -1.43 3.04 -1.87 -0.69 116.42 120.60 1hj4 h ASP 30 Ca 0.55 -0.03 -0.22 0.00 -3.24 0.00 0.00 57.03 54.08 1hj4 h ASP 30 Cb 0.43 0.00 0.02 0.00 -1.04 0.00 0.00 39.33 38.75 1hj4 h ASP 30 CO 1.48 0.02 -0.94 -1.13 -2.04 0.00 0.00 179.24 176.63 1hj4 h ASN 31 N 0.00 0.58 0.36 4.15 -1.24 -1.85 -3.25 115.58 114.34 1hj4 h ASN 31 Ca 0.00 -0.91 -0.06 0.00 0.71 0.00 0.00 56.30 56.04 1hj4 h ASN 31 Cb 0.86 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 39.71 1hj4 h ASN 31 CO 0.00 1.45 -0.31 0.25 -1.29 0.00 0.00 177.43 177.53 1hj4 h LEU 32 N -0.19 0.00 -0.77 0.34 5.85 -1.73 -1.56 115.31 117.26 1hj4 h LEU 32 Ca -0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1hj4 h LEU 32 Cb 1.71 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.74 1hj4 h LEU 32 CO 0.18 0.31 0.00 0.00 -0.34 0.00 0.00 178.44 178.59 1hj4 h ALA 33 N 1.69 1.00 0.00 1.25 0.00 -1.17 -2.65 119.26 119.38 1hj4 h ALA 33 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1hj4 h ALA 33 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1hj4 h ALA 33 CO 0.04 0.00 -0.01 1.04 0.00 0.00 0.00 179.25 180.32 1hj4 n GLN 34 N -2.31 0.06 -2.80 0.00 6.02 -0.59 -4.59 117.38 113.18 1hj4 n GLN 34 Ca 0.02 0.05 -0.40 0.00 -0.01 0.00 0.00 57.00 56.66 1hj4 n GLN 34 Cb 0.23 -1.57 -0.06 0.00 1.02 0.00 0.00 30.24 29.87 1hj4 n GLN 34 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1hj4 s GLN 35 N -3.02 4.77 0.18 -1.09 -0.21 -1.00 -5.04 119.66 114.24 1hj4 s GLN 35 Ca 0.13 1.40 -0.28 0.00 0.02 0.00 0.00 55.36 56.64 1hj4 s GLN 35 Cb 0.17 -3.29 -0.08 0.00 1.00 0.00 0.00 33.01 30.82 1hj4 s GLN 35 CO 0.55 0.50 0.87 -0.51 -2.12 0.00 0.00 175.29 174.57 1hj4 s ASP 36 N -1.03 7.50 0.26 5.90 1.11 -1.26 -4.96 116.67 124.19 1hj4 s ASP 36 Ca 0.40 1.78 0.11 0.00 0.18 0.00 0.00 52.55 55.02 1hj4 s ASP 36 Cb -0.25 -2.55 -0.05 0.00 1.07 0.00 0.00 42.92 41.14 1hj4 s ASP 36 CO 0.30 0.14 -0.17 0.68 1.18 0.00 0.00 175.17 177.30 1hj4 s VAL 37 N -0.93 2.24 0.23 -1.27 -7.23 -1.26 -5.13 120.40 107.05 1hj4 s VAL 37 Ca 0.40 -2.33 -0.15 0.00 -1.81 0.00 0.00 61.98 58.08 1hj4 s VAL 37 Cb -0.24 -2.26 -0.08 0.00 0.56 0.00 0.00 36.38 34.36 1hj4 s VAL 37 CO 0.29 -0.43 0.64 0.00 -0.31 0.00 0.00 175.10 175.29 1hj4 s ALA 38 N -2.66 3.46 -0.13 1.32 0.00 -1.26 -4.77 121.76 117.73 1hj4 s ALA 38 Ca 0.28 -0.04 -0.28 0.00 0.00 0.00 0.00 51.96 51.92 1hj4 s ALA 38 Cb -0.03 -2.65 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 1hj4 s ALA 38 CO 0.13 0.40 0.94 0.00 0.00 0.00 0.00 175.76 177.23 1hj4 s ALA 39 N -1.70 3.44 0.75 0.00 0.00 -1.26 -4.98 121.76 118.02 1hj4 s ALA 39 Ca 0.46 0.26 -0.12 0.00 0.00 0.00 0.00 51.96 52.56 1hj4 s ALA 39 Cb -0.13 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.67 1hj4 s ALA 39 CO 0.19 -0.61 1.10 -1.25 0.00 0.00 0.00 175.76 175.19 1hj4 s PRO 40 N 2.04 2.44 0.63 0.00 0.04 -1.26 -5.02 135.00 133.88 1hj4 s PRO 40 Ca 0.45 0.51 -0.10 0.00 0.04 0.00 0.00 61.00 61.89 1hj4 s PRO 40 Cb -0.18 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 1hj4 s PRO 40 CO 0.16 -1.34 1.02 0.20 0.04 0.00 0.00 177.00 177.08 1hj4 s GLY 41 N -4.18 1.63 -0.09 0.56 0.00 -1.26 -4.70 107.32 99.29 1hj4 s GLY 41 Ca 0.60 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 45.11 1hj4 s GLY 41 CO 0.53 0.06 -0.17 0.00 0.00 0.00 0.00 173.10 173.52 1hj4 s ALA 42 N -3.18 2.50 0.93 3.20 0.00 -1.26 -4.69 121.76 119.25 1hj4 s ALA 42 Ca 0.55 -0.95 -0.13 0.00 0.00 0.00 0.00 51.96 51.43 1hj4 s ALA 42 Cb -0.11 -1.01 0.15 0.00 0.00 0.00 0.00 23.12 22.15 1hj4 s ALA 42 CO 0.52 0.36 1.15 -1.25 0.00 0.00 0.00 175.76 176.54 1hj4 s PRO 43 N -0.01 1.01 0.30 0.00 0.04 -1.26 -4.91 135.00 130.17 1hj4 s PRO 43 Ca -0.05 0.20 -0.30 0.00 0.04 0.00 0.00 61.00 60.89 1hj4 s PRO 43 Cb -0.14 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.44 1hj4 s PRO 43 CO 0.04 -2.27 1.49 -1.91 0.04 0.00 0.00 177.00 174.39 1hj4 n GLU 44 N -3.80 2.46 -0.26 4.56 0.00 -1.26 -2.13 120.64 120.21 1hj4 n GLU 44 Ca 0.08 0.87 0.00 0.00 0.00 0.00 0.00 57.16 58.11 1hj4 n GLU 44 Cb 0.59 -2.59 0.00 0.00 0.00 0.00 0.00 31.44 29.45 1hj4 n GLU 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1hj4 n GLY 45 N 1.67 0.76 3.00 8.31 0.00 -1.26 -5.04 105.19 112.62 1hj4 n GLY 45 Ca 0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 1hj4 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hj4 s VAL 46 N -2.61 0.57 -0.07 1.61 1.01 -0.91 -5.08 120.40 114.92 1hj4 s VAL 46 Ca 0.00 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.51 1hj4 s VAL 46 Cb 0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 1hj4 s VAL 46 CO 0.00 0.13 0.27 -0.44 0.00 0.00 0.00 175.10 175.06 1hj4 s SER 47 N -0.26 6.58 0.43 3.32 0.01 -1.26 -4.46 113.70 118.06 1hj4 s SER 47 Ca 0.02 0.69 -0.22 0.00 1.31 0.00 0.00 55.95 57.74 1hj4 s SER 47 Cb -0.03 -2.16 -0.09 0.00 0.21 0.00 0.00 66.02 63.95 1hj4 s SER 47 CO -0.00 0.35 1.04 0.00 0.41 0.00 0.00 173.24 175.03 1hj4 s ALA 48 N -0.93 3.00 -0.05 1.44 0.00 -1.26 -4.93 121.76 119.04 1hj4 s ALA 48 Ca 0.19 0.65 -0.10 0.00 0.00 0.00 0.00 51.96 52.69 1hj4 s ALA 48 Cb -0.14 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 1hj4 s ALA 48 CO 0.08 -0.23 0.27 -0.51 0.00 0.00 0.00 175.76 175.37 1hj4 s LEU 49 N -3.00 4.42 1.09 0.00 1.43 -1.26 -5.08 118.68 116.28 1hj4 s LEU 49 Ca 0.62 0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 54.28 1hj4 s LEU 49 Cb -0.19 -2.39 0.24 0.00 0.03 0.00 0.00 46.19 43.88 1hj4 s LEU 49 CO 0.24 0.35 1.06 -0.94 0.23 0.00 0.00 176.35 177.28 1hj4 s SER 50 N -1.17 1.73 0.12 2.29 1.04 -1.26 -4.56 113.70 111.89 1hj4 s SER 50 Ca 0.21 1.39 -0.31 0.00 0.48 0.00 0.00 55.95 57.71 1hj4 s SER 50 Cb -0.14 -2.12 -0.09 0.00 0.10 0.00 0.00 66.02 63.77 1hj4 s SER 50 CO 0.10 -3.72 1.57 -0.78 0.98 0.00 0.00 173.24 171.39 1hj4 h ASP 51 N -2.29 -1.47 -0.39 7.02 3.58 -1.97 0.38 116.42 121.27 1hj4 h ASP 51 Ca -0.58 0.18 0.01 0.00 0.42 0.00 0.00 57.03 57.05 1hj4 h ASP 51 Cb 1.33 0.58 -0.02 0.00 1.72 0.00 0.00 39.33 42.94 1hj4 h ASP 51 CO 0.53 -0.47 0.26 0.00 -2.88 0.00 0.00 179.24 176.68 1hj4 h ALA 52 N -0.13 0.50 -0.31 -0.78 0.00 -1.97 -1.48 119.26 115.09 1hj4 h ALA 52 Ca 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1hj4 h ALA 52 Cb 0.67 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1hj4 h ALA 52 CO -0.38 -0.05 0.14 1.96 0.00 0.00 0.00 179.25 180.92 1hj4 h GLN 53 N 0.52 0.29 -0.36 0.00 4.20 -1.79 0.70 115.11 118.68 1hj4 h GLN 53 Ca 0.14 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.81 1hj4 h GLN 53 Cb -0.06 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1hj4 h GLN 53 CO -0.03 0.20 0.12 -0.92 -0.67 0.00 0.00 178.83 177.52 1hj4 h TYR 54 N 0.30 0.58 -0.71 2.96 3.20 0.01 -1.54 116.97 121.77 1hj4 h TYR 54 Ca 0.13 -0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 1hj4 h TYR 54 Cb 0.06 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 1hj4 h TYR 54 CO -0.11 0.55 0.26 -0.91 -1.64 0.00 0.00 178.16 176.31 1hj4 h ASN 55 N 0.44 1.00 -0.47 -2.11 2.35 -1.13 0.23 115.58 115.89 1hj4 h ASN 55 Ca 0.12 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1hj4 h ASN 55 Cb 0.23 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1hj4 h ASN 55 CO -0.01 0.92 0.30 -0.08 -1.65 0.00 0.00 177.43 176.91 1hj4 h GLU 56 N 1.03 0.62 -0.43 0.81 4.81 -0.71 0.88 114.58 121.60 1hj4 h GLU 56 Ca 0.23 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.29 1hj4 h GLU 56 Cb 0.24 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1hj4 h GLU 56 CO -0.02 0.43 -0.25 0.00 -0.73 0.00 0.00 179.01 178.45 1hj4 h ALA 57 N 1.15 0.76 -0.47 2.92 0.00 -0.98 -2.37 119.26 120.26 1hj4 h ALA 57 Ca 0.17 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1hj4 h ALA 57 Cb -0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1hj4 h ALA 57 CO -0.03 0.66 0.14 -0.97 0.00 0.00 0.00 179.25 179.04 1hj4 h ASN 58 N 0.76 0.70 -0.53 0.00 -1.24 -0.10 0.11 115.58 115.28 1hj4 h ASN 58 Ca 0.10 -0.21 0.03 0.00 0.71 0.00 0.00 56.30 56.93 1hj4 h ASN 58 Cb 0.80 -0.18 -0.04 0.00 0.73 0.00 0.00 38.32 39.63 1hj4 h ASN 58 CO 0.07 0.73 0.30 0.11 -1.29 0.00 0.00 177.43 177.34 1hj4 h LYS 59 N 0.63 0.57 -0.48 6.67 6.56 -0.78 0.30 116.57 130.03 1hj4 h LYS 59 Ca 0.15 -0.03 -0.02 0.00 -1.06 0.00 0.00 60.65 59.69 1hj4 h LYS 59 Cb 0.29 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.80 1hj4 h LYS 59 CO -0.00 0.37 0.21 0.82 -2.06 0.00 0.00 179.45 178.79 1hj4 h ILE 60 N 0.58 1.20 -0.15 1.86 2.04 -1.16 -1.64 117.51 120.24 1hj4 h ILE 60 Ca 0.22 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.50 1hj4 h ILE 60 Cb 0.07 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1hj4 h ILE 60 CO -0.12 0.22 0.08 0.22 0.00 0.00 0.00 178.15 178.55 1hj4 h TYR 61 N 0.63 0.16 -0.38 1.37 3.20 -0.27 -0.21 116.97 121.46 1hj4 h TYR 61 Ca 0.16 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.94 1hj4 h TYR 61 Cb 0.15 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 1hj4 h TYR 61 CO -0.00 0.10 -0.16 0.74 -1.64 0.00 0.00 178.16 177.19 1hj4 h PHE 62 N 0.18 0.77 0.10 -3.82 -1.00 -0.90 0.40 116.94 112.67 1hj4 h PHE 62 Ca 0.06 -0.15 -0.00 0.00 2.81 0.00 0.00 57.97 60.68 1hj4 h PHE 62 Cb -0.01 -0.19 0.00 0.00 3.61 0.00 0.00 35.95 39.36 1hj4 h PHE 62 CO -0.08 0.81 -0.05 0.93 -1.61 0.00 0.00 178.31 178.32 1hj4 h GLU 63 N 0.63 -0.13 -0.08 1.51 5.08 -1.10 -2.48 114.58 118.01 1hj4 h GLU 63 Ca 0.10 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1hj4 h GLU 63 Cb 0.62 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1hj4 h GLU 63 CO 0.04 0.39 0.00 2.89 -1.00 0.00 0.00 179.01 181.33 1hj4 n ARG 64 N -4.86 2.00 0.00 2.33 1.85 -0.11 -4.27 116.66 113.61 1hj4 n ARG 64 Ca -0.08 -2.45 0.00 0.00 -1.00 0.00 0.00 57.85 54.32 1hj4 n ARG 64 Cb 0.29 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.21 1hj4 n ARG 64 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1hj4 h ALA 66 N 0.00 1.93 -0.65 0.00 0.00 -0.45 -2.47 119.26 117.63 1hj4 h ALA 66 Ca 0.00 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1hj4 h ALA 66 Cb 0.02 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 1hj4 h ALA 66 CO 0.00 -0.17 0.24 0.78 0.00 0.00 0.00 179.25 180.10 1hj4 h GLY 67 N 0.00 0.92 0.67 0.00 0.00 -1.81 0.52 103.07 103.38 1hj4 h GLY 67 Ca 0.06 -0.12 -0.33 0.00 0.00 0.00 0.00 47.33 46.95 1hj4 h GLY 67 CO -0.00 -0.05 -1.94 0.00 0.00 0.00 0.00 176.54 174.55 1hj4 n HIS 69 N -3.08 0.00 0.00 0.00 8.25 -0.96 -0.61 115.22 118.83 1hj4 n HIS 69 Ca -0.24 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 1hj4 n HIS 69 Cb 1.07 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.85 1hj4 n HIS 69 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hj4 n GLY 70 N 1.50 1.66 0.21 -1.41 0.00 0.18 -0.79 105.19 106.53 1hj4 n GLY 70 Ca -0.02 -1.68 0.05 0.00 0.00 0.00 0.00 46.02 44.37 1hj4 n GLY 70 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1hj4 h VAL 71 N 0.00 1.10 -0.01 1.61 -1.51 -1.95 -1.36 116.25 114.13 1hj4 h VAL 71 Ca 0.00 -1.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.47 1hj4 h VAL 71 Cb 0.00 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 1hj4 h VAL 71 CO 0.00 0.28 -0.26 0.18 -1.23 0.00 0.00 177.57 176.54 1hj4 n LEU 72 N -4.05 0.97 -1.55 4.19 4.77 -1.26 -4.95 117.00 115.12 1hj4 n LEU 72 Ca -0.02 -0.23 -0.14 0.00 -0.03 0.00 0.00 56.01 55.59 1hj4 n LEU 72 Cb 0.34 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.29 1hj4 n LEU 72 CO 0.37 0.18 -0.18 0.54 -1.33 0.00 0.00 177.39 176.97 1hj4 n ARG 73 N -0.71 -1.11 -0.07 3.23 1.74 -0.51 -4.84 116.66 114.39 1hj4 n ARG 73 Ca 0.12 0.71 0.12 0.00 -0.77 0.00 0.00 57.85 58.03 1hj4 n ARG 73 Cb 0.34 -4.97 0.38 0.00 -1.02 0.00 0.00 32.46 27.19 1hj4 n ARG 73 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1hj4 n LYS 74 N -2.37 1.84 0.00 5.56 4.76 -1.15 -0.23 118.16 126.57 1hj4 n LYS 74 Ca -0.16 -1.25 0.00 0.00 -2.87 0.00 0.00 58.31 54.02 1hj4 n LYS 74 Cb 0.61 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 32.37 1hj4 n LYS 74 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hj4 n GLY 75 N 1.20 -1.38 0.00 0.72 0.00 0.03 -4.27 105.19 101.48 1hj4 n GLY 75 Ca 0.17 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1hj4 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hj4 n ALA 76 N -0.07 0.00 0.10 4.61 0.00 -0.70 -4.80 120.51 119.65 1hj4 n ALA 76 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1hj4 n ALA 76 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 1hj4 n ALA 76 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1hj4 h THR 77 N 0.00 1.58 -2.50 0.00 1.35 -1.68 -3.43 112.91 108.22 1hj4 h THR 77 Ca 0.00 -2.75 -0.50 0.00 -0.55 0.00 0.00 66.41 62.60 1hj4 h THR 77 Cb 0.00 2.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.89 1hj4 h THR 77 CO 0.00 0.79 -0.40 -0.83 -0.25 0.00 0.00 175.52 174.83 1hj4 s GLY 78 N -4.58 1.50 0.91 5.82 0.00 0.22 -5.05 107.32 106.15 1hj4 s GLY 78 Ca -0.00 -1.05 -0.12 0.00 0.00 0.00 0.00 44.72 43.55 1hj4 s GLY 78 CO 0.79 -1.04 1.09 -1.59 0.00 0.00 0.00 173.10 172.35 1hj4 s LYS 79 N -3.64 1.11 0.59 2.90 -2.85 -1.26 -4.39 119.74 112.20 1hj4 s LYS 79 Ca 0.36 0.77 -0.20 0.00 -1.00 0.00 0.00 55.97 55.89 1hj4 s LYS 79 Cb -0.10 -1.80 -0.03 0.00 -2.06 0.00 0.00 37.83 33.84 1hj4 s LYS 79 CO 0.30 -2.33 1.31 0.00 0.10 0.00 0.00 175.35 174.72 1hj4 s ALA 80 N -2.94 2.61 -0.20 0.59 0.00 -1.26 -4.29 121.76 116.27 1hj4 s ALA 80 Ca 0.64 1.23 0.17 0.00 0.00 0.00 0.00 51.96 54.00 1hj4 s ALA 80 Cb -0.18 -3.54 0.46 0.00 0.00 0.00 0.00 23.12 19.86 1hj4 s ALA 80 CO 0.57 -1.41 1.17 1.28 0.00 0.00 0.00 175.76 177.36 1hj4 n LEU 81 N -1.45 2.52 -4.77 0.00 4.77 0.68 -4.88 117.00 113.88 1hj4 n LEU 81 Ca 0.13 -3.40 -0.35 0.00 -0.03 0.00 0.00 56.01 52.36 1hj4 n LEU 81 Cb 0.47 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.54 1hj4 n LEU 81 CO 0.49 1.26 0.79 0.42 -1.33 0.00 0.00 177.39 179.01 1hj4 s THR 82 N -2.99 3.03 0.30 -5.08 -4.23 -1.17 -4.71 115.64 100.78 1hj4 s THR 82 Ca 0.37 0.59 0.06 0.00 -1.18 0.00 0.00 61.69 61.53 1hj4 s THR 82 Cb 0.37 -3.19 0.30 0.00 1.34 0.00 0.00 72.50 71.32 1hj4 s THR 82 CO -0.06 -0.18 1.70 -0.65 -0.54 0.00 0.00 174.62 174.89 1hj4 h PRO 83 N 0.80 0.41 -0.68 3.99 0.11 -1.82 -0.43 132.00 134.38 1hj4 h PRO 83 Ca -0.49 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.64 1hj4 h PRO 83 Cb 1.27 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 1hj4 h PRO 83 CO 0.56 0.27 0.39 0.38 -0.21 0.00 0.00 178.00 179.39 1hj4 h ASP 84 N 0.42 0.61 -0.19 -2.05 2.03 -1.92 0.15 116.42 115.47 1hj4 h ASP 84 Ca 0.59 0.02 -0.16 0.00 -0.73 0.00 0.00 57.03 56.75 1hj4 h ASP 84 Cb 1.16 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 1hj4 h ASP 84 CO -0.53 0.40 -0.52 -0.07 -1.03 0.00 0.00 179.24 177.49 1hj4 h LEU 85 N 0.74 0.78 -0.29 0.15 3.38 -1.47 -3.00 115.31 115.60 1hj4 h LEU 85 Ca 0.29 -0.58 -0.19 0.00 0.09 0.00 0.00 57.88 57.49 1hj4 h LEU 85 Cb 0.13 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1hj4 h LEU 85 CO -0.16 1.23 -0.62 0.71 0.09 0.00 0.00 178.44 179.69 1hj4 h THR 86 N 0.38 1.28 -0.40 0.22 1.35 -1.07 -2.38 112.91 112.29 1hj4 h THR 86 Ca -0.01 -1.82 -0.06 0.00 -0.55 0.00 0.00 66.41 63.97 1hj4 h THR 86 Cb 1.14 1.76 -0.02 0.00 -1.73 0.00 0.00 68.15 69.30 1hj4 h THR 86 CO 0.11 0.58 0.01 0.03 -0.25 0.00 0.00 175.52 176.01 1hj4 h ARG 87 N 0.59 0.64 -0.10 4.72 3.08 -0.79 0.33 114.38 122.85 1hj4 h ARG 87 Ca -0.01 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 59.78 1hj4 h ARG 87 Cb 1.23 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 1hj4 h ARG 87 CO 0.13 0.65 -0.44 0.22 -1.07 0.00 0.00 179.97 179.47 1hj4 h ASP 88 N 0.61 0.24 -0.07 7.04 3.58 -1.48 -3.05 116.42 123.28 1hj4 h ASP 88 Ca 0.13 -0.10 -0.15 0.00 0.42 0.00 0.00 57.03 57.33 1hj4 h ASP 88 Cb 0.37 -0.07 0.01 0.00 1.72 0.00 0.00 39.33 41.36 1hj4 h ASP 88 CO 0.01 0.65 -0.53 -0.07 -2.88 0.00 0.00 179.24 176.43 1hj4 h LEU 89 N 0.19 0.59 0.00 2.28 3.38 -0.77 -3.50 115.31 117.47 1hj4 h LEU 89 Ca 0.01 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 57.31 1hj4 h LEU 89 Cb 0.85 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1hj4 h LEU 89 CO 0.07 1.17 0.00 0.61 0.09 0.00 0.00 178.44 180.38 1hj4 n GLY 90 N 0.81 0.98 0.38 0.83 0.00 0.11 -4.45 105.19 103.84 1hj4 n GLY 90 Ca -0.09 -1.75 -0.17 0.00 0.00 0.00 0.00 46.02 44.01 1hj4 n GLY 90 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1hj4 h PHE 91 N 0.00 -0.90 -0.50 1.61 3.04 -1.89 -1.98 116.94 116.32 1hj4 h PHE 91 Ca 0.00 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.04 1hj4 h PHE 91 Cb 0.00 0.32 -0.10 0.00 2.56 0.00 0.00 35.95 38.73 1hj4 h PHE 91 CO 0.00 -0.52 -0.17 -0.44 -2.02 0.00 0.00 178.31 175.16 1hj4 h ASP 92 N -0.84 -0.60 -0.14 0.41 5.19 -1.99 0.77 116.42 119.22 1hj4 h ASP 92 Ca -0.06 0.16 0.04 0.00 -0.62 0.00 0.00 57.03 56.55 1hj4 h ASP 92 Cb 0.69 0.36 -0.04 0.00 0.18 0.00 0.00 39.33 40.52 1hj4 h ASP 92 CO 0.06 -0.20 -0.10 0.22 -3.12 0.00 0.00 179.24 176.10 1hj4 h TYR 93 N -0.05 -0.24 -0.66 4.55 5.03 -1.75 -1.62 116.97 122.23 1hj4 h TYR 93 Ca 0.24 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.52 1hj4 h TYR 93 Cb 0.42 0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.80 1hj4 h TYR 93 CO -0.46 -0.15 0.24 -0.07 -1.32 0.00 0.00 178.16 176.40 1hj4 h LEU 94 N -0.10 0.94 -0.53 2.82 3.38 -0.49 -1.81 115.31 119.52 1hj4 h LEU 94 Ca 0.09 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.90 1hj4 h LEU 94 Cb 0.23 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1hj4 h LEU 94 CO -0.21 0.88 0.30 -0.61 0.09 0.00 0.00 178.44 178.89 1hj4 h GLN 95 N 0.95 0.57 -0.10 1.13 4.15 0.90 -0.02 115.11 122.68 1hj4 h GLN 95 Ca 0.22 -0.03 -0.15 0.00 0.77 0.00 0.00 58.65 59.45 1hj4 h GLN 95 Cb 0.25 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1hj4 h GLN 95 CO -0.01 0.37 -0.59 0.77 -1.93 0.00 0.00 178.83 177.44 1hj4 h SER 96 N 0.58 0.39 -0.23 -0.69 0.02 -1.15 -1.73 113.55 110.74 1hj4 h SER 96 Ca 0.22 -0.22 -0.15 0.00 -0.84 0.00 0.00 61.79 60.80 1hj4 h SER 96 Cb 0.07 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1hj4 h SER 96 CO -0.12 0.89 -0.44 0.15 -1.14 0.00 0.00 176.83 176.17 1hj4 h PHE 97 N 0.26 0.89 0.00 3.45 3.04 -0.97 -3.26 116.94 120.35 1hj4 h PHE 97 Ca -0.00 -0.32 -0.08 0.00 3.98 0.00 0.00 57.97 61.55 1hj4 h PHE 97 Cb 1.11 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 39.45 1hj4 h PHE 97 CO 0.03 1.10 -0.37 0.82 -2.02 0.00 0.00 178.31 177.87 1hj4 h ILE 98 N 0.42 0.74 0.00 1.41 2.04 -0.98 -3.20 117.51 117.95 1hj4 h ILE 98 Ca 0.01 -1.66 0.00 0.00 1.00 0.00 0.00 64.86 64.21 1hj4 h ILE 98 Cb 1.05 2.08 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1hj4 h ILE 98 CO 0.10 0.36 0.00 0.00 0.00 0.00 0.00 178.15 178.61 1hj4 h THR 99 N 0.00 0.00 0.00 -0.27 1.03 -1.35 -1.73 112.91 110.58 1hj4 h THR 99 Ca -0.00 -0.21 0.00 0.00 -0.01 0.00 0.00 66.41 66.19 1hj4 h THR 99 Cb 1.05 1.10 0.00 0.00 -1.07 0.00 0.00 68.15 69.23 1hj4 h THR 99 CO 0.05 0.00 0.00 1.88 -0.01 0.00 0.00 175.52 177.44 1hj4 h TYR 100 N 0.00 0.00 0.00 0.00 0.05 -1.71 -3.48 116.97 111.84 1hj4 h TYR 100 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1hj4 h TYR 100 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1hj4 h TYR 100 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 1hj4 n GLY 101 N 0.66 0.58 3.45 3.88 0.00 -0.65 -5.02 105.19 108.08 1hj4 n GLY 101 Ca 0.04 -1.98 -0.25 0.00 0.00 0.00 0.00 46.02 43.83 1hj4 n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hj4 s SER 102 N -0.50 3.48 0.14 1.61 1.04 0.98 -4.78 113.70 115.68 1hj4 s SER 102 Ca 0.00 -0.98 -0.33 0.00 0.48 0.00 0.00 55.95 55.12 1hj4 s SER 102 Cb 0.00 -0.28 -0.13 0.00 0.10 0.00 0.00 66.02 65.71 1hj4 s SER 102 CO 0.00 0.05 1.66 -2.65 0.98 0.00 0.00 173.24 173.28 1hj4 n PRO 103 N -0.33 2.34 -1.43 4.02 -0.02 -1.02 -3.87 135.00 134.67 1hj4 n PRO 103 Ca -0.07 0.85 -0.36 0.00 -2.02 0.00 0.00 63.50 61.90 1hj4 n PRO 103 Cb 0.59 -2.65 0.09 0.00 -0.02 0.00 0.00 33.50 31.51 1hj4 n PRO 103 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hj4 n ALA 104 N 4.03 0.40 -1.37 3.55 0.00 -1.25 -4.55 120.51 121.31 1hj4 n ALA 104 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1hj4 n ALA 104 Cb 0.31 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1hj4 n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hj4 n GLY 105 N 0.86 1.28 3.76 0.00 0.00 0.12 -4.35 105.19 106.87 1hj4 n GLY 105 Ca 0.14 -1.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.15 1hj4 n GLY 105 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hj4 s MET 106 N 1.55 4.70 0.97 1.61 -1.94 -1.22 -4.75 119.30 120.23 1hj4 s MET 106 Ca 0.00 1.30 -0.12 0.00 -1.71 0.00 0.00 55.69 55.16 1hj4 s MET 106 Cb 0.00 -3.27 0.10 0.00 2.01 0.00 0.00 34.83 33.67 1hj4 s MET 106 CO 0.00 0.54 0.67 -2.30 -0.01 0.00 0.00 175.02 173.92 1hj4 n PRO 107 N 1.58 -0.65 -0.28 2.03 -0.02 -1.26 0.27 135.00 136.67 1hj4 n PRO 107 Ca -0.04 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1hj4 n PRO 107 Cb 0.48 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1hj4 n PRO 107 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1hj4 n ASN 108 N -2.67 0.00 0.00 2.55 3.02 -1.26 -4.08 115.26 112.83 1hj4 n ASN 108 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1hj4 n ASN 108 Cb 0.54 -2.01 0.00 0.00 -0.61 0.00 0.00 39.78 37.70 1hj4 n ASN 108 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 1hj4 n TRP 109 N -2.00 0.00 -2.25 3.10 4.27 -1.11 -4.78 117.44 114.67 1hj4 n TRP 109 Ca 0.00 0.00 -0.25 0.00 -3.89 0.00 0.00 57.50 53.36 1hj4 n TRP 109 Cb 0.00 0.00 0.15 0.00 -1.36 0.00 0.00 31.31 30.10 1hj4 n TRP 109 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1hj4 n GLY 110 N 0.00 -0.40 3.93 -1.67 0.00 0.77 -4.94 105.19 102.88 1hj4 n GLY 110 Ca 0.00 -1.87 -0.25 0.00 0.00 0.00 0.00 46.02 43.90 1hj4 n GLY 110 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1hj4 s THR 111 N -3.36 3.67 -0.97 2.61 -1.32 -1.26 -4.82 115.64 110.19 1hj4 s THR 111 Ca 0.68 -0.20 0.21 0.00 -1.21 0.00 0.00 61.69 61.17 1hj4 s THR 111 Cb -0.03 -3.42 -0.22 0.00 -1.51 0.00 0.00 72.50 67.32 1hj4 s THR 111 CO 0.46 -0.39 0.92 -1.54 -2.21 0.00 0.00 174.62 171.87 1hj4 n SER 112 N -2.42 0.94 -1.11 8.08 3.41 -1.26 0.15 113.62 121.40 1hj4 n SER 112 Ca 0.04 -0.92 -0.08 0.00 -0.26 0.00 0.00 58.87 57.65 1hj4 n SER 112 Cb 0.58 0.98 0.01 0.00 -0.26 0.00 0.00 64.21 65.51 1hj4 n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hj4 n GLY 113 N 1.49 0.19 3.41 5.00 0.00 -1.25 -3.88 105.19 110.15 1hj4 n GLY 113 Ca 0.04 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 1hj4 n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hj4 s GLU 114 N -4.76 3.14 0.06 1.61 2.02 -1.26 -0.01 118.70 119.50 1hj4 s GLU 114 Ca 0.07 -0.85 0.06 0.00 0.02 0.00 0.00 54.97 54.28 1hj4 s GLU 114 Cb -0.03 -3.60 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 1hj4 s GLU 114 CO 0.09 -0.51 -0.12 -0.51 0.02 0.00 0.00 175.26 174.23 1hj4 s LEU 115 N 1.58 2.91 0.00 1.80 1.43 -1.26 -5.05 118.68 120.09 1hj4 s LEU 115 Ca 0.03 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 1hj4 s LEU 115 Cb -0.18 -1.71 0.11 0.00 0.03 0.00 0.00 46.19 44.44 1hj4 s LEU 115 CO 0.06 0.23 0.68 -1.54 0.23 0.00 0.00 176.35 176.01 1hj4 n SER 116 N 1.17 0.56 -0.24 2.29 3.41 -1.26 -4.78 113.62 114.77 1hj4 n SER 116 Ca -0.15 -1.55 -0.08 0.00 -0.26 0.00 0.00 58.87 56.83 1hj4 n SER 116 Cb 0.52 -0.47 0.04 0.00 -0.26 0.00 0.00 64.21 64.04 1hj4 n SER 116 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hj4 h ALA 117 N -1.02 0.88 -0.37 7.33 0.00 -1.99 0.33 119.26 124.43 1hj4 h ALA 117 Ca -0.22 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1hj4 h ALA 117 Cb 0.74 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1hj4 h ALA 117 CO 0.21 0.59 0.21 1.49 0.00 0.00 0.00 179.25 181.75 1hj4 h GLU 118 N 0.99 0.51 -0.31 0.00 4.22 -2.01 -2.65 114.58 115.32 1hj4 h GLU 118 Ca 0.21 -0.05 -0.16 0.00 0.08 0.00 0.00 59.36 59.44 1hj4 h GLU 118 Cb 0.36 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1hj4 h GLU 118 CO 0.00 0.40 -0.44 1.96 -2.18 0.00 0.00 179.01 178.75 1hj4 h GLN 119 N 0.47 0.81 -0.21 1.92 4.20 -1.85 -2.91 115.11 117.53 1hj4 h GLN 119 Ca 0.13 -0.45 0.00 0.00 0.06 0.00 0.00 58.65 58.39 1hj4 h GLN 119 Cb 0.03 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1hj4 h GLN 119 CO -0.02 1.08 0.14 0.28 -0.67 0.00 0.00 178.83 179.64 1hj4 h VAL 120 N 0.65 1.06 -0.59 -0.54 2.07 -0.21 -2.20 116.25 116.48 1hj4 h VAL 120 Ca 0.04 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1hj4 h VAL 120 Cb 1.02 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 1hj4 h VAL 120 CO 0.10 0.06 0.33 0.44 0.02 0.00 0.00 177.57 178.51 1hj4 h ASP 121 N 0.29 0.74 -0.55 0.57 5.19 -1.49 -2.49 116.42 118.68 1hj4 h ASP 121 Ca 0.08 -0.09 0.04 0.00 -0.62 0.00 0.00 57.03 56.44 1hj4 h ASP 121 Cb -0.03 -0.19 -0.04 0.00 0.18 0.00 0.00 39.33 39.25 1hj4 h ASP 121 CO -0.02 0.62 0.30 -0.07 -3.12 0.00 0.00 179.24 176.95 1hj4 h LEU 122 N 0.80 0.44 -0.73 1.55 3.38 -1.32 -1.69 115.31 117.74 1hj4 h LEU 122 Ca 0.21 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 1hj4 h LEU 122 Cb 0.04 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1hj4 h LEU 122 CO -0.03 0.30 0.25 0.24 0.09 0.00 0.00 178.44 179.29 1hj4 h MET 123 N 0.57 1.12 -0.52 1.13 2.86 -1.20 0.16 114.93 119.06 1hj4 h MET 123 Ca 0.24 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1hj4 h MET 123 Cb 0.12 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1hj4 h MET 123 CO -0.15 0.94 0.23 0.00 1.06 0.00 0.00 176.91 179.00 1hj4 h ALA 124 N 1.13 0.67 -0.34 6.32 0.00 -1.07 -1.64 119.26 124.33 1hj4 h ALA 124 Ca 0.24 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1hj4 h ALA 124 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1hj4 h ALA 124 CO -0.01 0.26 -0.01 -0.91 0.00 0.00 0.00 179.25 178.58 1hj4 h ASN 125 N 0.70 0.60 -0.81 0.00 2.35 -1.08 -3.01 115.58 114.32 1hj4 h ASN 125 Ca 0.18 -0.31 0.09 0.00 -0.55 0.00 0.00 56.30 55.70 1hj4 h ASN 125 Cb 0.16 -0.16 -0.07 0.00 0.05 0.00 0.00 38.32 38.29 1hj4 h ASN 125 CO -0.02 0.76 0.46 0.22 -1.65 0.00 0.00 177.43 177.20 1hj4 h TYR 126 N 0.41 0.83 0.00 1.19 3.20 -0.49 -0.74 116.97 121.38 1hj4 h TYR 126 Ca 0.10 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1hj4 h TYR 126 Cb 0.46 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.48 1hj4 h TYR 126 CO 0.04 0.34 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.77 1hj4 h LEU 127 N 0.77 0.00 0.00 2.82 3.38 -1.17 -2.22 115.31 118.89 1hj4 h LEU 127 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1hj4 h LEU 127 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1hj4 h LEU 127 CO -0.24 0.06 -0.37 0.18 0.09 0.00 0.00 178.44 178.16 1hj4 n LEU 128 N -3.34 0.52 -4.94 1.67 4.77 -0.30 -4.32 117.00 111.07 1hj4 n LEU 128 Ca -0.01 0.27 -0.24 0.00 -0.03 0.00 0.00 56.01 55.99 1hj4 n LEU 128 Cb 0.23 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.03 1hj4 n LEU 128 CO 0.27 -0.01 0.24 -0.76 -1.33 0.00 0.00 177.39 175.79 1hj4 s LEU 129 N -3.68 3.90 -0.32 2.23 1.43 -0.84 -4.89 118.68 116.52 1hj4 s LEU 129 Ca 0.10 0.52 -0.27 0.00 -1.03 0.00 0.00 54.13 53.45 1hj4 s LEU 129 Cb 0.15 -3.40 0.01 0.00 0.03 0.00 0.00 46.19 42.99 1hj4 s LEU 129 CO 0.66 -0.39 0.98 -1.81 0.23 0.00 0.00 176.35 176.02 1hj4 s ASP 130 N -4.07 6.83 0.30 2.29 1.01 -1.26 -4.64 116.67 117.14 1hj4 s ASP 130 Ca 0.42 0.90 -0.29 0.00 0.71 0.00 0.00 52.55 54.29 1hj4 s ASP 130 Cb -0.10 -2.50 -0.10 0.00 1.01 0.00 0.00 42.92 41.24 1hj4 s ASP 130 CO 0.38 -0.81 1.17 -2.16 0.21 0.00 0.00 175.17 173.97 1hj4 s PRO 131 N 3.44 4.52 0.26 8.23 0.04 -1.26 -4.82 135.00 145.41 1hj4 s PRO 131 Ca 0.41 1.95 -0.09 0.00 0.04 0.00 0.00 61.00 63.31 1hj4 s PRO 131 Cb -0.13 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.22 1hj4 s PRO 131 CO 0.15 0.05 0.57 0.00 0.04 0.00 0.00 177.00 177.81 1hj4 s ALA 132 N -1.17 3.56 -0.12 8.56 0.00 -1.26 -5.05 121.76 126.28 1hj4 s ALA 132 Ca 0.47 -0.32 -0.27 0.00 0.00 0.00 0.00 51.96 51.83 1hj4 s ALA 132 Cb -0.35 -2.43 -0.02 0.00 0.00 0.00 0.00 23.12 20.32 1hj4 s ALA 132 CO 0.45 0.40 0.89 0.00 0.00 0.00 0.00 175.76 177.50 1hj4 s ALA 133 N -1.93 3.43 0.89 0.00 0.00 -1.26 -4.92 121.76 117.97 1hj4 s ALA 133 Ca 0.47 0.20 -0.14 0.00 0.00 0.00 0.00 51.96 52.50 1hj4 s ALA 133 Cb -0.11 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.75 1hj4 s ALA 133 CO 0.24 -0.54 0.46 -2.30 0.00 0.00 0.00 175.76 173.63 1hj4 n PRO 134 N 4.88 -0.13 -1.73 0.00 -0.02 -1.26 -4.92 135.00 131.82 1hj4 n PRO 134 Ca 0.05 0.01 -0.37 0.00 -2.02 0.00 0.00 63.50 61.17 1hj4 n PRO 134 Cb 0.49 -1.87 0.06 0.00 -0.02 0.00 0.00 33.50 32.16 1hj4 n PRO 134 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1hj4 n PRO 135 N -1.52 1.25 -2.14 0.52 -0.02 -1.26 -5.03 135.00 126.80 1hj4 n PRO 135 Ca 0.08 0.48 -0.27 0.00 -2.02 0.00 0.00 63.50 61.77 1hj4 n PRO 135 Cb 0.53 -2.55 0.10 0.00 -0.02 0.00 0.00 33.50 31.56 1hj4 n PRO 135 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1hj4 s GLU 136 N -3.27 1.72 -0.38 -0.52 0.41 -1.26 -4.76 118.70 110.64 1hj4 s GLU 136 Ca 0.80 -0.35 0.03 0.00 -0.41 0.00 0.00 54.97 55.05 1hj4 s GLU 136 Cb -0.39 -2.08 0.16 0.00 -1.78 0.00 0.00 34.13 30.04 1hj4 s GLU 136 CO 0.42 -1.60 0.37 0.12 -0.49 0.00 0.00 175.26 174.08 1hj4 s PHE 137 N -3.44 -0.08 0.00 1.61 2.19 -1.26 -5.01 117.98 111.99 1hj4 s PHE 137 Ca 0.64 -1.11 0.00 0.00 0.33 0.00 0.00 56.93 56.80 1hj4 s PHE 137 Cb -0.08 -0.49 0.00 0.00 -1.31 0.00 0.00 43.02 41.14 1hj4 s PHE 137 CO 0.47 -0.96 0.00 0.41 1.83 0.00 0.00 175.22 176.98 1hj4 n GLY 138 N 3.94 1.88 0.26 13.12 0.00 -1.26 -4.86 105.19 118.26 1hj4 n GLY 138 Ca 0.14 -2.08 -0.00 0.00 0.00 0.00 0.00 46.02 44.08 1hj4 n GLY 138 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1hj4 h MET 139 N 0.00 0.58 -0.17 1.61 4.05 -2.00 -0.28 114.93 118.72 1hj4 h MET 139 Ca 0.00 -0.03 0.05 0.00 -0.28 0.00 0.00 59.70 59.43 1hj4 h MET 139 Cb 0.00 -0.13 -0.05 0.00 -0.80 0.00 0.00 31.60 30.62 1hj4 h MET 139 CO 0.00 0.38 -0.13 -0.22 0.23 0.00 0.00 176.91 177.17 1hj4 h LYS 140 N 0.59 -0.14 -0.57 0.39 1.63 -1.99 0.07 116.57 116.55 1hj4 h LYS 140 Ca 0.32 0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 60.06 1hj4 h LYS 140 Cb 0.30 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.94 1hj4 h LYS 140 CO -0.24 -0.09 0.09 0.93 -3.45 0.00 0.00 179.45 176.69 1hj4 h GLU 141 N -0.14 0.95 -0.49 1.90 3.07 -1.80 -2.45 114.58 115.61 1hj4 h GLU 141 Ca 0.11 -0.25 -0.04 0.00 -0.50 0.00 0.00 59.36 58.67 1hj4 h GLU 141 Cb 0.30 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.08 1hj4 h GLU 141 CO -0.26 0.90 0.14 0.52 -1.40 0.00 0.00 179.01 178.92 1hj4 h MET 142 N 0.84 0.77 0.00 2.33 2.86 -0.73 -2.71 114.93 118.29 1hj4 h MET 142 Ca 0.17 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1hj4 h MET 142 Cb 0.42 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1hj4 h MET 142 CO 0.01 0.73 -0.24 0.00 1.06 0.00 0.00 176.91 178.47 1hj4 h ARG 143 N 0.66 0.00 0.00 1.72 3.08 -0.91 -0.73 114.38 118.21 1hj4 h ARG 143 Ca 0.16 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.06 1hj4 h ARG 143 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1hj4 h ARG 143 CO -0.00 0.24 -0.69 0.93 -1.07 0.00 0.00 179.97 179.38 1hj4 h GLU 144 N 0.00 0.00 0.00 0.04 5.08 -1.20 -2.79 114.58 115.71 1hj4 h GLU 144 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1hj4 h GLU 144 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1hj4 h GLU 144 CO 0.03 0.69 -0.48 -1.13 -1.00 0.00 0.00 179.01 177.12 1hj4 n SER 145 N -3.56 0.67 -4.64 1.42 3.41 -0.73 -4.86 113.62 105.33 1hj4 n SER 145 Ca -0.00 0.18 -0.43 0.00 -0.26 0.00 0.00 58.87 58.36 1hj4 n SER 145 Cb 0.71 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.61 1hj4 n SER 145 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 1hj4 s TRP 146 N -3.13 2.77 -0.08 7.33 -0.00 -0.36 -4.29 118.94 121.18 1hj4 s TRP 146 Ca 0.08 0.94 0.01 0.00 -0.00 0.00 0.00 56.10 57.13 1hj4 s TRP 146 Cb 0.14 -3.78 0.02 0.00 -0.00 0.00 0.00 33.47 29.85 1hj4 s TRP 146 CO 0.69 -1.61 -0.10 0.15 -0.00 0.00 0.00 176.95 176.08 1hj4 s LYS 147 N 3.95 1.62 -0.44 5.86 1.02 -0.48 -4.99 119.74 126.27 1hj4 s LYS 147 Ca 0.55 -0.35 -0.11 0.00 0.02 0.00 0.00 55.97 56.08 1hj4 s LYS 147 Cb -0.17 -1.47 0.08 0.00 -0.52 0.00 0.00 37.83 35.75 1hj4 s LYS 147 CO 0.20 -0.09 0.32 0.08 -0.92 0.00 0.00 175.35 174.94 1hj4 s VAL 148 N 1.06 4.54 0.05 3.17 1.01 -1.26 -1.00 120.40 127.97 1hj4 s VAL 148 Ca -0.07 -1.36 -0.17 0.00 0.00 0.00 0.00 61.98 60.38 1hj4 s VAL 148 Cb -0.15 -3.79 -0.18 0.00 0.00 0.00 0.00 36.38 32.26 1hj4 s VAL 148 CO -0.01 -0.58 1.23 0.45 0.00 0.00 0.00 175.10 176.19 1hj4 h HIS 149 N 8.53 0.80 -3.47 5.22 -0.00 -0.86 -3.41 115.15 121.95 1hj4 h HIS 149 Ca -0.24 -0.37 -0.61 0.00 -0.00 0.00 0.00 60.37 59.15 1hj4 h HIS 149 Cb 1.09 -0.12 -0.39 0.00 -0.00 0.00 0.00 27.41 27.99 1hj4 h HIS 149 CO 0.63 1.17 -0.76 0.08 -0.00 0.00 0.00 177.93 179.05 1hj4 s VAL 150 N -3.61 1.42 0.68 2.45 1.01 -0.80 -5.04 120.40 116.50 1hj4 s VAL 150 Ca -0.12 -1.49 -0.17 0.00 0.00 0.00 0.00 61.98 60.20 1hj4 s VAL 150 Cb 0.06 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.54 1hj4 s VAL 150 CO 0.85 -0.41 1.20 0.00 0.00 0.00 0.00 175.10 176.74 1hj4 n ALA 151 N 4.66 0.66 -0.33 5.51 0.00 -1.26 -4.83 120.51 124.93 1hj4 n ALA 151 Ca -0.05 -0.09 0.15 0.00 0.00 0.00 0.00 53.44 53.46 1hj4 n ALA 151 Cb 0.43 -2.26 0.34 0.00 0.00 0.00 0.00 19.45 17.96 1hj4 n ALA 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1hj4 h PRO 152 N 0.15 0.52 0.00 0.00 0.11 -1.96 0.61 132.00 131.44 1hj4 h PRO 152 Ca -0.49 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 1hj4 h PRO 152 Cb 1.33 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1hj4 h PRO 152 CO 0.51 0.35 -0.05 1.05 -0.21 0.00 0.00 178.00 179.64 1hj4 h GLU 153 N 0.54 0.00 -0.10 1.05 4.11 -1.99 -2.27 114.58 115.92 1hj4 h GLU 153 Ca 0.60 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.03 1hj4 h GLU 153 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1hj4 h GLU 153 CO -0.48 0.05 0.00 -0.25 0.07 0.00 0.00 179.01 178.40 1hj4 n ASP 154 N -3.23 2.35 -4.93 3.06 8.00 0.20 -4.94 116.55 117.05 1hj4 n ASP 154 Ca -0.01 -1.78 -0.25 0.00 0.71 0.00 0.00 54.79 53.46 1hj4 n ASP 154 Cb 0.26 -0.05 0.01 0.00 -0.02 0.00 0.00 41.12 41.32 1hj4 n ASP 154 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hj4 s ARG 155 N -1.89 3.27 0.82 -1.24 0.52 -0.86 -4.95 118.95 114.62 1hj4 s ARG 155 Ca 0.34 -0.12 -0.13 0.00 -0.52 0.00 0.00 55.73 55.30 1hj4 s ARG 155 Cb 0.20 -2.45 0.09 0.00 0.52 0.00 0.00 34.95 33.32 1hj4 s ARG 155 CO 0.31 -0.27 1.19 -2.14 0.02 0.00 0.00 175.30 174.40 1hj4 s PRO 156 N -4.68 1.55 0.00 3.54 0.02 -1.26 -4.94 135.00 129.24 1hj4 s PRO 156 Ca 0.48 1.69 0.17 0.00 0.02 0.00 0.00 61.00 63.36 1hj4 s PRO 156 Cb -0.10 -1.77 0.16 0.00 0.02 0.00 0.00 34.50 32.81 1hj4 s PRO 156 CO 0.42 -2.26 1.06 0.25 -0.33 0.00 0.00 177.00 176.14 1hj4 n THR 157 N -3.47 0.08 -3.63 0.99 -2.24 -1.26 -4.98 114.28 99.78 1hj4 n THR 157 Ca 0.13 -0.54 -0.10 0.00 -2.27 0.00 0.00 64.05 61.27 1hj4 n THR 157 Cb 0.51 1.28 -0.02 0.00 -2.10 0.00 0.00 70.33 69.99 1hj4 n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hj4 s GLN 158 N -1.37 1.45 0.06 -0.78 -2.07 -1.26 -5.13 119.66 110.56 1hj4 s GLN 158 Ca 0.21 -0.72 -0.30 0.00 -1.82 0.00 0.00 55.36 52.72 1hj4 s GLN 158 Cb 0.14 0.58 -0.08 0.00 -1.09 0.00 0.00 33.01 32.56 1hj4 s GLN 158 CO 0.21 -0.64 1.76 -1.14 -1.32 0.00 0.00 175.29 174.17 1hj4 s GLN 159 N -3.83 4.17 0.00 9.60 0.74 -1.26 -4.83 119.66 124.24 1hj4 s GLN 159 Ca 0.06 2.43 0.17 0.00 0.05 0.00 0.00 55.36 58.07 1hj4 s GLN 159 Cb -0.02 -3.78 0.24 0.00 1.10 0.00 0.00 33.01 30.55 1hj4 s GLN 159 CO -0.05 -0.82 1.16 0.39 -0.55 0.00 0.00 175.29 175.42 1hj4 n GLU 160 N 6.27 1.85 -4.12 1.67 1.02 0.14 -4.95 120.64 122.52 1hj4 n GLU 160 Ca 0.17 -1.80 -0.25 0.00 -0.02 0.00 0.00 57.16 55.27 1hj4 n GLU 160 Cb 0.40 -1.36 -0.07 0.00 -0.02 0.00 0.00 31.44 30.39 1hj4 n GLU 160 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1hj4 s ASN 161 N -1.31 4.44 -0.25 1.62 2.20 -1.25 -4.29 114.94 116.10 1hj4 s ASN 161 Ca 0.25 -1.09 0.13 0.00 -0.94 0.00 0.00 52.86 51.22 1hj4 s ASN 161 Cb 0.16 -0.43 0.67 0.00 -2.00 0.00 0.00 41.25 39.65 1hj4 s ASN 161 CO 0.23 -0.57 1.63 -0.90 -2.94 0.00 0.00 177.10 174.54 1hj4 n ASP 162 N -1.27 4.57 -4.81 3.54 5.68 -1.26 -5.01 116.55 117.98 1hj4 n ASP 162 Ca -0.01 -3.12 -0.32 0.00 -0.50 0.00 0.00 54.79 50.84 1hj4 n ASP 162 Cb 0.65 -0.65 0.02 0.00 -1.14 0.00 0.00 41.12 40.00 1hj4 n ASP 162 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 1hj4 s TRP 163 N -2.90 3.10 -1.12 2.11 0.52 -1.26 -4.96 118.94 114.43 1hj4 s TRP 163 Ca 0.50 1.47 -0.13 0.00 0.02 0.00 0.00 56.10 57.95 1hj4 s TRP 163 Cb 0.40 -2.93 0.21 0.00 -1.15 0.00 0.00 33.47 29.99 1hj4 s TRP 163 CO 0.11 -1.08 1.25 0.34 0.02 0.00 0.00 176.95 177.59 1hj4 s ASP 164 N -3.24 7.09 0.24 2.95 -1.08 -1.26 -4.90 116.67 116.46 1hj4 s ASP 164 Ca 0.61 -3.07 -0.05 0.00 -0.52 0.00 0.00 52.55 49.51 1hj4 s ASP 164 Cb -0.15 -2.32 0.35 0.00 -1.46 0.00 0.00 42.92 39.34 1hj4 s ASP 164 CO 0.44 -0.62 1.82 -0.07 0.52 0.00 0.00 175.17 177.27 1hj4 h LEU 165 N 8.64 0.71 -1.94 -1.34 3.38 -1.96 -2.44 115.31 120.37 1hj4 h LEU 165 Ca 0.24 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1hj4 h LEU 165 Cb 0.90 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1hj4 h LEU 165 CO 1.12 0.43 -0.06 -0.33 0.09 0.00 0.00 178.44 179.69 1hj4 h GLU 166 N 0.84 0.00 -0.59 1.13 5.08 -1.92 -2.01 114.58 117.10 1hj4 h GLU 166 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1hj4 h GLU 166 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1hj4 h GLU 166 CO -0.21 0.06 0.00 -1.71 -1.00 0.00 0.00 179.01 176.15 1hj4 n ASN 167 N -3.28 4.11 -4.78 1.42 5.15 -0.94 -1.76 115.26 115.18 1hj4 n ASN 167 Ca -0.01 -2.26 -0.37 0.00 -0.60 0.00 0.00 54.58 51.34 1hj4 n ASN 167 Cb 0.24 -0.48 -0.05 0.00 -0.53 0.00 0.00 39.78 38.96 1hj4 n ASN 167 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1hj4 s LEU 168 N -1.49 4.21 -0.17 1.20 2.96 -0.76 -1.69 118.68 122.95 1hj4 s LEU 168 Ca 0.45 1.99 -0.03 0.00 -0.22 0.00 0.00 54.13 56.32 1hj4 s LEU 168 Cb 0.27 -4.12 -0.02 0.00 0.50 0.00 0.00 46.19 42.82 1hj4 s LEU 168 CO 0.25 -0.36 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.49 1hj4 s PHE 169 N -1.63 2.94 -0.40 5.38 0.40 -0.28 -0.75 117.98 123.62 1hj4 s PHE 169 Ca 0.55 -0.59 -0.16 0.00 -0.60 0.00 0.00 56.93 56.13 1hj4 s PHE 169 Cb -0.21 -1.97 0.01 0.00 0.51 0.00 0.00 43.02 41.36 1hj4 s PHE 169 CO 0.27 -0.24 0.38 0.45 0.70 0.00 0.00 175.22 176.78 1hj4 s SER 170 N 0.70 6.17 -0.19 1.36 0.15 0.19 -0.91 113.70 121.16 1hj4 s SER 170 Ca -0.03 -0.66 -0.03 0.00 0.70 0.00 0.00 55.95 55.92 1hj4 s SER 170 Cb -0.15 -2.20 -0.01 0.00 -1.71 0.00 0.00 66.02 61.95 1hj4 s SER 170 CO 0.02 -0.50 -0.05 -0.69 1.20 0.00 0.00 173.24 173.22 1hj4 s VAL 171 N 1.98 3.49 0.06 4.45 1.01 0.29 -1.33 120.40 130.36 1hj4 s VAL 171 Ca 0.10 -0.47 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 1hj4 s VAL 171 Cb -0.17 -2.56 -0.07 0.00 0.00 0.00 0.00 36.38 33.58 1hj4 s VAL 171 CO 0.12 0.45 1.35 -0.89 0.00 0.00 0.00 175.10 176.13 1hj4 s THR 172 N 1.06 3.61 -0.92 3.92 2.01 0.33 -0.35 115.64 125.30 1hj4 s THR 172 Ca 0.01 1.11 -0.04 0.00 0.31 0.00 0.00 61.69 63.08 1hj4 s THR 172 Cb -0.15 -3.71 0.23 0.00 0.01 0.00 0.00 72.50 68.88 1hj4 s THR 172 CO 0.00 0.05 0.82 -0.76 -0.69 0.00 0.00 174.62 174.05 1hj4 s LEU 173 N 1.56 5.72 0.04 4.42 1.43 -0.03 -1.61 118.68 130.21 1hj4 s LEU 173 Ca 0.63 -3.62 -0.10 0.00 -1.03 0.00 0.00 54.13 50.01 1hj4 s LEU 173 Cb -0.33 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.88 1hj4 s LEU 173 CO 0.29 -0.23 1.17 -0.09 0.23 0.00 0.00 176.35 177.72 1hj4 h ARG 174 N 6.25 -0.11 0.00 1.70 2.43 -1.29 -2.45 114.38 120.92 1hj4 h ARG 174 Ca 0.15 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1hj4 h ARG 174 Cb 0.84 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 1hj4 h ARG 174 CO 0.87 -0.07 0.00 -0.25 -1.51 0.00 0.00 179.97 179.01 1hj4 n ASP 175 N -3.56 0.00 -0.06 -3.80 9.92 -1.26 -2.21 116.55 115.57 1hj4 n ASP 175 Ca -0.01 0.30 0.12 0.00 -0.53 0.00 0.00 54.79 54.67 1hj4 n ASP 175 Cb 0.11 -0.42 0.31 0.00 -0.64 0.00 0.00 41.12 40.47 1hj4 n ASP 175 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1hj4 n ALA 176 N -1.42 3.36 -3.44 2.24 0.00 -0.94 -4.92 120.51 115.38 1hj4 n ALA 176 Ca 0.08 -0.35 -0.22 0.00 0.00 0.00 0.00 53.44 52.94 1hj4 n ALA 176 Cb 0.24 -1.14 0.07 0.00 0.00 0.00 0.00 19.45 18.62 1hj4 n ALA 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hj4 n GLY 177 N 1.45 -0.46 3.23 0.00 0.00 -1.02 -4.93 105.19 103.47 1hj4 n GLY 177 Ca 0.07 0.18 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 1hj4 n GLY 177 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hj4 s GLN 178 N -6.14 1.23 0.12 1.61 -0.21 -1.17 -1.18 119.66 113.91 1hj4 s GLN 178 Ca 0.51 -1.64 0.07 0.00 0.02 0.00 0.00 55.36 54.32 1hj4 s GLN 178 Cb -0.23 0.09 -0.04 0.00 1.00 0.00 0.00 33.01 33.84 1hj4 s GLN 178 CO 0.63 -0.34 -0.18 0.96 -2.12 0.00 0.00 175.29 174.25 1hj4 s ILE 179 N -4.01 1.60 -0.09 1.08 -4.36 -0.41 -0.85 121.20 114.16 1hj4 s ILE 179 Ca 0.36 -1.66 0.01 0.00 -0.26 0.00 0.00 60.65 59.11 1hj4 s ILE 179 Cb 0.07 -1.57 -0.02 0.00 1.25 0.00 0.00 42.46 42.18 1hj4 s ILE 179 CO 0.11 -0.22 -0.11 0.00 0.24 0.00 0.00 174.94 174.96 1hj4 s ALA 180 N -1.62 2.78 -0.38 2.27 0.00 0.52 -0.75 121.76 124.60 1hj4 s ALA 180 Ca 0.08 -0.91 -0.12 0.00 0.00 0.00 0.00 51.96 51.01 1hj4 s ALA 180 Cb -0.08 -1.18 0.02 0.00 0.00 0.00 0.00 23.12 21.87 1hj4 s ALA 180 CO 0.04 0.43 0.24 -0.51 0.00 0.00 0.00 175.76 175.97 1hj4 s LEU 181 N -0.32 4.76 -0.11 0.00 1.43 -0.10 -0.55 118.68 123.79 1hj4 s LEU 181 Ca 0.04 -0.83 0.02 0.00 -1.03 0.00 0.00 54.13 52.33 1hj4 s LEU 181 Cb -0.13 -2.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 1hj4 s LEU 181 CO 0.02 -0.37 -0.20 -0.63 0.23 0.00 0.00 176.35 175.41 1hj4 s ILE 182 N 1.63 2.47 0.07 -0.59 1.01 -0.09 -0.02 121.20 125.68 1hj4 s ILE 182 Ca 0.04 -0.87 -0.30 0.00 0.00 0.00 0.00 60.65 59.51 1hj4 s ILE 182 Cb -0.19 -1.98 -0.09 0.00 0.01 0.00 0.00 42.46 40.21 1hj4 s ILE 182 CO 0.08 0.55 1.85 -0.62 0.00 0.00 0.00 174.94 176.80 1hj4 s ASP 183 N 0.32 6.47 0.56 3.58 -1.08 0.14 -1.13 116.67 125.53 1hj4 s ASP 183 Ca -0.15 2.65 0.33 0.00 -0.52 0.00 0.00 52.55 54.86 1hj4 s ASP 183 Cb -0.17 -2.55 1.64 0.00 -1.46 0.00 0.00 42.92 40.38 1hj4 s ASP 183 CO 0.07 -1.00 2.11 1.23 0.52 0.00 0.00 175.17 178.10 1hj4 h GLY 184 N 9.52 0.00 0.00 2.66 0.00 -1.66 -0.46 103.07 113.14 1hj4 h GLY 184 Ca -0.46 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.58 1hj4 h GLY 184 CO 0.94 0.00 -2.10 0.00 0.00 0.00 0.00 176.54 175.38 1hj4 n ALA 185 N -2.19 1.59 0.38 3.60 0.00 -1.26 -4.65 120.51 117.98 1hj4 n ALA 185 Ca -0.01 -0.82 0.11 0.00 0.00 0.00 0.00 53.44 52.71 1hj4 n ALA 185 Cb 0.22 0.06 -0.04 0.00 0.00 0.00 0.00 19.45 19.69 1hj4 n ALA 185 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1hj4 n THR 186 N -3.07 0.19 -1.16 0.00 -2.24 -1.24 -4.97 114.28 101.79 1hj4 n THR 186 Ca -0.34 -0.34 -0.06 0.00 -2.27 0.00 0.00 64.05 61.04 1hj4 n THR 186 Cb 0.86 0.12 -0.02 0.00 -2.10 0.00 0.00 70.33 69.19 1hj4 n THR 186 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1hj4 n TYR 187 N -2.12 0.00 -2.46 4.78 4.01 -0.18 -4.98 117.16 116.20 1hj4 n TYR 187 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.33 1hj4 n TYR 187 Cb 0.48 -1.62 -0.04 0.00 -0.31 0.00 0.00 39.34 37.85 1hj4 n TYR 187 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1hj4 s GLU 188 N -2.01 4.56 -0.41 -0.72 2.02 -1.26 -4.73 118.70 116.14 1hj4 s GLU 188 Ca 0.00 1.78 -0.29 0.00 0.02 0.00 0.00 54.97 56.48 1hj4 s GLU 188 Cb 0.00 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.99 1hj4 s GLU 188 CO 0.00 0.02 1.17 0.42 0.02 0.00 0.00 175.26 176.89 1hj4 s ILE 189 N -0.21 4.24 0.14 -1.63 1.01 -1.26 -0.69 121.20 122.80 1hj4 s ILE 189 Ca 0.50 1.32 0.05 0.00 0.00 0.00 0.00 60.65 62.53 1hj4 s ILE 189 Cb -0.31 -4.47 -0.19 0.00 0.01 0.00 0.00 42.46 37.51 1hj4 s ILE 189 CO 0.36 -0.80 1.32 0.11 0.00 0.00 0.00 174.94 175.93 1hj4 h LYS 190 N 9.12 0.08 -1.51 2.79 1.79 -0.80 -3.48 116.57 124.56 1hj4 h LYS 190 Ca -0.23 -0.11 0.09 0.00 -2.18 0.00 0.00 60.65 58.23 1hj4 h LYS 190 Cb 1.07 0.04 -0.24 0.00 -1.58 0.00 0.00 32.23 31.51 1hj4 h LYS 190 CO 1.09 0.97 0.58 0.45 -1.08 0.00 0.00 179.45 181.46 1hj4 s SER 191 N -6.83 -0.34 -0.17 0.86 0.15 -1.15 -5.01 113.70 101.21 1hj4 s SER 191 Ca -0.01 0.43 0.01 0.00 0.70 0.00 0.00 55.95 57.08 1hj4 s SER 191 Cb 0.10 0.35 0.01 0.00 -1.71 0.00 0.00 66.02 64.77 1hj4 s SER 191 CO 0.82 -0.28 -0.19 -0.69 1.20 0.00 0.00 173.24 174.10 1hj4 s VAL 192 N -0.89 2.22 -0.02 4.45 1.01 -1.26 -0.93 120.40 124.97 1hj4 s VAL 192 Ca 0.00 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.14 1hj4 s VAL 192 Cb -0.01 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1hj4 s VAL 192 CO -0.01 0.53 -0.19 -0.76 0.00 0.00 0.00 175.10 174.68 1hj4 s LEU 193 N 1.13 2.50 0.13 3.92 1.43 0.07 -4.97 118.68 122.89 1hj4 s LEU 193 Ca 0.01 -0.33 -0.30 0.00 -1.03 0.00 0.00 54.13 52.48 1hj4 s LEU 193 Cb -0.14 -1.48 -0.07 0.00 0.03 0.00 0.00 46.19 44.53 1hj4 s LEU 193 CO -0.08 0.32 1.07 -1.81 0.23 0.00 0.00 176.35 176.08 1hj4 s ASP 194 N -0.83 7.31 0.00 2.29 1.01 -1.26 -1.29 116.67 123.89 1hj4 s ASP 194 Ca 0.12 1.98 0.00 0.00 0.71 0.00 0.00 52.55 55.35 1hj4 s ASP 194 Cb -0.10 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1hj4 s ASP 194 CO 0.01 -0.22 0.00 0.35 0.21 0.00 0.00 175.17 175.52 1hj4 n THR 195 N 2.79 0.00 -1.53 -1.27 -2.24 -0.32 -4.92 114.28 106.79 1hj4 n THR 195 Ca 0.04 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.51 1hj4 n THR 195 Cb 0.47 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.77 1hj4 n THR 195 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hj4 s GLY 196 N 0.00 1.65 0.30 3.38 0.00 -1.26 -4.71 107.32 106.68 1hj4 s GLY 196 Ca 0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 44.72 44.42 1hj4 s GLY 196 CO 0.00 0.35 1.31 -0.47 0.00 0.00 0.00 173.10 174.29 1hj4 s TYR 197 N -3.07 3.11 -1.28 1.90 5.04 -1.26 -3.70 117.35 118.09 1hj4 s TYR 197 Ca 0.59 1.35 -0.15 0.00 -2.44 0.00 0.00 57.07 56.42 1hj4 s TYR 197 Cb -0.14 -3.66 0.01 0.00 0.35 0.00 0.00 41.96 38.51 1hj4 s TYR 197 CO 0.55 -1.90 0.58 0.00 -1.34 0.00 0.00 175.55 173.44 1hj4 n ALA 198 N 1.31 -2.34 -1.55 3.97 0.00 -0.94 -2.50 120.51 118.46 1hj4 n ALA 198 Ca 0.02 -0.34 -0.60 0.00 0.00 0.00 0.00 53.44 52.53 1hj4 n ALA 198 Cb 0.42 -2.65 -0.08 0.00 0.00 0.00 0.00 19.45 17.13 1hj4 n ALA 198 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1hj4 n VAL 199 N -4.47 0.01 0.03 0.00 0.31 -1.24 -3.40 118.33 109.56 1hj4 n VAL 199 Ca -0.19 -0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 63.92 1hj4 n VAL 199 Cb 0.63 -0.18 -0.14 0.00 -0.91 0.00 0.00 33.84 33.23 1hj4 n VAL 199 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1hj4 h HIS 200 N 3.54 0.53 -3.29 3.52 2.76 -1.19 -3.47 115.15 117.56 1hj4 h HIS 200 Ca -0.50 -0.39 -0.10 0.00 -2.20 0.00 0.00 60.37 57.18 1hj4 h HIS 200 Cb 1.41 -0.02 -0.18 0.00 1.55 0.00 0.00 27.41 30.17 1hj4 h HIS 200 CO 0.59 1.61 -0.28 0.96 -1.30 0.00 0.00 177.93 179.51 1hj4 s ILE 201 N -2.51 0.08 -0.08 6.26 -4.36 -1.26 -4.79 121.20 114.54 1hj4 s ILE 201 Ca -0.19 -0.67 -0.02 0.00 -0.26 0.00 0.00 60.65 59.51 1hj4 s ILE 201 Cb 0.05 -0.85 -0.03 0.00 1.25 0.00 0.00 42.46 42.87 1hj4 s ILE 201 CO 0.79 -0.37 0.01 -0.44 0.24 0.00 0.00 174.94 175.18 1hj4 s SER 202 N -1.89 5.30 0.05 4.36 0.01 -1.26 -2.97 113.70 117.31 1hj4 s SER 202 Ca -0.07 0.16 0.03 0.00 1.31 0.00 0.00 55.95 57.38 1hj4 s SER 202 Cb -0.02 -1.50 -0.02 0.00 0.21 0.00 0.00 66.02 64.68 1hj4 s SER 202 CO -0.02 0.37 -0.10 -0.13 0.41 0.00 0.00 173.24 173.78 1hj4 s ARG 203 N -0.94 0.63 0.01 12.44 1.81 0.18 -4.94 118.95 128.14 1hj4 s ARG 203 Ca 0.14 -0.79 0.04 0.00 -1.72 0.00 0.00 55.73 53.40 1hj4 s ARG 203 Cb -0.11 -0.49 -0.03 0.00 -0.45 0.00 0.00 34.95 33.87 1hj4 s ARG 203 CO 0.03 0.10 -0.08 -0.51 -0.68 0.00 0.00 175.30 174.16 1hj4 s LEU 204 N -1.53 3.11 0.84 2.53 2.01 -1.26 -0.06 118.68 124.31 1hj4 s LEU 204 Ca -0.06 -0.17 -0.10 0.00 0.01 0.00 0.00 54.13 53.80 1hj4 s LEU 204 Cb -0.10 -1.79 0.10 0.00 0.01 0.00 0.00 46.19 44.42 1hj4 s LEU 204 CO 0.01 0.28 1.12 -0.94 1.01 0.00 0.00 176.35 177.83 1hj4 s SER 205 N -1.42 3.75 0.55 2.29 1.04 0.39 -4.64 113.70 115.66 1hj4 s SER 205 Ca 0.17 2.00 0.24 0.00 0.48 0.00 0.00 55.95 58.84 1hj4 s SER 205 Cb -0.11 -2.54 1.56 0.00 0.10 0.00 0.00 66.02 65.02 1hj4 s SER 205 CO 0.07 -2.55 2.19 0.00 0.98 0.00 0.00 173.24 173.93 1hj4 h ALA 206 N -1.48 1.65 0.00 5.32 0.00 -1.85 -0.79 119.26 122.12 1hj4 h ALA 206 Ca -0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1hj4 h ALA 206 Cb 1.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1hj4 h ALA 206 CO 0.47 0.04 -0.26 0.66 0.00 0.00 0.00 179.25 180.15 1hj4 h SER 207 N 0.00 0.00 0.00 0.00 4.64 -1.92 -3.47 113.55 112.79 1hj4 h SER 207 Ca -0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1hj4 h SER 207 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1hj4 h SER 207 CO 0.00 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1hj4 n GLY 208 N 1.30 0.76 0.12 -0.77 0.00 -0.30 -4.93 105.19 101.37 1hj4 n GLY 208 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 1hj4 n GLY 208 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1hj4 h ARG 209 N 2.69 0.33 -5.26 1.61 2.43 -1.92 -3.46 114.38 110.80 1hj4 h ARG 209 Ca 0.00 -0.45 -0.62 0.00 -0.81 0.00 0.00 59.98 58.11 1hj4 h ARG 209 Cb 0.00 0.15 -0.16 0.00 -0.42 0.00 0.00 29.97 29.54 1hj4 h ARG 209 CO 0.00 1.16 -0.56 0.71 -1.51 0.00 0.00 179.97 179.77 1hj4 s TYR 210 N -2.79 3.26 -0.25 2.20 2.02 -1.26 -1.42 117.35 119.10 1hj4 s TYR 210 Ca -0.14 0.08 -0.08 0.00 -0.37 0.00 0.00 57.07 56.57 1hj4 s TYR 210 Cb 0.02 -2.10 -0.03 0.00 -0.40 0.00 0.00 41.96 39.45 1hj4 s TYR 210 CO 0.82 0.15 0.09 -1.17 -1.57 0.00 0.00 175.55 173.87 1hj4 s LEU 211 N 0.42 3.57 -0.15 -1.29 2.96 -0.31 -0.46 118.68 123.43 1hj4 s LEU 211 Ca 0.04 -0.15 -0.04 0.00 -0.22 0.00 0.00 54.13 53.76 1hj4 s LEU 211 Cb -0.12 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1hj4 s LEU 211 CO 0.00 -0.03 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.62 1hj4 s PHE 212 N 1.58 3.06 0.01 5.38 0.40 0.91 -0.02 117.98 129.31 1hj4 s PHE 212 Ca 0.06 -0.18 0.06 0.00 -0.60 0.00 0.00 56.93 56.27 1hj4 s PHE 212 Cb -0.15 -1.94 -0.02 0.00 0.51 0.00 0.00 43.02 41.42 1hj4 s PHE 212 CO 0.05 0.06 -0.17 0.14 0.70 0.00 0.00 175.22 176.00 1hj4 s VAL 213 N 0.16 1.35 -0.08 -0.44 -7.23 -0.29 -0.65 120.40 113.22 1hj4 s VAL 213 Ca -0.01 -0.90 0.03 0.00 -1.81 0.00 0.00 61.98 59.29 1hj4 s VAL 213 Cb -0.13 -1.16 0.01 0.00 0.56 0.00 0.00 36.38 35.65 1hj4 s VAL 213 CO 0.02 0.24 -0.19 -0.51 -0.31 0.00 0.00 175.10 174.35 1hj4 s ILE 214 N -0.61 1.64 0.48 -0.62 2.07 -1.16 -1.34 121.20 121.67 1hj4 s ILE 214 Ca 0.05 -0.78 -0.04 0.00 -1.41 0.00 0.00 60.65 58.48 1hj4 s ILE 214 Cb -0.07 -1.44 -0.02 0.00 0.13 0.00 0.00 42.46 41.05 1hj4 s ILE 214 CO 0.00 0.47 0.76 -0.83 -1.91 0.00 0.00 174.94 173.43 1hj4 s GLY 215 N 0.49 1.50 0.63 1.50 0.00 0.41 -0.65 107.32 111.19 1hj4 s GLY 215 Ca -0.17 -0.66 0.41 0.00 0.00 0.00 0.00 44.72 44.30 1hj4 s GLY 215 CO 0.07 -0.49 2.24 0.07 0.00 0.00 0.00 173.10 174.99 1hj4 h ARG 216 N 0.24 0.00 -0.04 2.90 0.11 -1.50 -1.16 114.38 114.93 1hj4 h ARG 216 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1hj4 h ARG 216 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1hj4 h ARG 216 CO 0.61 0.00 0.00 -0.40 0.10 0.00 0.00 179.97 180.28 1hj4 n ASP 217 N -3.10 0.79 0.00 0.08 5.75 -1.26 -1.03 116.55 117.78 1hj4 n ASP 217 Ca -0.02 -1.40 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 1hj4 n ASP 217 Cb 0.15 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 1hj4 n ASP 217 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hj4 n GLY 218 N 1.03 0.74 3.70 6.12 0.00 -0.44 -4.28 105.19 112.06 1hj4 n GLY 218 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1hj4 n GLY 218 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hj4 s LYS 219 N -0.55 4.52 -0.16 1.61 2.47 -1.25 -1.09 119.74 125.28 1hj4 s LYS 219 Ca 0.00 1.40 -0.02 0.00 -1.56 0.00 0.00 55.97 55.79 1hj4 s LYS 219 Cb 0.00 -3.48 -0.02 0.00 -1.46 0.00 0.00 37.83 32.87 1hj4 s LYS 219 CO 0.00 -0.13 -0.07 0.08 0.16 0.00 0.00 175.35 175.39 1hj4 s VAL 220 N 1.30 3.45 -0.05 4.02 1.01 0.12 -0.45 120.40 129.79 1hj4 s VAL 220 Ca 0.51 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 62.02 1hj4 s VAL 220 Cb -0.20 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1hj4 s VAL 220 CO 0.25 0.49 -0.15 0.20 0.00 0.00 0.00 175.10 175.88 1hj4 s ASN 221 N 0.65 3.95 -0.17 3.32 0.02 -0.45 -1.60 114.94 120.67 1hj4 s ASN 221 Ca -0.04 -0.23 -0.00 0.00 -1.02 0.00 0.00 52.86 51.57 1hj4 s ASN 221 Cb -0.15 -0.87 0.00 0.00 0.02 0.00 0.00 41.25 40.25 1hj4 s ASN 221 CO 0.02 0.33 -0.14 -0.32 0.02 0.00 0.00 177.10 177.01 1hj4 s MET 222 N -0.64 3.20 -0.08 -0.60 -2.45 -0.35 -1.14 119.30 117.24 1hj4 s MET 222 Ca 0.10 -0.74 0.04 0.00 -1.25 0.00 0.00 55.69 53.83 1hj4 s MET 222 Cb -0.11 -2.68 -0.01 0.00 1.25 0.00 0.00 34.83 33.28 1hj4 s MET 222 CO 0.01 -0.06 -0.21 0.42 1.05 0.00 0.00 175.02 176.23 1hj4 s ILE 223 N 1.01 2.39 -0.50 10.11 1.01 0.97 -0.18 121.20 136.02 1hj4 s ILE 223 Ca -0.01 -0.93 -0.19 0.00 0.00 0.00 0.00 60.65 59.52 1hj4 s ILE 223 Cb -0.15 -1.92 0.06 0.00 0.01 0.00 0.00 42.46 40.46 1hj4 s ILE 223 CO -0.03 0.56 0.62 -0.62 0.00 0.00 0.00 174.94 175.47 1hj4 s ASP 224 N -0.02 6.23 0.00 3.58 -1.08 -1.09 -1.16 116.67 123.13 1hj4 s ASP 224 Ca -0.07 -0.90 0.18 0.00 -0.52 0.00 0.00 52.55 51.25 1hj4 s ASP 224 Cb -0.15 -2.29 0.83 0.00 -1.46 0.00 0.00 42.92 39.86 1hj4 s ASP 224 CO 0.05 -0.87 1.57 0.18 0.52 0.00 0.00 175.17 176.61 1hj4 n LEU 225 N 6.13 0.00 0.03 -1.34 4.77 -0.51 -2.78 117.00 123.31 1hj4 n LEU 225 Ca -0.06 0.41 0.13 0.00 -0.03 0.00 0.00 56.01 56.45 1hj4 n LEU 225 Cb 0.45 -0.41 0.34 0.00 -2.33 0.00 0.00 43.42 41.47 1hj4 n LEU 225 CO 0.54 -0.16 0.61 0.79 -1.33 0.00 0.00 177.39 177.84 1hj4 n TRP 226 N -1.41 0.29 -2.14 -1.77 7.02 -1.26 -4.83 117.44 113.34 1hj4 n TRP 226 Ca 0.06 0.08 -0.35 0.00 -1.02 0.00 0.00 57.50 56.28 1hj4 n TRP 226 Cb 0.18 -0.53 0.01 0.00 -2.42 0.00 0.00 31.31 28.56 1hj4 n TRP 226 CO 0.00 0.00 0.00 -1.64 -2.02 0.00 0.00 177.69 174.03 1hj4 s MET 227 N -3.06 3.20 0.24 -0.99 -1.94 -1.12 0.23 119.30 115.87 1hj4 s MET 227 Ca 0.10 1.62 -0.04 0.00 -1.71 0.00 0.00 55.69 55.66 1hj4 s MET 227 Cb 0.16 -1.98 0.42 0.00 2.01 0.00 0.00 34.83 35.44 1hj4 s MET 227 CO 0.65 -0.97 1.77 -0.22 -0.01 0.00 0.00 175.02 176.24 1hj4 h LYS 228 N 0.97 0.60 -3.20 2.03 1.63 -1.92 -3.18 116.57 113.51 1hj4 h LYS 228 Ca -0.50 -0.04 -0.63 0.00 -0.85 0.00 0.00 60.65 58.64 1hj4 h LYS 228 Cb 1.27 -0.14 -0.41 0.00 -0.60 0.00 0.00 32.23 32.35 1hj4 h LYS 228 CO 0.56 0.40 -0.67 -1.21 -3.45 0.00 0.00 179.45 175.08 1hj4 s GLU 229 N -6.02 1.76 0.25 1.90 2.02 -1.26 -4.67 118.70 112.69 1hj4 s GLU 229 Ca -0.12 -2.47 -0.29 0.00 0.02 0.00 0.00 54.97 52.11 1hj4 s GLU 229 Cb 0.20 -2.95 -0.15 0.00 0.10 0.00 0.00 34.13 31.32 1hj4 s GLU 229 CO 0.77 -1.15 0.97 -2.30 0.02 0.00 0.00 175.26 173.57 1hj4 n PRO 230 N 3.15 1.11 -3.83 0.39 -0.02 -1.20 -4.98 135.00 129.62 1hj4 n PRO 230 Ca 0.08 0.39 -0.09 0.00 -2.02 0.00 0.00 63.50 61.86 1hj4 n PRO 230 Cb 0.33 -1.74 0.02 0.00 -0.02 0.00 0.00 33.50 32.10 1hj4 n PRO 230 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1hj4 s THR 231 N -0.87 0.00 -0.04 3.45 -1.32 -1.26 -5.00 115.64 110.61 1hj4 s THR 231 Ca 0.62 -1.05 -0.30 0.00 -1.21 0.00 0.00 61.69 59.76 1hj4 s THR 231 Cb -0.77 -2.86 -0.04 0.00 -1.51 0.00 0.00 72.50 67.32 1hj4 s THR 231 CO 0.58 0.00 1.37 -0.89 -2.21 0.00 0.00 174.62 173.47 1hj4 s THR 232 N -2.37 3.88 -0.04 5.08 2.01 -1.26 -2.67 115.64 120.27 1hj4 s THR 232 Ca 0.17 1.20 0.21 0.00 0.31 0.00 0.00 61.69 63.57 1hj4 s THR 232 Cb -0.05 -3.77 -0.32 0.00 0.01 0.00 0.00 72.50 68.37 1hj4 s THR 232 CO 0.12 -0.03 0.43 1.33 -0.69 0.00 0.00 174.62 175.78 1hj4 n VAL 233 N 4.85 0.09 -3.55 3.82 0.24 0.75 -4.69 118.33 119.84 1hj4 n VAL 233 Ca 0.13 -0.50 -0.16 0.00 -2.04 0.00 0.00 64.34 61.77 1hj4 n VAL 233 Cb 0.44 -0.01 -0.06 0.00 -1.47 0.00 0.00 33.84 32.74 1hj4 n VAL 233 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1hj4 s ALA 234 N -3.38 -1.54 0.07 2.33 0.00 -1.16 -0.18 121.76 117.90 1hj4 s ALA 234 Ca -0.08 0.99 -0.06 0.00 0.00 0.00 0.00 51.96 52.81 1hj4 s ALA 234 Cb 0.13 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.38 1hj4 s ALA 234 CO 0.86 -0.41 0.12 -1.83 0.00 0.00 0.00 175.76 174.50 1hj4 s GLU 235 N -1.63 0.75 0.03 0.00 -1.05 -0.17 -1.22 118.70 115.41 1hj4 s GLU 235 Ca -0.09 -0.98 -0.27 0.00 -0.15 0.00 0.00 54.97 53.47 1hj4 s GLU 235 Cb -0.01 0.29 0.08 0.00 -0.44 0.00 0.00 34.13 34.06 1hj4 s GLU 235 CO 0.05 -0.21 0.71 -1.50 0.95 0.00 0.00 175.26 175.27 1hj4 s ILE 236 N -3.66 0.00 -0.14 1.83 2.07 -0.63 -1.39 121.20 119.28 1hj4 s ILE 236 Ca 0.04 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.25 1hj4 s ILE 236 Cb 0.05 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.61 1hj4 s ILE 236 CO -0.10 0.00 -0.06 -0.75 -1.91 0.00 0.00 174.94 172.12 1hj4 s LYS 237 N -2.49 3.56 0.00 3.50 2.20 -1.26 0.14 119.74 125.39 1hj4 s LYS 237 Ca -0.03 -0.56 0.08 0.00 -0.36 0.00 0.00 55.97 55.10 1hj4 s LYS 237 Cb -0.01 -2.82 -0.00 0.00 -1.51 0.00 0.00 37.83 33.49 1hj4 s LYS 237 CO -0.03 0.26 0.56 0.44 -0.36 0.00 0.00 175.35 176.22 1hj4 n ILE 238 N 3.46 0.00 -4.00 5.43 -6.64 -0.25 -4.50 119.36 112.85 1hj4 n ILE 238 Ca -0.18 -0.41 0.01 0.00 -1.77 0.00 0.00 62.75 60.41 1hj4 n ILE 238 Cb 0.53 1.10 0.00 0.00 -1.44 0.00 0.00 39.64 39.82 1hj4 n ILE 238 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1hj4 n GLY 239 N 0.83 0.32 0.10 3.28 0.00 -1.26 -4.84 105.19 103.61 1hj4 n GLY 239 Ca 0.03 -0.87 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 1hj4 n GLY 239 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1hj4 n SER 240 N -0.31 0.59 -3.74 1.61 7.64 0.15 -4.31 113.62 115.24 1hj4 n SER 240 Ca 0.02 0.07 -0.21 0.00 1.01 0.00 0.00 58.87 59.76 1hj4 n SER 240 Cb 0.17 0.48 -0.18 0.00 -1.01 0.00 0.00 64.21 63.68 1hj4 n SER 240 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1hj4 s GLU 241 N -2.52 0.32 0.01 1.43 0.41 -0.80 -4.29 118.70 113.25 1hj4 s GLU 241 Ca -0.14 0.20 -0.12 0.00 -0.41 0.00 0.00 54.97 54.51 1hj4 s GLU 241 Cb 0.07 -0.74 0.01 0.00 -1.78 0.00 0.00 34.13 31.69 1hj4 s GLU 241 CO 0.79 -0.29 0.24 0.00 -0.49 0.00 0.00 175.26 175.51 1hj4 s ALA 242 N 1.92 -0.56 0.00 5.21 0.00 -0.20 -0.02 121.76 128.11 1hj4 s ALA 242 Ca 0.03 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1hj4 s ALA 242 Cb -0.12 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1hj4 s ALA 242 CO -0.04 -0.27 0.00 0.54 0.00 0.00 0.00 175.76 175.99 1hj4 n ARG 243 N 1.16 2.89 -4.20 0.00 5.12 -1.20 -3.91 116.66 116.52 1hj4 n ARG 243 Ca -0.21 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.52 1hj4 n ARG 243 Cb 0.57 -0.33 -0.12 0.00 -1.16 0.00 0.00 32.46 31.42 1hj4 n ARG 243 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1hj4 s SER 244 N -0.34 1.76 -0.08 0.55 1.04 -1.23 -4.61 113.70 110.79 1hj4 s SER 244 Ca 0.00 -0.61 -0.20 0.00 0.48 0.00 0.00 55.95 55.62 1hj4 s SER 244 Cb 0.00 -0.06 0.04 0.00 0.10 0.00 0.00 66.02 66.10 1hj4 s SER 244 CO 0.00 -0.05 0.47 -0.51 0.98 0.00 0.00 173.24 174.12 1hj4 s ILE 245 N -1.22 0.02 0.15 -1.02 2.07 -1.26 -1.14 121.20 118.80 1hj4 s ILE 245 Ca -0.01 -0.20 -0.16 0.00 -1.41 0.00 0.00 60.65 58.87 1hj4 s ILE 245 Cb -0.10 -0.74 0.03 0.00 0.13 0.00 0.00 42.46 41.78 1hj4 s ILE 245 CO 0.02 -0.11 0.43 -0.70 -1.91 0.00 0.00 174.94 172.67 1hj4 s GLU 246 N -0.81 1.16 0.23 3.50 2.56 -0.17 -4.85 118.70 120.32 1hj4 s GLU 246 Ca -0.09 -0.78 0.10 0.00 0.00 0.00 0.00 54.97 54.21 1hj4 s GLU 246 Cb -0.03 0.48 -0.05 0.00 2.00 0.00 0.00 34.13 36.53 1hj4 s GLU 246 CO 0.05 -0.46 -0.14 0.95 -0.56 0.00 0.00 175.26 175.10 1hj4 s THR 247 N -3.83 2.86 0.10 -1.70 -4.23 -1.26 -0.75 115.64 106.82 1hj4 s THR 247 Ca 0.05 -2.01 -0.31 0.00 -1.18 0.00 0.00 61.69 58.24 1hj4 s THR 247 Cb 0.01 -2.46 -0.08 0.00 1.34 0.00 0.00 72.50 71.31 1hj4 s THR 247 CO -0.09 -0.25 1.44 -0.94 -0.54 0.00 0.00 174.62 174.24 1hj4 s SER 248 N -3.18 6.77 0.00 3.99 1.04 -0.55 -4.66 113.70 117.12 1hj4 s SER 248 Ca 0.27 2.35 0.00 0.00 0.48 0.00 0.00 55.95 59.05 1hj4 s SER 248 Cb -0.07 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.47 1hj4 s SER 248 CO 0.15 -0.71 0.89 0.29 0.98 0.00 0.00 173.24 174.84 1hj4 n LYS 249 N 4.33 2.33 -2.61 4.02 5.02 -1.26 -4.29 118.16 125.70 1hj4 n LYS 249 Ca 0.12 -1.28 -0.41 0.00 -2.02 0.00 0.00 58.31 54.72 1hj4 n LYS 249 Cb 0.42 -0.92 -0.04 0.00 -0.02 0.00 0.00 35.03 34.47 1hj4 n LYS 249 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1hj4 s MET 250 N -0.79 4.62 0.11 1.97 1.75 -1.18 -4.63 119.30 121.15 1hj4 s MET 250 Ca 0.00 1.60 -0.36 0.00 -1.25 0.00 0.00 55.69 55.68 1hj4 s MET 250 Cb 0.00 -3.33 -0.16 0.00 2.84 0.00 0.00 34.83 34.18 1hj4 s MET 250 CO 0.00 0.10 1.38 -1.91 -0.65 0.00 0.00 175.02 173.95 1hj4 n GLU 251 N 2.75 1.38 0.00 4.11 2.13 -1.26 -0.75 120.64 128.99 1hj4 n GLU 251 Ca 0.03 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.35 1hj4 n GLU 251 Cb 0.48 -2.16 0.00 0.00 0.27 0.00 0.00 31.44 30.03 1hj4 n GLU 251 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hj4 n GLY 252 N 2.69 2.51 0.76 8.31 0.00 -1.26 -4.87 105.19 113.33 1hj4 n GLY 252 Ca 0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.26 1hj4 n GLY 252 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1hj4 n TRP 253 N -2.00 0.73 -1.73 1.61 7.02 0.07 -5.01 117.44 118.13 1hj4 n TRP 253 Ca 0.00 -1.10 -0.42 0.00 -1.02 0.00 0.00 57.50 54.96 1hj4 n TRP 253 Cb 0.00 -0.32 -0.03 0.00 -2.42 0.00 0.00 31.31 28.55 1hj4 n TRP 253 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1hj4 s GLU 254 N -2.96 4.12 -0.38 -0.99 8.01 -1.25 -1.95 118.70 123.30 1hj4 s GLU 254 Ca 0.40 2.62 0.00 0.00 0.01 0.00 0.00 54.97 58.00 1hj4 s GLU 254 Cb 0.34 -3.06 0.00 0.00 -4.31 0.00 0.00 34.13 27.10 1hj4 s GLU 254 CO 0.05 -0.74 0.00 -0.25 0.01 0.00 0.00 175.26 174.33 1hj4 n ASP 255 N 3.66 -5.08 0.07 -0.19 8.00 -1.26 -4.89 116.55 116.86 1hj4 n ASP 255 Ca 0.15 0.09 -0.21 0.00 0.71 0.00 0.00 54.79 55.53 1hj4 n ASP 255 Cb 0.35 -2.89 -0.13 0.00 -0.02 0.00 0.00 41.12 38.43 1hj4 n ASP 255 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1hj4 h LYS 256 N 0.21 0.49 -4.08 -1.24 1.79 -1.70 -3.37 116.57 108.67 1hj4 h LYS 256 Ca -0.07 -0.68 -0.13 0.00 -2.18 0.00 0.00 60.65 57.60 1hj4 h LYS 256 Cb 0.78 0.23 -0.16 0.00 -1.58 0.00 0.00 32.23 31.50 1hj4 h LYS 256 CO 0.11 1.29 -0.63 0.71 -1.08 0.00 0.00 179.45 179.85 1hj4 s TYR 257 N -2.86 0.39 0.13 -1.35 2.02 -1.26 -0.66 117.35 113.76 1hj4 s TYR 257 Ca -0.11 -0.84 0.07 0.00 -0.37 0.00 0.00 57.07 55.82 1hj4 s TYR 257 Cb 0.04 -0.28 -0.04 0.00 -0.40 0.00 0.00 41.96 41.27 1hj4 s TYR 257 CO 0.88 -0.36 -0.16 0.00 -1.57 0.00 0.00 175.55 174.34 1hj4 s ALA 258 N -3.28 1.71 -0.01 3.71 0.00 -0.48 -1.48 121.76 121.93 1hj4 s ALA 258 Ca 0.01 -1.35 0.02 0.00 0.00 0.00 0.00 51.96 50.64 1hj4 s ALA 258 Cb 0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 1hj4 s ALA 258 CO -0.08 0.19 -0.07 -1.50 0.00 0.00 0.00 175.76 174.30 1hj4 s ILE 259 N -1.94 0.59 0.04 0.00 2.07 0.07 0.01 121.20 122.04 1hj4 s ILE 259 Ca 0.11 -0.29 0.08 0.00 -1.41 0.00 0.00 60.65 59.14 1hj4 s ILE 259 Cb -0.06 -0.52 -0.03 0.00 0.13 0.00 0.00 42.46 41.99 1hj4 s ILE 259 CO 0.04 0.18 -0.23 0.00 -1.91 0.00 0.00 174.94 173.03 1hj4 s ALA 260 N 0.03 1.93 -0.01 1.50 0.00 -0.25 -1.00 121.76 123.95 1hj4 s ALA 260 Ca -0.00 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 50.91 1hj4 s ALA 260 Cb -0.05 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 1hj4 s ALA 260 CO -0.00 0.45 -0.21 0.20 0.00 0.00 0.00 175.76 176.19 1hj4 s GLY 261 N -1.11 1.42 0.13 0.00 0.00 -0.29 -0.93 107.32 106.54 1hj4 s GLY 261 Ca 0.09 -1.11 0.09 0.00 0.00 0.00 0.00 44.72 43.79 1hj4 s GLY 261 CO 0.02 -0.94 -0.22 0.00 0.00 0.00 0.00 173.10 171.96 1hj4 s ALA 262 N -0.73 2.01 -0.03 3.20 0.00 -0.63 -3.24 121.76 122.35 1hj4 s ALA 262 Ca 0.12 -1.37 -0.20 0.00 0.00 0.00 0.00 51.96 50.51 1hj4 s ALA 262 Cb -0.10 -0.27 -0.33 0.00 0.00 0.00 0.00 23.12 22.43 1hj4 s ALA 262 CO 0.01 0.38 0.92 1.88 0.00 0.00 0.00 175.76 178.95 1hj4 h TYR 263 N 3.81 0.67 -3.40 0.00 -1.99 -0.66 -2.53 116.97 112.87 1hj4 h TYR 263 Ca -0.46 -0.49 -0.27 0.00 2.00 0.00 0.00 58.73 59.51 1hj4 h TYR 263 Cb 1.19 -0.03 -0.33 0.00 2.00 0.00 0.00 36.73 39.56 1hj4 h TYR 263 CO 0.63 1.39 -0.67 -0.46 -0.00 0.00 0.00 178.16 179.05 1hj4 s TRP 264 N -2.48 -0.06 0.98 4.88 -0.11 -1.00 -3.68 118.94 117.47 1hj4 s TRP 264 Ca -0.12 0.30 -0.12 0.00 1.22 0.00 0.00 56.10 57.37 1hj4 s TRP 264 Cb 0.02 -0.16 0.18 0.00 -1.50 0.00 0.00 33.47 32.01 1hj4 s TRP 264 CO 0.86 -0.12 1.08 -2.14 -4.62 0.00 0.00 176.95 172.01 1hj4 s PRO 265 N 1.08 0.58 -0.83 5.86 0.02 -1.26 -0.68 135.00 139.77 1hj4 s PRO 265 Ca -0.09 0.77 -0.25 0.00 0.02 0.00 0.00 61.00 61.46 1hj4 s PRO 265 Cb -0.12 -1.73 -0.02 0.00 0.02 0.00 0.00 34.50 32.65 1hj4 s PRO 265 CO -0.04 -2.70 1.78 -2.14 -0.33 0.00 0.00 177.00 173.57 1hj4 s PRO 266 N -4.84 2.81 0.11 5.54 0.02 -1.24 -4.59 135.00 132.81 1hj4 s PRO 266 Ca 0.65 -0.19 -0.26 0.00 0.02 0.00 0.00 61.00 61.22 1hj4 s PRO 266 Cb -0.20 -4.86 0.08 0.00 0.02 0.00 0.00 34.50 29.54 1hj4 s PRO 266 CO 0.59 -2.90 0.81 1.14 -0.33 0.00 0.00 177.00 176.31 1hj4 s GLN 267 N 6.55 1.14 0.09 5.54 -2.07 -1.26 -1.34 119.66 128.32 1hj4 s GLN 267 Ca 0.62 -0.50 0.06 0.00 -1.82 0.00 0.00 55.36 53.72 1hj4 s GLN 267 Cb -0.07 0.47 -0.03 0.00 -1.09 0.00 0.00 33.01 32.28 1hj4 s GLN 267 CO 0.05 -0.51 -0.16 1.52 -1.32 0.00 0.00 175.29 174.87 1hj4 s TYR 268 N -3.42 1.43 -0.09 9.60 -0.85 -0.57 -1.60 117.35 121.85 1hj4 s TYR 268 Ca 0.06 -0.46 0.01 0.00 -0.52 0.00 0.00 57.07 56.16 1hj4 s TYR 268 Cb -0.02 -0.78 0.02 0.00 0.38 0.00 0.00 41.96 41.56 1hj4 s TYR 268 CO -0.06 0.12 -0.11 0.08 -1.52 0.00 0.00 175.55 174.06 1hj4 s VAL 269 N -1.40 1.14 -0.31 -3.49 1.01 -0.10 -1.16 120.40 116.09 1hj4 s VAL 269 Ca 0.03 -0.43 -0.17 0.00 0.00 0.00 0.00 61.98 61.40 1hj4 s VAL 269 Cb -0.09 -1.08 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1hj4 s VAL 269 CO 0.03 0.37 0.49 -0.63 0.00 0.00 0.00 175.10 175.36 1hj4 s ILE 270 N 1.08 5.06 0.18 2.22 1.01 0.22 -1.10 121.20 129.87 1hj4 s ILE 270 Ca -0.07 0.53 0.08 0.00 0.00 0.00 0.00 60.65 61.20 1hj4 s ILE 270 Cb -0.14 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1hj4 s ILE 270 CO -0.01 -0.07 -0.06 -0.04 0.00 0.00 0.00 174.94 174.75 1hj4 s MET 271 N 2.31 2.17 0.22 2.79 -1.94 0.10 -0.73 119.30 124.23 1hj4 s MET 271 Ca 0.19 -1.23 -0.31 0.00 -1.71 0.00 0.00 55.69 52.63 1hj4 s MET 271 Cb -0.16 -2.22 -0.11 0.00 2.01 0.00 0.00 34.83 34.36 1hj4 s MET 271 CO 0.12 0.44 1.61 0.34 -0.01 0.00 0.00 175.02 177.51 1hj4 s ASP 272 N -2.89 6.47 0.37 3.03 -1.08 0.13 -1.38 116.67 121.32 1hj4 s ASP 272 Ca 0.26 2.79 0.27 0.00 -0.52 0.00 0.00 52.55 55.35 1hj4 s ASP 272 Cb -0.09 -2.61 1.16 0.00 -1.46 0.00 0.00 42.92 39.92 1hj4 s ASP 272 CO 0.16 -0.88 1.82 1.23 0.52 0.00 0.00 175.17 178.02 1hj4 h GLY 273 N 6.09 0.00 0.00 2.66 0.00 -1.05 0.37 103.07 111.14 1hj4 h GLY 273 Ca -0.44 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.59 1hj4 h GLY 273 CO 0.88 0.00 -2.21 1.18 0.00 0.00 0.00 176.54 176.40 1hj4 n GLU 274 N -2.54 0.99 0.00 4.80 1.02 -1.26 -4.77 120.64 118.88 1hj4 n GLU 274 Ca 0.01 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1hj4 n GLU 274 Cb 0.24 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1hj4 n GLU 274 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1hj4 n THR 275 N -2.62 0.00 -1.01 2.62 -2.24 -1.19 -4.79 114.28 105.04 1hj4 n THR 275 Ca -0.27 -0.07 -0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1hj4 n THR 275 Cb 1.03 0.55 -0.00 0.00 -2.10 0.00 0.00 70.33 69.81 1hj4 n THR 275 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1hj4 n LEU 276 N -1.35 0.21 -4.68 3.22 4.77 0.11 -4.77 117.00 114.51 1hj4 n LEU 276 Ca 0.00 0.01 -0.45 0.00 -0.03 0.00 0.00 56.01 55.54 1hj4 n LEU 276 Cb 0.00 -1.03 -0.04 0.00 -2.33 0.00 0.00 43.42 40.03 1hj4 n LEU 276 CO 0.00 -0.26 1.20 1.21 -1.33 0.00 0.00 177.39 178.21 1hj4 n GLU 277 N -2.03 2.26 -2.32 3.23 2.13 -1.26 -4.44 120.64 118.21 1hj4 n GLU 277 Ca -0.00 0.81 -0.43 0.00 0.66 0.00 0.00 57.16 58.20 1hj4 n GLU 277 Cb 0.13 -2.58 -0.02 0.00 0.27 0.00 0.00 31.44 29.24 1hj4 n GLU 277 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1hj4 s PRO 278 N 0.74 4.06 -0.23 5.31 0.04 -1.26 -0.69 135.00 142.97 1hj4 s PRO 278 Ca 0.76 1.61 0.03 0.00 0.04 0.00 0.00 61.00 63.44 1hj4 s PRO 278 Cb -0.64 -3.87 -0.16 0.00 0.04 0.00 0.00 34.50 29.87 1hj4 s PRO 278 CO 0.39 -0.94 -0.19 1.63 0.04 0.00 0.00 177.00 177.92 1hj4 n LYS 279 N 7.05 0.62 -3.66 4.56 4.76 0.09 -4.96 118.16 126.61 1hj4 n LYS 279 Ca 0.15 0.13 -0.12 0.00 -2.87 0.00 0.00 58.31 55.60 1hj4 n LYS 279 Cb 0.45 -1.48 -0.12 0.00 -1.84 0.00 0.00 35.03 32.05 1hj4 n LYS 279 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1hj4 s LYS 280 N -2.47 0.21 -0.17 1.97 2.47 -0.99 -5.00 119.74 115.75 1hj4 s LYS 280 Ca -0.31 0.84 -0.05 0.00 -1.56 0.00 0.00 55.97 54.89 1hj4 s LYS 280 Cb 0.08 0.08 -0.03 0.00 -1.46 0.00 0.00 37.83 36.50 1hj4 s LYS 280 CO 0.56 -0.27 0.00 0.42 0.16 0.00 0.00 175.35 176.23 1hj4 s ILE 281 N 2.43 4.23 -0.12 5.43 1.01 -1.26 -0.61 121.20 132.30 1hj4 s ILE 281 Ca -0.00 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.44 1hj4 s ILE 281 Cb -0.12 -2.88 0.01 0.00 0.01 0.00 0.00 42.46 39.48 1hj4 s ILE 281 CO -0.10 0.47 -0.19 -1.10 0.00 0.00 0.00 174.94 174.02 1hj4 s GLN 282 N 0.46 2.66 0.36 2.79 -1.52 -0.31 -5.00 119.66 119.10 1hj4 s GLN 282 Ca -0.01 -0.73 -0.26 0.00 -1.95 0.00 0.00 55.36 52.42 1hj4 s GLN 282 Cb -0.14 -2.15 -0.09 0.00 -0.22 0.00 0.00 33.01 30.41 1hj4 s GLN 282 CO 0.02 0.00 1.09 0.45 -0.25 0.00 0.00 175.29 176.60 1hj4 s SER 283 N 0.79 6.87 0.00 5.90 0.15 -1.26 -1.52 113.70 124.64 1hj4 s SER 283 Ca -0.09 2.18 0.18 0.00 0.70 0.00 0.00 55.95 58.92 1hj4 s SER 283 Cb -0.16 -2.61 0.29 0.00 -1.71 0.00 0.00 66.02 61.84 1hj4 s SER 283 CO 0.00 -0.42 1.22 0.35 1.20 0.00 0.00 173.24 175.60 1hj4 n THR 284 N 0.38 0.41 -1.76 6.45 -2.24 -0.45 -4.92 114.28 112.15 1hj4 n THR 284 Ca 0.03 -0.70 -0.41 0.00 -2.27 0.00 0.00 64.05 60.69 1hj4 n THR 284 Cb 0.47 1.02 -0.00 0.00 -2.10 0.00 0.00 70.33 69.72 1hj4 n THR 284 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hj4 n ARG 285 N 1.09 2.62 -3.45 -0.78 1.74 -1.26 -4.53 116.66 112.09 1hj4 n ARG 285 Ca 0.14 0.92 0.00 0.00 -0.77 0.00 0.00 57.85 58.14 1hj4 n ARG 285 Cb 0.49 -2.65 0.00 0.00 -1.02 0.00 0.00 32.46 29.29 1hj4 n ARG 285 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hj4 n GLY 286 N 0.77 -0.80 3.83 -0.13 0.00 -1.09 -5.03 105.19 102.74 1hj4 n GLY 286 Ca 0.03 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.79 1hj4 n GLY 286 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hj4 s MET 287 N -0.91 4.01 0.48 1.61 -1.94 -1.26 0.15 119.30 121.44 1hj4 s MET 287 Ca 0.00 0.51 -0.23 0.00 -1.71 0.00 0.00 55.69 54.26 1hj4 s MET 287 Cb 0.00 -3.11 -0.07 0.00 2.01 0.00 0.00 34.83 33.66 1hj4 s MET 287 CO 0.00 0.59 1.31 0.95 -0.01 0.00 0.00 175.02 177.86 1hj4 s THR 288 N -1.24 2.46 0.30 2.05 -4.23 -0.09 -4.85 115.64 110.03 1hj4 s THR 288 Ca 0.31 0.37 0.05 0.00 -1.18 0.00 0.00 61.69 61.23 1hj4 s THR 288 Cb -0.17 -3.20 0.07 0.00 1.34 0.00 0.00 72.50 70.54 1hj4 s THR 288 CO 0.17 0.02 1.73 0.10 -0.54 0.00 0.00 174.62 176.11 1hj4 h TYR 289 N 2.01 0.41 0.00 3.99 -0.00 -1.51 -2.55 116.97 119.32 1hj4 h TYR 289 Ca -0.50 -0.09 0.00 0.00 -0.00 0.00 0.00 58.73 58.14 1hj4 h TYR 289 Cb 1.27 -0.10 0.00 0.00 -0.00 0.00 0.00 36.73 37.90 1hj4 h TYR 289 CO 0.50 0.63 -0.61 -0.40 -0.00 0.00 0.00 178.16 178.28 1hj4 n ASP 290 N -4.10 1.80 -0.00 0.10 5.75 -1.26 -4.48 116.55 114.36 1hj4 n ASP 290 Ca -0.01 0.56 0.13 0.00 -0.01 0.00 0.00 54.79 55.47 1hj4 n ASP 290 Cb 0.42 -0.84 0.51 0.00 -1.03 0.00 0.00 41.12 40.18 1hj4 n ASP 290 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1hj4 n GLU 291 N -4.54 0.00 -3.72 0.11 1.02 -1.26 -4.96 120.64 107.29 1hj4 n GLU 291 Ca -0.08 -0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.77 1hj4 n GLU 291 Cb 0.31 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.25 1hj4 n GLU 291 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1hj4 n GLN 292 N -1.50 -1.12 -4.85 3.49 6.02 -0.96 -5.00 117.38 113.46 1hj4 n GLN 292 Ca 0.07 0.62 -0.25 0.00 -0.01 0.00 0.00 57.00 57.42 1hj4 n GLN 292 Cb 0.34 -3.35 -0.15 0.00 1.02 0.00 0.00 30.24 28.09 1hj4 n GLN 292 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1hj4 s GLU 293 N -5.54 1.44 0.28 -1.09 2.12 -1.26 -4.85 118.70 109.80 1hj4 s GLU 293 Ca 0.25 -0.64 -0.30 0.00 0.36 0.00 0.00 54.97 54.64 1hj4 s GLU 293 Cb -0.11 -1.39 -0.11 0.00 0.26 0.00 0.00 34.13 32.78 1hj4 s GLU 293 CO 0.88 0.38 1.54 -0.47 -0.54 0.00 0.00 175.26 177.06 1hj4 s TYR 294 N -0.43 2.82 -0.13 5.30 5.04 -1.26 -0.92 117.35 127.78 1hj4 s TYR 294 Ca 0.07 0.87 0.00 0.00 -2.44 0.00 0.00 57.07 55.57 1hj4 s TYR 294 Cb -0.07 -3.99 0.02 0.00 0.35 0.00 0.00 41.96 38.27 1hj4 s TYR 294 CO -0.01 -3.29 -0.12 -1.58 -1.34 0.00 0.00 175.55 169.21 1hj4 s HIS 295 N -0.06 1.93 -2.15 4.97 5.65 0.12 -4.89 115.29 120.86 1hj4 s HIS 295 Ca 0.62 -1.03 0.19 0.00 0.25 0.00 0.00 55.06 55.08 1hj4 s HIS 295 Cb -0.46 -1.46 0.83 0.00 -1.18 0.00 0.00 32.58 30.31 1hj4 s HIS 295 CO 0.47 -0.60 1.57 -0.35 -0.65 0.00 0.00 174.74 175.19 1hj4 n PRO 296 N 4.75 1.43 -3.02 2.88 -0.04 -1.26 -2.66 135.00 137.07 1hj4 n PRO 296 Ca -0.16 -0.65 -0.15 0.00 -0.04 0.00 0.00 63.50 62.50 1hj4 n PRO 296 Cb 0.50 -1.33 0.01 0.00 -0.04 0.00 0.00 33.50 32.64 1hj4 n PRO 296 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1hj4 n GLU 297 N -0.11 0.98 -2.83 0.54 2.13 -1.26 -4.89 120.64 115.20 1hj4 n GLU 297 Ca 0.14 -2.84 -0.43 0.00 0.66 0.00 0.00 57.16 54.69 1hj4 n GLU 297 Cb 0.22 -1.46 -0.04 0.00 0.27 0.00 0.00 31.44 30.43 1hj4 n GLU 297 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1hj4 s PRO 298 N -1.41 3.15 0.40 5.31 0.02 -1.26 -4.77 135.00 136.43 1hj4 s PRO 298 Ca 0.33 -0.83 -0.25 0.00 0.02 0.00 0.00 61.00 60.27 1hj4 s PRO 298 Cb 0.32 -4.27 -0.08 0.00 0.02 0.00 0.00 34.50 30.49 1hj4 s PRO 298 CO -0.07 -1.85 1.18 1.03 -0.33 0.00 0.00 177.00 176.96 1hj4 s ARG 299 N 4.16 4.06 -0.02 5.54 0.52 -1.26 -4.66 118.95 127.29 1hj4 s ARG 299 Ca 0.24 1.87 -0.28 0.00 -0.52 0.00 0.00 55.73 57.04 1hj4 s ARG 299 Cb -0.15 -2.69 -0.03 0.00 0.52 0.00 0.00 34.95 32.59 1hj4 s ARG 299 CO 0.09 -0.32 0.88 0.08 0.02 0.00 0.00 175.30 176.05 1hj4 s VAL 300 N -1.39 4.93 0.00 3.52 1.01 -0.95 -0.97 120.40 126.54 1hj4 s VAL 300 Ca 0.57 1.84 0.00 0.00 0.00 0.00 0.00 61.98 64.39 1hj4 s VAL 300 Cb -0.31 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 31.85 1hj4 s VAL 300 CO 0.40 0.19 0.00 0.00 0.00 0.00 0.00 175.10 175.69 1hj4 n ALA 301 N 3.84 0.00 -1.76 5.51 0.00 -0.15 -4.48 120.51 123.47 1hj4 n ALA 301 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.08 1hj4 n ALA 301 Cb 0.51 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.98 1hj4 n ALA 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hj4 s ALA 302 N -2.61 3.13 -0.14 0.00 0.00 -0.49 -4.63 121.76 117.02 1hj4 s ALA 302 Ca 0.00 1.36 0.01 0.00 0.00 0.00 0.00 51.96 53.33 1hj4 s ALA 302 Cb 0.00 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.58 1hj4 s ALA 302 CO 0.00 -1.15 -0.14 0.42 0.00 0.00 0.00 175.76 174.89 1hj4 s ILE 303 N -1.25 1.53 0.45 0.00 1.01 -1.26 -1.61 121.20 120.07 1hj4 s ILE 303 Ca 0.63 -0.62 0.06 0.00 0.00 0.00 0.00 60.65 60.71 1hj4 s ILE 303 Cb -0.41 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 1hj4 s ILE 303 CO 0.52 0.45 0.12 -0.76 0.00 0.00 0.00 174.94 175.27 1hj4 s LEU 304 N 1.34 2.82 -0.09 2.97 1.02 0.18 -4.67 118.68 122.24 1hj4 s LEU 304 Ca 0.01 -1.30 0.03 0.00 0.02 0.00 0.00 54.13 52.89 1hj4 s LEU 304 Cb -0.13 -1.11 0.01 0.00 0.02 0.00 0.00 46.19 44.97 1hj4 s LEU 304 CO -0.08 -0.66 -0.18 0.00 0.02 0.00 0.00 176.35 175.46 1hj4 s ALA 305 N -2.71 1.76 0.41 4.21 0.00 -1.26 -0.62 121.76 123.55 1hj4 s ALA 305 Ca 0.31 -0.74 -0.25 0.00 0.00 0.00 0.00 51.96 51.28 1hj4 s ALA 305 Cb 0.04 -0.75 -0.08 0.00 0.00 0.00 0.00 23.12 22.33 1hj4 s ALA 305 CO 0.17 0.12 1.24 0.45 0.00 0.00 0.00 175.76 177.74 1hj4 s SER 306 N 0.64 6.34 0.00 0.00 0.15 -0.46 -4.81 113.70 115.56 1hj4 s SER 306 Ca -0.14 2.52 0.21 0.00 0.70 0.00 0.00 55.95 59.24 1hj4 s SER 306 Cb -0.16 -2.63 -0.20 0.00 -1.71 0.00 0.00 66.02 61.32 1hj4 s SER 306 CO 0.04 -0.82 0.92 1.41 1.20 0.00 0.00 173.24 175.99 1hj4 n HIS 307 N 0.02 0.00 -0.10 3.44 8.25 -1.26 -3.13 115.22 122.44 1hj4 n HIS 307 Ca 0.04 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.40 1hj4 n HIS 307 Cb 0.45 -0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.40 1hj4 n HIS 307 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1hj4 n TYR 308 N -1.36 0.02 -4.08 4.41 4.02 -1.26 -4.65 117.16 114.26 1hj4 n TYR 308 Ca 0.05 0.01 -0.07 0.00 -0.01 0.00 0.00 57.90 57.87 1hj4 n TYR 308 Cb 0.34 -1.00 -0.10 0.00 -0.02 0.00 0.00 39.34 38.56 1hj4 n TYR 308 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1hj4 s ARG 309 N -2.49 0.57 -1.05 -0.72 0.52 -1.26 -4.98 118.95 109.53 1hj4 s ARG 309 Ca -0.12 -1.13 -0.16 0.00 -0.52 0.00 0.00 55.73 53.79 1hj4 s ARG 309 Cb 0.06 0.18 -0.08 0.00 0.52 0.00 0.00 34.95 35.64 1hj4 s ARG 309 CO 0.81 -0.10 2.12 -0.35 0.02 0.00 0.00 175.30 177.80 1hj4 n PRO 310 N 0.32 2.13 -4.13 3.54 -0.04 -1.26 -4.46 135.00 131.10 1hj4 n PRO 310 Ca -0.15 -2.01 -0.15 0.00 -0.04 0.00 0.00 63.50 61.15 1hj4 n PRO 310 Cb 0.60 -2.93 -0.11 0.00 -0.04 0.00 0.00 33.50 31.02 1hj4 n PRO 310 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1hj4 s GLU 311 N 4.03 0.70 0.02 0.54 2.02 -1.26 -1.70 118.70 123.05 1hj4 s GLU 311 Ca 0.52 -0.93 -0.02 0.00 0.02 0.00 0.00 54.97 54.57 1hj4 s GLU 311 Cb 0.14 -0.51 -0.04 0.00 0.10 0.00 0.00 34.13 33.82 1hj4 s GLU 311 CO 0.02 0.10 0.19 -0.06 0.02 0.00 0.00 175.26 175.53 1hj4 s PHE 312 N -1.67 3.54 -0.33 1.61 0.08 0.38 -1.35 117.98 120.25 1hj4 s PHE 312 Ca -0.03 0.31 -0.04 0.00 0.12 0.00 0.00 56.93 57.29 1hj4 s PHE 312 Cb -0.08 -1.80 0.05 0.00 -0.57 0.00 0.00 43.02 40.62 1hj4 s PHE 312 CO 0.01 0.62 0.06 0.42 -0.10 0.00 0.00 175.22 176.23 1hj4 s ILE 313 N -1.40 3.35 -0.22 0.64 1.01 0.21 -1.05 121.20 123.74 1hj4 s ILE 313 Ca 0.30 -1.35 -0.01 0.00 0.00 0.00 0.00 60.65 59.60 1hj4 s ILE 313 Cb -0.13 -2.95 0.02 0.00 0.01 0.00 0.00 42.46 39.41 1hj4 s ILE 313 CO 0.22 -0.19 -0.12 -0.69 0.00 0.00 0.00 174.94 174.17 1hj4 s VAL 314 N 1.30 2.62 -0.22 2.92 1.01 0.13 -0.65 120.40 127.52 1hj4 s VAL 314 Ca -0.02 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 60.80 1hj4 s VAL 314 Cb -0.20 -2.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1hj4 s VAL 314 CO 0.00 0.37 0.83 0.20 0.00 0.00 0.00 175.10 176.50 1hj4 s ASN 315 N 1.33 6.87 -0.39 3.32 0.01 -0.63 -0.63 114.94 124.82 1hj4 s ASN 315 Ca 0.03 1.07 -0.08 0.00 -0.71 0.00 0.00 52.86 53.18 1hj4 s ASN 315 Cb -0.15 -2.44 0.07 0.00 0.41 0.00 0.00 41.25 39.14 1hj4 s ASN 315 CO -0.08 -0.48 0.20 -0.69 -1.51 0.00 0.00 177.10 174.54 1hj4 s VAL 316 N 2.64 4.01 0.01 1.60 1.01 -0.05 -0.97 120.40 128.64 1hj4 s VAL 316 Ca 0.36 -1.35 -0.02 0.00 0.00 0.00 0.00 61.98 60.97 1hj4 s VAL 316 Cb -0.16 -3.41 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 1hj4 s VAL 316 CO 0.09 -0.40 1.04 0.50 0.00 0.00 0.00 175.10 176.32 1hj4 h LYS 317 N 8.31 -0.06 0.00 2.72 3.64 -1.24 -2.27 116.57 127.68 1hj4 h LYS 317 Ca -0.22 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.10 1hj4 h LYS 317 Cb 1.08 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1hj4 h LYS 317 CO 0.70 -0.04 -0.28 0.93 -2.27 0.00 0.00 179.45 178.48 1hj4 h GLU 318 N -0.07 0.00 0.00 1.90 3.07 -1.86 -0.59 114.58 117.03 1hj4 h GLU 318 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1hj4 h GLU 318 Cb 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 1hj4 h GLU 318 CO -0.01 0.28 -0.77 0.25 -1.40 0.00 0.00 179.01 177.37 1hj4 n THR 319 N -3.55 0.09 -3.16 1.13 -2.24 -1.25 -4.74 114.28 100.57 1hj4 n THR 319 Ca -0.01 -0.11 -0.15 0.00 -2.27 0.00 0.00 64.05 61.52 1hj4 n THR 319 Cb 0.43 0.32 0.05 0.00 -2.10 0.00 0.00 70.33 69.03 1hj4 n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hj4 n GLY 320 N 1.44 -0.06 3.26 3.38 0.00 -0.88 -1.37 105.19 110.97 1hj4 n GLY 320 Ca 0.04 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1hj4 n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hj4 s LYS 321 N -5.61 2.68 -0.24 1.61 1.02 -1.07 -0.77 119.74 117.36 1hj4 s LYS 321 Ca 0.29 -0.90 -0.09 0.00 0.02 0.00 0.00 55.97 55.29 1hj4 s LYS 321 Cb -0.13 -2.20 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 1hj4 s LYS 321 CO 0.49 0.33 0.11 0.42 -0.92 0.00 0.00 175.35 175.77 1hj4 s ILE 322 N -0.03 4.76 -0.21 2.17 1.01 -0.40 -0.88 121.20 127.62 1hj4 s ILE 322 Ca -0.08 -0.02 -0.10 0.00 0.00 0.00 0.00 60.65 60.45 1hj4 s ILE 322 Cb -0.15 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 1hj4 s ILE 322 CO 0.05 0.34 0.12 -0.76 0.00 0.00 0.00 174.94 174.70 1hj4 s LEU 323 N 1.33 4.10 -0.44 2.97 1.43 0.20 -0.60 118.68 127.66 1hj4 s LEU 323 Ca 0.06 0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 53.19 1hj4 s LEU 323 Cb -0.15 -2.07 0.07 0.00 0.03 0.00 0.00 46.19 44.08 1hj4 s LEU 323 CO 0.05 0.14 0.33 -0.76 0.23 0.00 0.00 176.35 176.34 1hj4 s LEU 324 N 0.57 5.37 -0.37 1.79 1.43 -0.20 -0.69 118.68 126.58 1hj4 s LEU 324 Ca 0.07 -1.37 -0.12 0.00 -1.03 0.00 0.00 54.13 51.69 1hj4 s LEU 324 Cb -0.12 -2.09 0.02 0.00 0.03 0.00 0.00 46.19 44.03 1hj4 s LEU 324 CO 0.00 -0.58 0.22 -0.69 0.23 0.00 0.00 176.35 175.53 1hj4 s VAL 325 N 1.55 4.70 -0.33 -1.59 1.01 -0.21 -1.01 120.40 124.51 1hj4 s VAL 325 Ca 0.03 -0.78 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 1hj4 s VAL 325 Cb -0.23 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.56 1hj4 s VAL 325 CO 0.05 -0.22 1.08 -0.62 0.00 0.00 0.00 175.10 175.39 1hj4 s ASP 326 N 1.58 6.90 -0.08 3.32 -1.08 -0.59 -0.47 116.67 126.26 1hj4 s ASP 326 Ca 0.03 0.99 0.13 0.00 -0.52 0.00 0.00 52.55 53.18 1hj4 s ASP 326 Cb -0.19 -2.54 0.50 0.00 -1.46 0.00 0.00 42.92 39.23 1hj4 s ASP 326 CO 0.07 -0.91 1.36 0.00 0.52 0.00 0.00 175.17 176.21 1hj4 n TYR 327 N 6.95 1.03 0.17 -5.34 0.18 -0.69 -4.16 117.16 115.30 1hj4 n TYR 327 Ca 0.12 -0.41 0.05 0.00 1.88 0.00 0.00 57.90 59.54 1hj4 n TYR 327 Cb 0.47 -0.18 0.18 0.00 -0.38 0.00 0.00 39.34 39.44 1hj4 n TYR 327 CO 0.00 0.00 0.00 1.79 -2.08 0.00 0.00 176.86 176.57 1hj4 h THR 328 N 2.85 0.74 -2.26 -3.48 1.35 -1.92 -3.42 112.91 106.78 1hj4 h THR 328 Ca 0.00 -1.78 -0.30 0.00 -0.55 0.00 0.00 66.41 63.78 1hj4 h THR 328 Cb 1.07 2.17 -0.34 0.00 -1.73 0.00 0.00 68.15 69.32 1hj4 h THR 328 CO 0.16 0.38 -0.61 -0.62 -0.25 0.00 0.00 175.52 174.58 1hj4 s ASP 329 N -6.38 1.34 0.04 5.36 -1.08 -1.26 -5.02 116.67 109.68 1hj4 s ASP 329 Ca 0.03 -0.39 0.27 0.00 -0.52 0.00 0.00 52.55 51.94 1hj4 s ASP 329 Cb 0.09 0.55 0.86 0.00 -1.46 0.00 0.00 42.92 42.96 1hj4 s ASP 329 CO 0.71 -0.35 1.69 0.18 0.52 0.00 0.00 175.17 177.91 1hj4 n LEU 330 N 5.32 0.34 -0.05 -1.34 4.77 -1.26 -3.69 117.00 121.09 1hj4 n LEU 330 Ca -0.04 0.34 -0.22 0.00 -0.03 0.00 0.00 56.01 56.06 1hj4 n LEU 330 Cb 0.48 -0.36 -0.13 0.00 -2.33 0.00 0.00 43.42 41.08 1hj4 n LEU 330 CO 0.04 0.00 -0.71 0.47 -1.33 0.00 0.00 177.39 175.87 1hj4 n ASP 331 N -1.68 2.01 -4.22 -1.43 8.00 -1.26 -4.40 116.55 113.56 1hj4 n ASP 331 Ca 0.06 0.30 -0.41 0.00 0.71 0.00 0.00 54.79 55.45 1hj4 n ASP 331 Cb 0.36 -0.90 -0.03 0.00 -0.02 0.00 0.00 41.12 40.53 1hj4 n ASP 331 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1hj4 n ASN 332 N -3.90 4.98 -4.62 -2.24 3.02 -1.25 -5.03 115.26 106.22 1hj4 n ASN 332 Ca -0.33 -3.10 -0.43 0.00 -0.03 0.00 0.00 54.58 50.70 1hj4 n ASN 332 Cb 0.89 -1.23 -0.03 0.00 -0.61 0.00 0.00 39.78 38.80 1hj4 n ASN 332 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1hj4 s LEU 333 N -1.40 3.87 -0.19 3.41 2.96 -1.24 -4.73 118.68 121.36 1hj4 s LEU 333 Ca 0.30 0.72 -0.22 0.00 -0.22 0.00 0.00 54.13 54.72 1hj4 s LEU 333 Cb -0.08 -3.45 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 1hj4 s LEU 333 CO -0.09 -0.98 0.66 -0.54 -1.32 0.00 0.00 176.35 174.07 1hj4 s LYS 334 N 3.83 4.24 0.11 1.98 1.02 -1.26 -5.03 119.74 124.63 1hj4 s LYS 334 Ca 0.44 0.69 0.04 0.00 0.02 0.00 0.00 55.97 57.16 1hj4 s LYS 334 Cb -0.11 -3.57 -0.04 0.00 -0.52 0.00 0.00 37.83 33.60 1hj4 s LYS 334 CO 0.21 -0.23 -0.11 0.95 -0.92 0.00 0.00 175.35 175.25 1hj4 s THR 335 N 1.87 1.07 -0.22 2.17 -4.23 -1.26 -1.55 115.64 113.49 1hj4 s THR 335 Ca 0.30 -1.76 0.02 0.00 -1.18 0.00 0.00 61.69 59.08 1hj4 s THR 335 Cb -0.16 -1.51 0.04 0.00 1.34 0.00 0.00 72.50 72.21 1hj4 s THR 335 CO 0.11 -0.58 -0.16 -0.89 -0.54 0.00 0.00 174.62 172.56 1hj4 s THR 336 N -2.61 2.11 -0.57 3.99 2.01 -0.18 -4.97 115.64 115.43 1hj4 s THR 336 Ca 0.09 -1.29 -0.17 0.00 0.31 0.00 0.00 61.69 60.63 1hj4 s THR 336 Cb -0.02 -2.07 0.12 0.00 0.01 0.00 0.00 72.50 70.54 1hj4 s THR 336 CO 0.01 0.26 0.59 -0.70 -0.69 0.00 0.00 174.62 174.09 1hj4 s GLU 337 N 1.20 3.03 -0.28 4.92 2.12 -1.26 -1.03 118.70 127.39 1hj4 s GLU 337 Ca -0.02 -1.57 -0.20 0.00 0.36 0.00 0.00 54.97 53.55 1hj4 s GLU 337 Cb -0.16 -4.29 -0.02 0.00 0.26 0.00 0.00 34.13 29.92 1hj4 s GLU 337 CO -0.09 -1.42 0.59 0.42 -0.54 0.00 0.00 175.26 174.22 1hj4 s ILE 338 N 2.02 4.99 -0.05 -3.70 1.01 0.23 -4.94 121.20 120.77 1hj4 s ILE 338 Ca 0.07 0.91 -0.30 0.00 0.00 0.00 0.00 60.65 61.34 1hj4 s ILE 338 Cb -0.27 -3.94 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1hj4 s ILE 338 CO 0.04 -0.04 1.53 -0.44 0.00 0.00 0.00 174.94 176.02 1hj4 s SER 339 N 1.58 6.75 0.00 3.58 0.01 -1.26 -1.28 113.70 123.08 1hj4 s SER 339 Ca 0.24 2.13 0.00 0.00 1.31 0.00 0.00 55.95 59.64 1hj4 s SER 339 Cb -0.15 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1hj4 s SER 339 CO 0.10 -0.84 0.00 0.00 0.41 0.00 0.00 173.24 172.91 1hj4 n ALA 340 N 6.48 0.00 -3.20 1.44 0.00 0.06 -4.90 120.51 120.39 1hj4 n ALA 340 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.47 1hj4 n ALA 340 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.78 1hj4 n ALA 340 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1hj4 s GLU 341 N 1.40 0.44 0.72 0.00 2.56 -1.20 -5.02 118.70 117.61 1hj4 s GLU 341 Ca 0.00 0.22 -0.14 0.00 0.00 0.00 0.00 54.97 55.04 1hj4 s GLU 341 Cb 0.00 0.21 0.04 0.00 2.00 0.00 0.00 34.13 36.37 1hj4 s GLU 341 CO 0.00 -0.08 1.16 1.03 -0.56 0.00 0.00 175.26 176.80 1hj4 s ARG 342 N -0.31 2.29 -0.47 4.30 0.52 -1.26 -3.95 118.95 120.08 1hj4 s ARG 342 Ca -0.04 1.56 -0.00 0.00 -0.52 0.00 0.00 55.73 56.72 1hj4 s ARG 342 Cb -0.03 -1.87 0.00 0.00 0.52 0.00 0.00 34.95 33.57 1hj4 s ARG 342 CO 0.01 -1.68 0.01 1.19 0.02 0.00 0.00 175.30 174.86 1hj4 n PHE 343 N -2.80 -0.27 -1.70 -0.53 3.72 -0.28 -4.62 117.46 110.98 1hj4 n PHE 343 Ca 0.12 0.01 -0.44 0.00 -0.05 0.00 0.00 57.45 57.08 1hj4 n PHE 343 Cb 0.51 -1.79 -0.03 0.00 -0.94 0.00 0.00 39.48 37.24 1hj4 n PHE 343 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1hj4 n LEU 344 N -0.80 3.57 0.00 4.37 4.77 -1.24 -2.05 117.00 125.61 1hj4 n LEU 344 Ca -0.06 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 1hj4 n LEU 344 Cb 0.55 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1hj4 n LEU 344 CO 0.08 -0.16 0.00 1.57 -1.33 0.00 0.00 177.39 177.55 1hj4 n HIS 345 N 2.77 0.00 -3.83 -1.77 -0.00 -0.09 -4.28 115.22 108.02 1hj4 n HIS 345 Ca 0.13 0.00 -0.24 0.00 0.46 0.00 0.00 57.72 58.08 1hj4 n HIS 345 Cb 0.33 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.16 1hj4 n HIS 345 CO 0.00 0.00 0.00 0.16 0.46 0.00 0.00 176.34 176.96 1hj4 s ASP 346 N 1.00 4.73 0.00 0.26 -4.77 -1.26 -1.39 116.67 115.24 1hj4 s ASP 346 Ca 0.00 -1.00 0.00 0.00 -3.30 0.00 0.00 52.55 48.25 1hj4 s ASP 346 Cb 0.00 -0.26 0.00 0.00 -1.09 0.00 0.00 42.92 41.57 1hj4 s ASP 346 CO 0.00 -0.75 0.00 0.61 0.70 0.00 0.00 175.17 175.73 1hj4 n GLY 347 N -1.51 -0.94 3.60 2.12 0.00 -0.81 -1.09 105.19 106.56 1hj4 n GLY 347 Ca 0.01 -1.08 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 1hj4 n GLY 347 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hj4 s GLY 348 N 0.00 0.65 0.36 -0.02 0.00 -0.18 -4.04 107.32 104.09 1hj4 s GLY 348 Ca 0.00 -0.95 -0.13 0.00 0.00 0.00 0.00 44.72 43.64 1hj4 s GLY 348 CO 0.00 -0.65 0.76 1.08 0.00 0.00 0.00 173.10 174.29 1hj4 s LEU 349 N -3.05 3.95 0.00 0.66 1.43 -1.26 -0.85 118.68 119.56 1hj4 s LEU 349 Ca 0.23 1.22 -0.17 0.00 -1.03 0.00 0.00 54.13 54.38 1hj4 s LEU 349 Cb -0.01 -4.06 0.26 0.00 0.03 0.00 0.00 46.19 42.40 1hj4 s LEU 349 CO 0.11 -0.30 0.92 -0.90 0.23 0.00 0.00 176.35 176.42 1hj4 n ASP 350 N -0.79 -1.90 0.17 2.29 5.75 -0.25 -4.84 116.55 116.97 1hj4 n ASP 350 Ca 0.03 -1.07 0.05 0.00 -0.01 0.00 0.00 54.79 53.80 1hj4 n ASP 350 Cb 0.53 -0.85 0.51 0.00 -1.03 0.00 0.00 41.12 40.29 1hj4 n ASP 350 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1hj4 h GLY 351 N -2.36 0.18 1.79 6.12 0.00 -1.92 -1.09 103.07 105.80 1hj4 h GLY 351 Ca -0.35 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1hj4 h GLY 351 CO 0.23 0.08 -0.11 -1.14 0.00 0.00 0.00 176.54 175.60 1hj4 n SER 352 N -4.42 0.13 -1.02 0.19 3.41 -1.26 -4.91 113.62 105.74 1hj4 n SER 352 Ca -0.01 0.35 -0.12 0.00 -0.26 0.00 0.00 58.87 58.82 1hj4 n SER 352 Cb 0.16 -0.35 -0.04 0.00 -0.26 0.00 0.00 64.21 63.71 1hj4 n SER 352 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1hj4 n HIS 353 N -1.52 -0.10 -0.10 7.33 8.25 -0.41 -4.89 115.22 123.78 1hj4 n HIS 353 Ca 0.07 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.38 1hj4 n HIS 353 Cb 0.34 -2.34 -0.14 0.00 1.12 0.00 0.00 29.99 28.97 1hj4 n HIS 353 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1hj4 n ARG 354 N -2.57 0.67 -4.28 -0.41 0.63 -1.26 -4.40 116.66 105.05 1hj4 n ARG 354 Ca -0.13 0.11 -0.34 0.00 -0.92 0.00 0.00 57.85 56.58 1hj4 n ARG 354 Cb 0.44 -1.56 -0.11 0.00 0.45 0.00 0.00 32.46 31.68 1hj4 n ARG 354 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1hj4 s TYR 355 N -2.52 3.11 -0.26 -0.14 2.02 -1.26 -1.18 117.35 117.12 1hj4 s TYR 355 Ca -0.22 -0.13 -0.15 0.00 -0.37 0.00 0.00 57.07 56.20 1hj4 s TYR 355 Cb 0.08 -1.98 -0.04 0.00 -0.40 0.00 0.00 41.96 39.62 1hj4 s TYR 355 CO 0.72 0.08 0.38 0.12 -1.57 0.00 0.00 175.55 175.28 1hj4 s PHE 356 N 0.22 3.27 -0.26 2.71 5.36 0.07 -1.10 117.98 128.26 1hj4 s PHE 356 Ca -0.00 0.46 -0.02 0.00 -0.96 0.00 0.00 56.93 56.41 1hj4 s PHE 356 Cb -0.13 -2.57 0.03 0.00 -0.34 0.00 0.00 43.02 40.01 1hj4 s PHE 356 CO 0.02 -0.19 -0.04 0.42 -1.46 0.00 0.00 175.22 173.96 1hj4 s ILE 357 N 1.95 2.91 0.05 3.12 1.01 -0.03 -0.45 121.20 129.77 1hj4 s ILE 357 Ca 0.16 -1.12 0.04 0.00 0.00 0.00 0.00 60.65 59.73 1hj4 s ILE 357 Cb -0.16 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.75 1hj4 s ILE 357 CO 0.09 0.11 -0.12 0.28 0.00 0.00 0.00 174.94 175.30 1hj4 s THR 358 N 1.30 0.95 -0.23 2.92 -1.32 0.23 -1.01 115.64 118.48 1hj4 s THR 358 Ca -0.01 -1.08 -0.21 0.00 -1.21 0.00 0.00 61.69 59.17 1hj4 s THR 358 Cb -0.18 -0.91 -0.02 0.00 -1.51 0.00 0.00 72.50 69.88 1hj4 s THR 358 CO -0.03 -0.15 0.66 0.00 -2.21 0.00 0.00 174.62 172.89 1hj4 s ALA 359 N -1.07 3.58 -1.19 11.08 0.00 -0.25 0.19 121.76 134.11 1hj4 s ALA 359 Ca -0.02 -0.31 -0.14 0.00 0.00 0.00 0.00 51.96 51.49 1hj4 s ALA 359 Cb -0.09 -3.05 0.17 0.00 0.00 0.00 0.00 23.12 20.16 1hj4 s ALA 359 CO 0.01 -0.71 1.40 0.00 0.00 0.00 0.00 175.76 176.46 1hj4 s ALA 360 N 2.28 4.01 0.18 0.00 0.00 0.02 -0.92 121.76 127.33 1hj4 s ALA 360 Ca 0.29 -3.36 -0.15 0.00 0.00 0.00 0.00 51.96 48.74 1hj4 s ALA 360 Cb -0.16 -4.09 0.15 0.00 0.00 0.00 0.00 23.12 19.02 1hj4 s ALA 360 CO 0.09 -2.75 1.67 -2.95 0.00 0.00 0.00 175.76 171.82 1hj4 h ASN 361 N 7.22 -0.34 0.37 0.00 7.08 -1.65 -2.08 115.58 126.19 1hj4 h ASN 361 Ca 0.30 0.13 -0.00 0.00 -3.08 0.00 0.00 56.30 53.65 1hj4 h ASN 361 Cb 0.88 0.25 -0.00 0.00 -2.08 0.00 0.00 38.32 37.37 1hj4 h ASN 361 CO 1.22 -0.12 -0.02 0.00 -2.08 0.00 0.00 177.43 176.44 1hj4 h ALA 362 N 1.45 1.05 -0.52 4.14 0.00 -1.86 -2.08 119.26 121.44 1hj4 h ALA 362 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1hj4 h ALA 362 Cb 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1hj4 h ALA 362 CO -0.45 0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.36 1hj4 n ARG 363 N -3.18 2.68 -2.96 0.00 1.74 -0.83 -4.95 116.66 109.16 1hj4 n ARG 363 Ca -0.02 -2.33 -0.21 0.00 -0.77 0.00 0.00 57.85 54.52 1hj4 n ARG 363 Cb 0.17 -1.43 0.01 0.00 -1.02 0.00 0.00 32.46 30.19 1hj4 n ARG 363 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1hj4 n ASN 364 N 1.15 -5.07 -4.49 0.55 3.02 -0.78 -4.97 115.26 104.67 1hj4 n ASN 364 Ca 0.18 -0.21 -0.25 0.00 -0.03 0.00 0.00 54.58 54.27 1hj4 n ASN 364 Cb 0.53 -4.16 -0.10 0.00 -0.61 0.00 0.00 39.78 35.44 1hj4 n ASN 364 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1hj4 s LYS 365 N -5.61 1.74 -0.24 3.52 -0.14 -1.05 -1.95 119.74 116.00 1hj4 s LYS 365 Ca 0.25 -1.64 -0.02 0.00 -1.36 0.00 0.00 55.97 53.20 1hj4 s LYS 365 Cb -0.12 -1.86 0.02 0.00 -1.68 0.00 0.00 37.83 34.19 1hj4 s LYS 365 CO 0.31 0.36 -0.06 -0.51 -0.76 0.00 0.00 175.35 174.68 1hj4 s LEU 366 N -3.30 3.09 -0.07 3.17 1.43 0.64 -0.80 118.68 122.85 1hj4 s LEU 366 Ca 0.28 -0.78 -0.16 0.00 -1.03 0.00 0.00 54.13 52.44 1hj4 s LEU 366 Cb -0.06 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 1hj4 s LEU 366 CO 0.14 -0.10 0.42 -0.69 0.23 0.00 0.00 176.35 176.35 1hj4 s VAL 367 N 1.35 5.12 -0.15 -1.59 1.01 0.13 -1.73 120.40 124.55 1hj4 s VAL 367 Ca 0.01 0.84 0.01 0.00 0.00 0.00 0.00 61.98 62.85 1hj4 s VAL 367 Cb -0.16 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.48 1hj4 s VAL 367 CO -0.05 0.46 -0.17 -0.69 0.00 0.00 0.00 175.10 174.65 1hj4 s VAL 368 N -0.22 2.47 -0.06 2.92 1.01 0.16 -0.60 120.40 126.07 1hj4 s VAL 368 Ca 0.23 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1hj4 s VAL 368 Cb -0.16 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 1hj4 s VAL 368 CO 0.11 0.53 -0.16 -0.63 0.00 0.00 0.00 175.10 174.95 1hj4 s ILE 369 N 0.82 2.90 -0.46 2.22 -1.09 0.41 -0.66 121.20 125.33 1hj4 s ILE 369 Ca -0.06 -0.77 -0.21 0.00 -2.23 0.00 0.00 60.65 57.39 1hj4 s ILE 369 Cb -0.15 -2.14 0.03 0.00 -1.58 0.00 0.00 42.46 38.62 1hj4 s ILE 369 CO -0.01 0.58 0.66 -0.62 -1.23 0.00 0.00 174.94 174.32 1hj4 s ASP 370 N -0.50 6.30 0.29 3.58 -1.08 -0.33 -0.75 116.67 124.18 1hj4 s ASP 370 Ca 0.06 -0.48 0.25 0.00 -0.52 0.00 0.00 52.55 51.86 1hj4 s ASP 370 Cb -0.12 -2.32 1.00 0.00 -1.46 0.00 0.00 42.92 40.03 1hj4 s ASP 370 CO 0.01 -0.83 1.75 0.71 0.52 0.00 0.00 175.17 177.33 1hj4 h THR 371 N 5.88 0.00 0.15 1.71 1.35 -1.46 0.17 112.91 120.72 1hj4 h THR 371 Ca -0.26 -0.29 -0.20 0.00 -0.55 0.00 0.00 66.41 65.11 1hj4 h THR 371 Cb 1.09 1.07 0.02 0.00 -1.73 0.00 0.00 68.15 68.61 1hj4 h THR 371 CO 0.92 0.00 -0.89 0.50 -0.25 0.00 0.00 175.52 175.80 1hj4 h LYS 372 N 0.00 0.34 0.00 4.72 3.64 -1.92 -3.36 116.57 119.99 1hj4 h LYS 372 Ca 0.00 -0.56 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 1hj4 h LYS 372 Cb 0.42 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1hj4 h LYS 372 CO 0.00 1.27 -0.87 0.39 -2.27 0.00 0.00 179.45 177.97 1hj4 n GLU 373 N -4.08 0.23 -2.81 1.90 -0.58 -1.20 -4.98 120.64 109.12 1hj4 n GLU 373 Ca -0.14 0.01 -0.10 0.00 -0.42 0.00 0.00 57.16 56.52 1hj4 n GLU 373 Cb 0.85 -1.59 0.04 0.00 -0.57 0.00 0.00 31.44 30.18 1hj4 n GLU 373 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1hj4 n GLY 374 N 1.39 0.07 3.29 0.62 0.00 0.03 -5.04 105.19 105.55 1hj4 n GLY 374 Ca 0.03 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 1hj4 n GLY 374 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hj4 s LYS 375 N -4.93 0.91 0.26 1.61 -2.85 -1.10 -5.00 119.74 108.64 1hj4 s LYS 375 Ca 0.07 -0.50 -0.30 0.00 -1.00 0.00 0.00 55.97 54.24 1hj4 s LYS 375 Cb -0.03 0.40 -0.10 0.00 -2.06 0.00 0.00 37.83 36.04 1hj4 s LYS 375 CO 0.37 -0.32 1.42 -1.17 0.10 0.00 0.00 175.35 175.76 1hj4 s LEU 376 N -2.22 4.39 -0.09 2.77 2.96 -1.26 -1.18 118.68 124.04 1hj4 s LEU 376 Ca -0.03 2.67 0.04 0.00 -0.22 0.00 0.00 54.13 56.60 1hj4 s LEU 376 Cb 0.00 -3.63 -0.09 0.00 0.50 0.00 0.00 46.19 42.97 1hj4 s LEU 376 CO -0.05 -0.68 -0.03 0.52 -1.32 0.00 0.00 176.35 174.79 1hj4 n VAL 377 N 2.10 0.59 -3.52 1.68 0.31 0.16 -4.87 118.33 114.79 1hj4 n VAL 377 Ca 0.06 -0.30 -0.12 0.00 -0.01 0.00 0.00 64.34 63.97 1hj4 n VAL 377 Cb 0.40 -0.82 -0.04 0.00 -0.91 0.00 0.00 33.84 32.47 1hj4 n VAL 377 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hj4 s ALA 378 N -2.21 -1.82 -0.08 3.52 0.00 -1.11 -5.00 121.76 115.05 1hj4 s ALA 378 Ca -0.09 1.20 -0.02 0.00 0.00 0.00 0.00 51.96 53.05 1hj4 s ALA 378 Cb 0.03 0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.21 1hj4 s ALA 378 CO 0.30 -0.51 0.04 0.42 0.00 0.00 0.00 175.76 176.02 1hj4 s ILE 379 N -2.13 0.11 -0.01 0.00 1.01 -1.26 -0.67 121.20 118.25 1hj4 s ILE 379 Ca -0.01 0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.80 1hj4 s ILE 379 Cb -0.01 -0.42 0.00 0.00 0.01 0.00 0.00 42.46 42.04 1hj4 s ILE 379 CO -0.02 0.10 -0.05 -1.61 0.00 0.00 0.00 174.94 173.36 1hj4 s GLU 380 N 2.07 0.45 0.06 2.79 0.41 -0.70 -4.96 118.70 118.82 1hj4 s GLU 380 Ca 0.04 -0.15 -0.30 0.00 -0.41 0.00 0.00 54.97 54.15 1hj4 s GLU 380 Cb -0.13 -0.46 -0.05 0.00 -1.78 0.00 0.00 34.13 31.72 1hj4 s GLU 380 CO -0.05 0.07 0.96 0.34 -0.49 0.00 0.00 175.26 176.09 1hj4 s ASP 381 N 0.09 7.43 0.41 -0.19 -1.08 -1.26 -0.26 116.67 121.81 1hj4 s ASP 381 Ca -0.01 1.72 0.27 0.00 -0.52 0.00 0.00 52.55 54.01 1hj4 s ASP 381 Cb -0.04 -2.58 0.83 0.00 -1.46 0.00 0.00 42.92 39.67 1hj4 s ASP 381 CO -0.00 -0.15 1.77 0.71 0.52 0.00 0.00 175.17 178.02 1hj4 h THR 382 N 4.38 0.00 0.00 1.71 1.35 -1.75 -3.46 112.91 115.14 1hj4 h THR 382 Ca -0.42 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1hj4 h THR 382 Cb 1.21 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1hj4 h THR 382 CO 0.73 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.61 1hj4 n GLY 383 N 0.66 1.18 3.86 5.82 0.00 -1.26 -4.89 105.19 110.56 1hj4 n GLY 383 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1hj4 n GLY 383 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hj4 s GLY 384 N -1.78 2.43 -0.31 -0.02 0.00 -1.26 -5.11 107.32 101.28 1hj4 s GLY 384 Ca 0.00 -1.33 -0.08 0.00 0.00 0.00 0.00 44.72 43.31 1hj4 s GLY 384 CO 0.00 -1.95 0.12 1.20 0.00 0.00 0.00 173.10 172.47 1hj4 s GLN 385 N -4.16 3.16 -0.60 2.90 -1.52 -1.26 -4.74 119.66 113.44 1hj4 s GLN 385 Ca 0.33 -0.82 -0.03 0.00 -1.95 0.00 0.00 55.36 52.88 1hj4 s GLN 385 Cb -0.01 -3.47 0.00 0.00 -0.22 0.00 0.00 33.01 29.31 1hj4 s GLN 385 CO 0.20 -0.45 0.60 2.41 -0.25 0.00 0.00 175.29 177.79 1hj4 n THR 386 N 4.92 -9.29 -1.76 -0.19 -1.04 -1.25 -0.81 114.28 104.85 1hj4 n THR 386 Ca -0.14 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 1hj4 n THR 386 Cb 0.48 -6.61 -0.03 0.00 -1.82 0.00 0.00 70.33 62.35 1hj4 n THR 386 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1hj4 s PRO 387 N -2.89 4.14 -0.43 -2.82 0.04 -1.26 -1.28 135.00 130.50 1hj4 s PRO 387 Ca 0.04 2.57 0.03 0.00 0.04 0.00 0.00 61.00 63.68 1hj4 s PRO 387 Cb -0.01 -3.08 0.15 0.00 0.04 0.00 0.00 34.50 31.61 1hj4 s PRO 387 CO 0.66 -0.72 0.30 -1.58 0.04 0.00 0.00 177.00 175.70 1hj4 s HIS 388 N 1.02 1.40 -0.17 0.56 2.46 -0.60 -4.55 115.29 115.41 1hj4 s HIS 388 Ca 0.73 -2.24 0.25 0.00 0.47 0.00 0.00 55.06 54.27 1hj4 s HIS 388 Cb -0.49 -1.28 0.66 0.00 -0.13 0.00 0.00 32.58 31.34 1hj4 s HIS 388 CO 0.34 -0.79 1.72 -1.00 -2.47 0.00 0.00 174.74 172.54 1hj4 h PRO 389 N 6.24 0.00 0.00 2.88 0.13 -1.77 -3.39 132.00 136.08 1hj4 h PRO 389 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1hj4 h PRO 389 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1hj4 h PRO 389 CO 0.39 0.10 0.00 0.41 -0.23 0.00 0.00 178.00 178.68 1hj4 n GLY 390 N 0.69 3.60 0.02 1.56 0.00 -1.25 -0.54 105.19 109.27 1hj4 n GLY 390 Ca 0.02 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1hj4 n GLY 390 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hj4 n ARG 391 N 13.77 0.09 0.00 1.61 1.74 -1.26 -1.92 116.66 130.70 1hj4 n ARG 391 Ca 0.00 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1hj4 n ARG 391 Cb 0.00 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.94 1hj4 n ARG 391 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hj4 n GLY 392 N 1.48 -2.12 2.74 -0.13 0.00 0.29 -3.49 105.19 103.96 1hj4 n GLY 392 Ca 0.07 -1.58 -0.24 0.00 0.00 0.00 0.00 46.02 44.27 1hj4 n GLY 392 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hj4 s ALA 393 N -1.18 0.68 -0.10 4.61 0.00 -0.91 -4.75 121.76 120.11 1hj4 s ALA 393 Ca 0.00 -0.22 -0.13 0.00 0.00 0.00 0.00 51.96 51.61 1hj4 s ALA 393 Cb 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 22.23 1hj4 s ALA 393 CO 0.00 -0.67 0.32 -0.80 0.00 0.00 0.00 175.76 174.62 1hj4 s ASN 394 N 1.99 6.57 0.25 0.00 0.01 0.35 -0.20 114.94 123.91 1hj4 s ASN 394 Ca 0.04 0.67 -0.17 0.00 -0.71 0.00 0.00 52.86 52.69 1hj4 s ASN 394 Cb -0.13 -2.20 0.01 0.00 0.41 0.00 0.00 41.25 39.34 1hj4 s ASN 394 CO -0.06 0.21 0.59 0.72 -1.51 0.00 0.00 177.10 177.05 1hj4 s PHE 395 N -0.23 0.06 -0.50 2.20 -0.71 -0.48 -4.74 117.98 113.59 1hj4 s PHE 395 Ca 0.19 -0.46 -0.17 0.00 -1.04 0.00 0.00 56.93 55.45 1hj4 s PHE 395 Cb -0.14 0.44 0.08 0.00 -1.21 0.00 0.00 43.02 42.18 1hj4 s PHE 395 CO 0.07 -1.09 0.49 0.08 -1.34 0.00 0.00 175.22 173.44 1hj4 s VAL 396 N -3.96 5.12 0.14 -2.49 1.01 -1.26 -0.71 120.40 118.25 1hj4 s VAL 396 Ca 0.16 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 60.84 1hj4 s VAL 396 Cb -0.03 -4.23 -0.08 0.00 0.00 0.00 0.00 36.38 32.05 1hj4 s VAL 396 CO 0.06 -0.72 1.26 -2.28 0.00 0.00 0.00 175.10 173.42 1hj4 s HIS 397 N 1.94 3.36 0.46 5.22 2.46 -0.33 -4.90 115.29 123.50 1hj4 s HIS 397 Ca 0.07 1.26 0.22 0.00 0.47 0.00 0.00 55.06 57.08 1hj4 s HIS 397 Cb -0.24 -3.51 1.21 0.00 -0.13 0.00 0.00 32.58 29.91 1hj4 s HIS 397 CO 0.07 -1.58 1.87 -1.35 -2.47 0.00 0.00 174.74 171.29 1hj4 h PRO 398 N 5.97 0.27 0.00 2.88 0.11 -1.81 -1.13 132.00 138.28 1hj4 h PRO 398 Ca -0.43 -0.02 -0.36 0.00 0.11 0.00 0.00 66.00 65.30 1hj4 h PRO 398 Cb 1.21 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 1hj4 h PRO 398 CO 0.79 0.18 -2.25 2.41 -0.21 0.00 0.00 178.00 178.92 1hj4 n THR 399 N -4.44 1.23 0.21 -1.15 -1.04 -1.26 -4.72 114.28 103.11 1hj4 n THR 399 Ca 0.18 -0.38 0.11 0.00 -2.04 0.00 0.00 64.05 61.92 1hj4 n THR 399 Cb 0.76 -1.58 0.18 0.00 -1.82 0.00 0.00 70.33 67.86 1hj4 n THR 399 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 1hj4 h PHE 400 N -0.49 0.00 0.00 -1.42 0.04 -1.89 -3.50 116.94 109.69 1hj4 h PHE 400 Ca -0.54 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.23 1hj4 h PHE 400 Cb 1.60 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.75 1hj4 h PHE 400 CO -0.03 0.10 0.00 0.41 -0.60 0.00 0.00 178.31 178.18 1hj4 n GLY 401 N 1.05 -1.63 3.68 -1.45 0.00 -0.43 -4.89 105.19 101.51 1hj4 n GLY 401 Ca 0.03 -1.61 -0.48 0.00 0.00 0.00 0.00 46.02 43.96 1hj4 n GLY 401 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1hj4 n PRO 402 N 0.00 2.14 -4.20 1.61 -0.02 -1.26 -1.19 135.00 132.08 1hj4 n PRO 402 Ca 0.00 0.78 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 1hj4 n PRO 402 Cb 0.00 -2.61 -0.10 0.00 -0.02 0.00 0.00 33.50 30.77 1hj4 n PRO 402 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1hj4 s VAL 403 N 3.33 0.95 -0.05 -1.45 -7.23 0.11 -1.78 120.40 114.28 1hj4 s VAL 403 Ca 0.90 -1.92 0.06 0.00 -1.81 0.00 0.00 61.98 59.21 1hj4 s VAL 403 Cb -0.70 -1.67 -0.01 0.00 0.56 0.00 0.00 36.38 34.56 1hj4 s VAL 403 CO 0.49 -0.75 -0.24 0.86 -0.31 0.00 0.00 175.10 175.15 1hj4 s TRP 404 N -3.23 2.28 0.12 2.82 -0.00 -0.62 -1.38 118.94 118.94 1hj4 s TRP 404 Ca 0.12 -0.65 0.09 0.00 -0.00 0.00 0.00 56.10 55.66 1hj4 s TRP 404 Cb 0.02 -1.50 -0.04 0.00 -0.00 0.00 0.00 33.47 31.95 1hj4 s TRP 404 CO -0.01 -0.19 -0.19 0.00 -0.00 0.00 0.00 176.95 176.55 1hj4 s ALA 405 N -0.17 2.64 0.03 5.86 0.00 0.72 -0.92 121.76 129.92 1hj4 s ALA 405 Ca -0.02 -1.37 0.01 0.00 0.00 0.00 0.00 51.96 50.58 1hj4 s ALA 405 Cb -0.13 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 1hj4 s ALA 405 CO 0.03 0.59 -0.06 -0.08 0.00 0.00 0.00 175.76 176.24 1hj4 s THR 406 N -1.14 0.36 0.47 0.00 -1.32 -0.71 -2.14 115.64 111.16 1hj4 s THR 406 Ca 0.17 -0.85 0.07 0.00 -1.21 0.00 0.00 61.69 59.87 1hj4 s THR 406 Cb -0.10 -0.43 0.07 0.00 -1.51 0.00 0.00 72.50 70.52 1hj4 s THR 406 CO 0.10 -0.33 0.55 -1.54 -2.21 0.00 0.00 174.62 171.19 1hj4 n SER 407 N 1.80 1.98 -4.13 8.08 3.41 -1.26 -0.79 113.62 122.71 1hj4 n SER 407 Ca -0.21 -2.37 -0.17 0.00 -0.26 0.00 0.00 58.87 55.86 1hj4 n SER 407 Cb 0.56 -0.24 -0.12 0.00 -0.26 0.00 0.00 64.21 64.14 1hj4 n SER 407 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1hj4 s HIS 408 N -2.06 1.07 0.08 7.33 3.76 -1.14 -1.55 115.29 122.77 1hj4 s HIS 408 Ca 0.42 -0.43 -0.01 0.00 -0.15 0.00 0.00 55.06 54.89 1hj4 s HIS 408 Cb -0.03 -0.62 -0.26 0.00 1.11 0.00 0.00 32.58 32.78 1hj4 s HIS 408 CO 0.27 0.02 1.14 0.52 -0.85 0.00 0.00 174.74 175.83 1hj4 h MET 409 N 4.55 0.19 0.00 1.40 2.86 -1.18 -2.71 114.93 120.04 1hj4 h MET 409 Ca -0.39 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 56.93 1hj4 h MET 409 Cb 1.19 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.97 1hj4 h MET 409 CO 0.41 1.14 -0.37 0.41 1.06 0.00 0.00 176.91 179.56 1hj4 n GLY 410 N 1.50 -1.52 2.87 8.32 0.00 0.00 -0.27 105.19 116.09 1hj4 n GLY 410 Ca -0.07 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 1hj4 n GLY 410 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hj4 n ASP 411 N -2.12 -1.42 -0.99 1.61 5.68 -1.24 -4.78 116.55 113.29 1hj4 n ASP 411 Ca 0.04 -2.44 0.06 0.00 -0.50 0.00 0.00 54.79 51.95 1hj4 n ASP 411 Cb 0.43 2.50 0.21 0.00 -1.14 0.00 0.00 41.12 43.12 1hj4 n ASP 411 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1hj4 n ASP 412 N -1.60 2.86 -4.84 -1.12 5.68 -1.26 -4.07 116.55 112.20 1hj4 n ASP 412 Ca -0.03 -2.19 -0.34 0.00 -0.50 0.00 0.00 54.79 51.73 1hj4 n ASP 412 Cb 0.48 -0.40 -0.06 0.00 -1.14 0.00 0.00 41.12 40.00 1hj4 n ASP 412 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1hj4 s SER 413 N -0.81 6.87 -0.16 -1.12 1.04 -1.26 -0.21 113.70 118.04 1hj4 s SER 413 Ca 0.30 1.27 0.00 0.00 0.48 0.00 0.00 55.95 58.00 1hj4 s SER 413 Cb 0.19 -2.36 -0.00 0.00 0.10 0.00 0.00 66.02 63.94 1hj4 s SER 413 CO 0.16 -0.07 -0.15 -0.69 0.98 0.00 0.00 173.24 173.48 1hj4 s VAL 414 N -1.73 2.68 -0.02 5.02 1.01 0.70 -2.87 120.40 125.19 1hj4 s VAL 414 Ca 0.47 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.73 1hj4 s VAL 414 Cb -0.13 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 1hj4 s VAL 414 CO 0.19 0.51 -0.14 0.00 0.00 0.00 0.00 175.10 175.66 1hj4 s ALA 415 N 0.85 2.69 -0.09 5.51 0.00 0.03 -1.54 121.76 129.20 1hj4 s ALA 415 Ca -0.04 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 50.89 1hj4 s ALA 415 Cb -0.15 -0.92 -0.02 0.00 0.00 0.00 0.00 23.12 22.02 1hj4 s ALA 415 CO -0.01 0.57 -0.12 -0.51 0.00 0.00 0.00 175.76 175.69 1hj4 s LEU 416 N -1.00 2.83 -0.05 0.00 1.43 -0.73 -1.74 118.68 119.42 1hj4 s LEU 416 Ca 0.13 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 53.07 1hj4 s LEU 416 Cb -0.11 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 1hj4 s LEU 416 CO 0.03 0.26 -0.24 -0.51 0.23 0.00 0.00 176.35 176.12 1hj4 s ILE 417 N -0.20 1.93 0.19 -0.59 2.07 -0.09 -0.65 121.20 123.87 1hj4 s ILE 417 Ca 0.01 -1.00 -0.30 0.00 -1.41 0.00 0.00 60.65 57.94 1hj4 s ILE 417 Cb -0.13 -1.63 -0.09 0.00 0.13 0.00 0.00 42.46 40.74 1hj4 s ILE 417 CO 0.03 0.54 1.33 -0.83 -1.91 0.00 0.00 174.94 174.10 1hj4 s GLY 418 N -0.18 2.41 -0.15 1.50 0.00 -0.90 -1.59 107.32 108.42 1hj4 s GLY 418 Ca -0.02 1.12 0.15 0.00 0.00 0.00 0.00 44.72 45.98 1hj4 s GLY 418 CO 0.03 2.11 1.17 -1.30 0.00 0.00 0.00 173.10 175.11 1hj4 n THR 419 N 2.72 1.86 -3.63 0.90 -2.24 -0.73 -0.55 114.28 112.61 1hj4 n THR 419 Ca 0.07 -2.49 -0.28 0.00 -2.27 0.00 0.00 64.05 59.08 1hj4 n THR 419 Cb 0.43 -0.16 -0.11 0.00 -2.10 0.00 0.00 70.33 68.38 1hj4 n THR 419 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1hj4 s ASP 420 N -2.89 3.05 0.41 3.42 2.15 -1.26 -4.95 116.67 116.59 1hj4 s ASP 420 Ca 0.33 -3.19 0.09 0.00 0.43 0.00 0.00 52.55 50.20 1hj4 s ASP 420 Cb 0.30 -0.95 0.86 0.00 -0.30 0.00 0.00 42.92 42.84 1hj4 s ASP 420 CO -0.02 -0.17 2.01 -0.65 -0.17 0.00 0.00 175.17 176.17 1hj4 h PRO 421 N 5.85 0.37 0.05 4.34 0.11 -1.92 0.93 132.00 141.73 1hj4 h PRO 421 Ca 0.16 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.15 1hj4 h PRO 421 Cb 0.87 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 31.91 1hj4 h PRO 421 CO 0.50 0.34 -0.32 1.49 -0.21 0.00 0.00 178.00 179.80 1hj4 h GLU 422 N 0.37 0.12 0.00 1.05 4.57 -1.96 -3.21 114.58 115.52 1hj4 h GLU 422 Ca 0.09 -0.20 -0.22 0.00 -1.18 0.00 0.00 59.36 57.85 1hj4 h GLU 422 Cb 0.13 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.76 1hj4 h GLU 422 CO -0.01 1.09 -1.40 0.78 -1.18 0.00 0.00 179.01 178.30 1hj4 h GLY 423 N -0.74 0.00 -5.94 1.92 0.00 -1.97 -3.40 103.07 92.95 1hj4 h GLY 423 Ca -0.05 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.76 1hj4 h GLY 423 CO 0.06 0.00 -1.09 1.42 0.00 0.00 0.00 176.54 176.93 1hj4 n HIS 424 N -3.05 0.59 -0.20 5.60 8.25 0.31 -4.99 115.22 121.73 1hj4 n HIS 424 Ca -0.10 -3.79 0.07 0.00 -0.26 0.00 0.00 57.72 53.64 1hj4 n HIS 424 Cb 0.94 -0.42 0.35 0.00 1.12 0.00 0.00 29.99 31.98 1hj4 n HIS 424 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1hj4 h PRO 425 N 3.31 0.73 0.00 -0.41 0.13 -1.58 -1.71 132.00 132.47 1hj4 h PRO 425 Ca 0.10 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.15 1hj4 h PRO 425 Cb 0.88 -0.17 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 1hj4 h PRO 425 CO 0.54 0.48 -0.16 -0.44 -0.23 0.00 0.00 178.00 178.19 1hj4 h ASP 426 N 0.75 0.00 0.13 1.44 3.32 -1.90 -2.89 116.42 117.28 1hj4 h ASP 426 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1hj4 h ASP 426 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1hj4 h ASP 426 CO -0.12 0.16 -1.27 0.59 -1.72 0.00 0.00 179.24 176.89 1hj4 n ASN 427 N -3.47 0.61 -4.71 6.45 3.02 -0.71 -4.92 115.26 111.53 1hj4 n ASN 427 Ca -0.01 -0.49 -0.42 0.00 -0.03 0.00 0.00 54.58 53.63 1hj4 n ASN 427 Cb 0.33 1.20 -0.03 0.00 -0.61 0.00 0.00 39.78 40.66 1hj4 n ASN 427 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hj4 s ALA 428 N -3.20 3.86 -1.75 5.41 0.00 -0.83 -2.61 121.76 122.64 1hj4 s ALA 428 Ca 0.03 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1hj4 s ALA 428 Cb 0.15 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1hj4 s ALA 428 CO 0.86 -0.97 0.00 0.91 0.00 0.00 0.00 175.76 176.55 1hj4 n TRP 429 N 4.44 -0.77 -4.50 0.00 5.03 0.29 -4.89 117.44 117.03 1hj4 n TRP 429 Ca 0.16 0.00 -0.31 0.00 3.03 0.00 0.00 57.50 60.38 1hj4 n TRP 429 Cb 0.37 -3.56 -0.12 0.00 -1.03 0.00 0.00 31.31 26.97 1hj4 n TRP 429 CO 0.00 0.00 0.00 0.15 -0.03 0.00 0.00 177.69 177.81 1hj4 s LYS 430 N -4.57 2.13 -0.36 -0.99 -0.14 -1.07 -4.87 119.74 109.86 1hj4 s LYS 430 Ca 0.00 -0.97 -0.29 0.00 -1.36 0.00 0.00 55.97 53.35 1hj4 s LYS 430 Cb 0.00 -2.26 0.01 0.00 -1.68 0.00 0.00 37.83 33.90 1hj4 s LYS 430 CO 0.00 0.54 1.34 0.42 -0.76 0.00 0.00 175.35 176.89 1hj4 s ILE 431 N -1.02 4.04 -0.14 2.17 -1.09 -1.26 -2.11 121.20 121.79 1hj4 s ILE 431 Ca 0.17 1.12 0.20 0.00 -2.23 0.00 0.00 60.65 59.90 1hj4 s ILE 431 Cb -0.11 -4.21 -0.16 0.00 -1.58 0.00 0.00 42.46 36.40 1hj4 s ILE 431 CO 0.08 -0.64 0.71 0.18 -1.23 0.00 0.00 174.94 174.03 1hj4 n LEU 432 N 8.18 0.56 -3.48 2.97 4.77 0.18 -4.99 117.00 125.19 1hj4 n LEU 432 Ca 0.15 0.24 -0.10 0.00 -0.03 0.00 0.00 56.01 56.27 1hj4 n LEU 432 Cb 0.47 0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.62 1hj4 n LEU 432 CO 0.67 0.07 0.58 -0.62 -1.33 0.00 0.00 177.39 176.76 1hj4 s ASP 433 N -5.36 -0.45 -0.19 -1.43 -1.08 -1.25 -5.01 116.67 101.90 1hj4 s ASP 433 Ca -0.04 0.06 -0.08 0.00 -0.52 0.00 0.00 52.55 51.96 1hj4 s ASP 433 Cb 0.10 0.47 0.08 0.00 -1.46 0.00 0.00 42.92 42.10 1hj4 s ASP 433 CO 0.83 -0.73 0.43 -0.55 0.52 0.00 0.00 175.17 175.67 1hj4 s SER 434 N -2.44 -0.39 0.06 -0.34 0.15 -1.26 -1.78 113.70 107.70 1hj4 s SER 434 Ca 0.02 0.99 -0.10 0.00 0.70 0.00 0.00 55.95 57.56 1hj4 s SER 434 Cb -0.01 1.16 0.01 0.00 -1.71 0.00 0.00 66.02 65.46 1hj4 s SER 434 CO -0.09 -0.22 0.22 0.72 1.20 0.00 0.00 173.24 175.08 1hj4 s PHE 435 N 2.14 0.04 0.35 3.44 -0.12 -0.59 -4.94 117.98 118.30 1hj4 s PHE 435 Ca -0.05 -0.31 -0.23 0.00 -0.05 0.00 0.00 56.93 56.29 1hj4 s PHE 435 Cb -0.10 -0.00 -0.10 0.00 -0.63 0.00 0.00 43.02 42.19 1hj4 s PHE 435 CO -0.13 -0.49 0.91 -1.25 -0.05 0.00 0.00 175.22 174.20 1hj4 s PRO 436 N -3.02 4.38 0.00 1.99 0.04 -1.26 -0.21 135.00 136.91 1hj4 s PRO 436 Ca -0.02 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1hj4 s PRO 436 Cb 0.01 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 32.00 1hj4 s PRO 436 CO -0.06 0.17 0.00 0.00 0.04 0.00 0.00 177.00 177.14 1hj4 n ALA 437 N 0.07 0.00 -0.10 8.56 0.00 0.70 -4.89 120.51 124.84 1hj4 n ALA 437 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.38 1hj4 n ALA 437 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 1hj4 n ALA 437 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1hj4 h LEU 438 N 0.00 0.45 0.00 0.00 3.38 -1.88 -3.49 115.31 113.78 1hj4 h LEU 438 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1hj4 h LEU 438 Cb 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1hj4 h LEU 438 CO 0.00 0.53 0.00 0.61 0.09 0.00 0.00 178.44 179.67 1hj4 n GLY 439 N -0.65 -1.04 3.62 0.83 0.00 -1.26 -5.05 105.19 101.63 1hj4 n GLY 439 Ca -0.02 -1.10 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 1hj4 n GLY 439 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hj4 s GLY 440 N 0.00 1.56 0.00 -0.02 0.00 -1.26 -4.22 107.32 103.39 1hj4 s GLY 440 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 44.46 1hj4 s GLY 440 CO 0.00 0.38 0.00 0.61 0.00 0.00 0.00 173.10 174.09 1hj4 n GLY 441 N -0.47 0.54 3.77 0.20 0.00 0.62 -3.60 105.19 106.25 1hj4 n GLY 441 Ca 0.05 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.92 1hj4 n GLY 441 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hj4 s SER 442 N -2.70 6.72 -0.02 1.61 0.15 -1.02 -0.31 113.70 118.12 1hj4 s SER 442 Ca 0.00 2.20 0.00 0.00 0.70 0.00 0.00 55.95 58.86 1hj4 s SER 442 Cb 0.00 -2.60 -0.02 0.00 -1.71 0.00 0.00 66.02 61.69 1hj4 s SER 442 CO 0.00 -0.53 -0.02 0.18 1.20 0.00 0.00 173.24 174.07 1hj4 n LEU 443 N 0.16 2.80 -3.92 3.45 4.77 -1.26 -3.32 117.00 119.68 1hj4 n LEU 443 Ca 0.04 -0.01 -0.18 0.00 -0.03 0.00 0.00 56.01 55.83 1hj4 n LEU 443 Cb 0.48 -0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 41.33 1hj4 n LEU 443 CO 0.49 0.51 -0.40 -0.36 -1.33 0.00 0.00 177.39 176.29 1hj4 s PHE 444 N -2.05 0.60 -0.03 -1.77 0.08 -1.26 -3.90 117.98 109.65 1hj4 s PHE 444 Ca -0.03 -0.13 0.05 0.00 0.12 0.00 0.00 56.93 56.93 1hj4 s PHE 444 Cb 0.01 -0.49 -0.03 0.00 -0.57 0.00 0.00 43.02 41.94 1hj4 s PHE 444 CO 0.06 -0.10 -0.17 -1.50 -0.10 0.00 0.00 175.22 173.41 1hj4 s ILE 445 N 0.47 2.84 -0.06 0.64 2.07 -1.26 -2.22 121.20 123.67 1hj4 s ILE 445 Ca -0.06 -0.86 -0.12 0.00 -1.41 0.00 0.00 60.65 58.21 1hj4 s ILE 445 Cb -0.09 -2.10 0.02 0.00 0.13 0.00 0.00 42.46 40.42 1hj4 s ILE 445 CO -0.00 0.56 0.29 -0.75 -1.91 0.00 0.00 174.94 173.13 1hj4 s LYS 446 N -0.80 0.49 0.36 3.50 2.47 0.09 -4.48 119.74 121.38 1hj4 s LYS 446 Ca 0.12 0.10 -0.10 0.00 -1.56 0.00 0.00 55.97 54.53 1hj4 s LYS 446 Cb -0.10 0.23 0.03 0.00 -1.46 0.00 0.00 37.83 36.52 1hj4 s LYS 446 CO 0.01 -0.11 0.64 -0.08 0.16 0.00 0.00 175.35 175.97 1hj4 s THR 447 N -0.58 0.00 -0.06 3.43 -1.32 -1.26 -0.81 115.64 115.04 1hj4 s THR 447 Ca -0.07 -1.28 -0.19 0.00 -1.21 0.00 0.00 61.69 58.95 1hj4 s THR 447 Cb -0.04 -2.75 0.04 0.00 -1.51 0.00 0.00 72.50 68.24 1hj4 s THR 447 CO 0.02 0.00 0.43 -2.28 -2.21 0.00 0.00 174.62 170.58 1hj4 s HIS 448 N -2.70 -0.37 0.44 9.09 2.46 -1.26 -4.73 115.29 118.23 1hj4 s HIS 448 Ca 0.22 0.69 0.22 0.00 0.47 0.00 0.00 55.06 56.67 1hj4 s HIS 448 Cb -0.03 0.18 1.21 0.00 -0.13 0.00 0.00 32.58 33.81 1hj4 s HIS 448 CO 0.15 -0.40 1.83 -1.35 -2.47 0.00 0.00 174.74 172.50 1hj4 h PRO 449 N 4.07 0.28 -0.01 2.88 0.11 -1.94 -0.46 132.00 136.93 1hj4 h PRO 449 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1hj4 h PRO 449 Cb 1.17 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1hj4 h PRO 449 CO 0.35 0.19 -0.14 0.09 -0.21 0.00 0.00 178.00 178.28 1hj4 n ASN 450 N -4.48 0.74 -4.84 -2.05 3.02 -1.26 -4.88 115.26 101.51 1hj4 n ASN 450 Ca 0.22 -0.80 -0.32 0.00 -0.03 0.00 0.00 54.58 53.65 1hj4 n ASN 450 Cb 0.86 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.98 1hj4 n ASN 450 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1hj4 s SER 451 N -2.40 5.97 0.00 6.41 0.15 -0.18 -4.96 113.70 118.68 1hj4 s SER 451 Ca 0.29 0.19 0.22 0.00 0.70 0.00 0.00 55.95 57.35 1hj4 s SER 451 Cb 0.20 -1.76 0.56 0.00 -1.71 0.00 0.00 66.02 63.31 1hj4 s SER 451 CO 0.47 0.23 1.48 0.00 1.20 0.00 0.00 173.24 176.61 1hj4 n GLN 452 N 0.77 2.54 -4.45 5.44 10.64 -1.26 -4.68 117.38 126.36 1hj4 n GLN 452 Ca -0.10 -2.37 -0.30 0.00 -1.83 0.00 0.00 57.00 52.41 1hj4 n GLN 452 Cb 0.52 -1.52 -0.12 0.00 -0.86 0.00 0.00 30.24 28.25 1hj4 n GLN 452 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1hj4 s TYR 453 N -1.22 2.45 -0.22 2.61 2.02 -1.26 0.14 117.35 121.87 1hj4 s TYR 453 Ca 0.44 -0.31 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 1hj4 s TYR 453 Cb 0.23 -1.34 0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1hj4 s TYR 453 CO 0.31 0.32 -0.15 -1.17 -1.57 0.00 0.00 175.55 173.30 1hj4 s LEU 454 N -1.90 2.80 -0.16 -1.29 2.96 -0.03 -4.54 118.68 116.53 1hj4 s LEU 454 Ca 0.16 -0.98 -0.10 0.00 -0.22 0.00 0.00 54.13 52.98 1hj4 s LEU 454 Cb -0.10 -1.53 -0.05 0.00 0.50 0.00 0.00 46.19 45.01 1hj4 s LEU 454 CO 0.07 -0.09 0.19 -0.31 -1.32 0.00 0.00 176.35 174.89 1hj4 s TYR 455 N 1.22 3.49 -0.08 5.38 1.51 0.01 -0.65 117.35 128.23 1hj4 s TYR 455 Ca -0.01 0.49 -0.01 0.00 -1.01 0.00 0.00 57.07 56.53 1hj4 s TYR 455 Cb -0.16 -2.15 0.03 0.00 -0.11 0.00 0.00 41.96 39.56 1hj4 s TYR 455 CO -0.09 0.42 -0.03 0.08 -1.11 0.00 0.00 175.55 174.83 1hj4 s VAL 456 N -0.09 0.63 0.75 0.71 1.01 0.39 -0.73 120.40 123.07 1hj4 s VAL 456 Ca 0.13 -0.04 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 1hj4 s VAL 456 Cb -0.12 -0.72 0.10 0.00 0.00 0.00 0.00 36.38 35.64 1hj4 s VAL 456 CO 0.02 0.30 1.05 1.51 0.00 0.00 0.00 175.10 177.98 1hj4 s ASP 457 N 1.80 4.41 -0.30 3.32 1.47 -0.94 -0.97 116.67 125.46 1hj4 s ASP 457 Ca 0.04 0.20 0.18 0.00 1.18 0.00 0.00 52.55 54.16 1hj4 s ASP 457 Cb -0.12 -0.69 0.47 0.00 -0.34 0.00 0.00 42.92 42.23 1hj4 s ASP 457 CO -0.06 -1.85 1.18 0.00 0.68 0.00 0.00 175.17 175.12 1hj4 n ALA 458 N -3.03 2.71 -0.29 2.11 0.00 -1.26 -4.31 120.51 116.45 1hj4 n ALA 458 Ca 0.11 -2.37 0.07 0.00 0.00 0.00 0.00 53.44 51.25 1hj4 n ALA 458 Cb 0.60 -0.90 0.17 0.00 0.00 0.00 0.00 19.45 19.33 1hj4 n ALA 458 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1hj4 h THR 459 N 4.30 0.20 -0.20 0.00 2.02 -1.58 -1.32 112.91 116.33 1hj4 h THR 459 Ca -0.20 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1hj4 h THR 459 Cb 1.26 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1hj4 h THR 459 CO 0.16 0.01 0.00 0.18 0.37 0.00 0.00 175.52 176.24 1hj4 n LEU 460 N -5.45 2.22 -4.73 2.58 4.77 0.58 -4.76 117.00 112.21 1hj4 n LEU 460 Ca 0.15 -0.91 -0.42 0.00 -0.03 0.00 0.00 56.01 54.80 1hj4 n LEU 460 Cb 0.52 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 1hj4 n LEU 460 CO -0.01 0.45 1.04 -3.20 -1.33 0.00 0.00 177.39 174.34 1hj4 n ASN 461 N 0.69 3.29 0.14 -1.43 2.85 -0.50 -4.75 115.26 115.55 1hj4 n ASN 461 Ca 0.17 1.20 0.12 0.00 -0.11 0.00 0.00 54.58 55.96 1hj4 n ASN 461 Cb 0.42 -1.54 0.49 0.00 1.24 0.00 0.00 39.78 40.39 1hj4 n ASN 461 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1hj4 h PRO 462 N 3.17 0.00 -5.31 1.20 0.13 -1.90 -3.41 132.00 125.88 1hj4 h PRO 462 Ca -0.48 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.01 1hj4 h PRO 462 Cb 1.26 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 1hj4 h PRO 462 CO 0.67 0.00 0.00 -2.00 -0.23 0.00 0.00 178.00 176.44 1hj4 s GLU 463 N -3.31 3.67 0.24 0.86 2.12 -1.26 -4.98 118.70 116.03 1hj4 s GLU 463 Ca 0.05 -0.07 -0.06 0.00 0.36 0.00 0.00 54.97 55.25 1hj4 s GLU 463 Cb 0.10 -3.80 0.43 0.00 0.26 0.00 0.00 34.13 31.12 1hj4 s GLU 463 CO 0.43 -0.64 1.68 0.00 -0.54 0.00 0.00 175.26 176.19 1hj4 h ALA 464 N 8.43 0.90 -0.26 6.30 0.00 -1.96 -0.32 119.26 132.34 1hj4 h ALA 464 Ca -0.28 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1hj4 h ALA 464 Cb 1.12 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1hj4 h ALA 464 CO 0.78 -0.34 0.00 0.93 0.00 0.00 0.00 179.25 180.62 1hj4 h GLU 465 N 0.25 0.38 -0.03 0.00 5.08 -1.96 -0.96 114.58 117.35 1hj4 h GLU 465 Ca 0.40 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.59 1hj4 h GLU 465 Cb 0.67 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.87 1hj4 h GLU 465 CO -0.51 0.41 -0.39 0.82 -1.00 0.00 0.00 179.01 178.35 1hj4 h ILE 466 N 0.37 1.46 0.00 3.13 2.04 -1.50 -3.20 117.51 119.81 1hj4 h ILE 466 Ca 0.09 -1.90 -0.01 0.00 1.00 0.00 0.00 64.86 64.03 1hj4 h ILE 466 Cb 0.25 2.54 -0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1hj4 h ILE 466 CO 0.01 0.54 -0.04 0.77 0.00 0.00 0.00 178.15 179.42 1hj4 h SER 467 N -0.24 0.00 -0.61 1.72 4.64 -0.98 -1.49 113.55 116.59 1hj4 h SER 467 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1hj4 h SER 467 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1hj4 h SER 467 CO 0.08 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1hj4 n GLY 468 N -0.46 2.49 3.35 -0.77 0.00 -0.38 -1.00 105.19 108.43 1hj4 n GLY 468 Ca -0.01 -0.78 -0.18 0.00 0.00 0.00 0.00 46.02 45.05 1hj4 n GLY 468 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hj4 s SER 469 N -0.86 1.80 -0.02 1.61 0.01 -0.56 -0.98 113.70 114.71 1hj4 s SER 469 Ca 0.47 -1.29 0.02 0.00 1.31 0.00 0.00 55.95 56.47 1hj4 s SER 469 Cb 0.30 0.02 -0.00 0.00 0.21 0.00 0.00 66.02 66.56 1hj4 s SER 469 CO 0.23 -0.58 -0.08 -0.69 0.41 0.00 0.00 173.24 172.53 1hj4 s VAL 470 N -3.47 0.68 0.03 3.43 1.01 -0.66 -4.15 120.40 117.27 1hj4 s VAL 470 Ca 0.32 -0.33 -0.20 0.00 0.00 0.00 0.00 61.98 61.77 1hj4 s VAL 470 Cb 0.07 -0.60 -0.06 0.00 0.00 0.00 0.00 36.38 35.79 1hj4 s VAL 470 CO 0.11 0.21 0.59 0.00 0.00 0.00 0.00 175.10 176.01 1hj4 s ALA 471 N 0.04 3.52 -0.17 5.51 0.00 -0.14 -1.01 121.76 129.50 1hj4 s ALA 471 Ca -0.00 0.04 -0.00 0.00 0.00 0.00 0.00 51.96 52.00 1hj4 s ALA 471 Cb -0.06 -2.72 0.04 0.00 0.00 0.00 0.00 23.12 20.38 1hj4 s ALA 471 CO -0.00 0.24 -0.07 0.08 0.00 0.00 0.00 175.76 176.02 1hj4 s VAL 472 N -0.52 1.27 -0.04 0.00 1.01 0.24 -0.46 120.40 121.91 1hj4 s VAL 472 Ca 0.31 -0.74 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 1hj4 s VAL 472 Cb -0.19 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 1hj4 s VAL 472 CO 0.18 0.15 0.28 -0.36 0.00 0.00 0.00 175.10 175.35 1hj4 s PHE 473 N 1.56 3.64 -0.59 5.22 0.40 0.18 -0.84 117.98 127.56 1hj4 s PHE 473 Ca 0.00 0.73 -0.24 0.00 -0.60 0.00 0.00 56.93 56.83 1hj4 s PHE 473 Cb -0.15 -2.09 0.05 0.00 0.51 0.00 0.00 43.02 41.33 1hj4 s PHE 473 CO -0.08 0.67 0.95 0.34 0.70 0.00 0.00 175.22 177.80 1hj4 s ASP 474 N -1.21 6.28 0.26 1.36 -1.08 -1.26 -0.85 116.67 120.17 1hj4 s ASP 474 Ca 0.22 -0.54 -0.03 0.00 -0.52 0.00 0.00 52.55 51.68 1hj4 s ASP 474 Cb -0.14 -2.43 0.43 0.00 -1.46 0.00 0.00 42.92 39.32 1hj4 s ASP 474 CO 0.11 -1.30 1.84 0.40 0.52 0.00 0.00 175.17 176.73 1hj4 h ILE 475 N 6.00 0.97 -0.35 4.11 2.04 -0.66 -2.08 117.51 127.55 1hj4 h ILE 475 Ca -0.27 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.32 1hj4 h ILE 475 Cb 1.07 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1hj4 h ILE 475 CO 1.12 0.18 0.24 0.11 0.00 0.00 0.00 178.15 179.80 1hj4 h LYS 476 N 0.96 0.21 0.00 2.37 1.57 -1.92 -1.37 116.57 118.40 1hj4 h LYS 476 Ca 0.43 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 1hj4 h LYS 476 Cb 0.32 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1hj4 h LYS 476 CO -0.22 0.14 -0.16 0.00 -0.57 0.00 0.00 179.45 178.64 1hj4 n ALA 477 N -2.54 2.67 -1.95 3.86 0.00 -0.79 -4.89 120.51 116.87 1hj4 n ALA 477 Ca 0.04 -0.16 -0.41 0.00 0.00 0.00 0.00 53.44 52.91 1hj4 n ALA 477 Cb 0.27 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 1hj4 n ALA 477 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1hj4 s MET 478 N -3.02 4.36 -0.01 0.00 -1.94 -0.52 -4.90 119.30 113.27 1hj4 s MET 478 Ca 0.12 2.13 0.01 0.00 -1.71 0.00 0.00 55.69 56.25 1hj4 s MET 478 Cb 0.18 -3.16 -0.02 0.00 2.01 0.00 0.00 34.83 33.83 1hj4 s MET 478 CO 0.59 -0.29 0.02 0.25 -0.01 0.00 0.00 175.02 175.58 1hj4 n THR 479 N 2.42 0.03 -2.66 2.05 -2.24 -1.26 -4.43 114.28 108.18 1hj4 n THR 479 Ca 0.06 -0.04 -0.14 0.00 -2.27 0.00 0.00 64.05 61.66 1hj4 n THR 479 Cb 0.42 0.04 0.02 0.00 -2.10 0.00 0.00 70.33 68.71 1hj4 n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hj4 n GLY 480 N 2.56 -0.07 0.37 3.38 0.00 -1.26 -4.65 105.19 105.52 1hj4 n GLY 480 Ca -0.01 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1hj4 n GLY 480 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hj4 n ASP 481 N -0.80 1.13 0.00 1.61 5.68 -1.26 -4.90 116.55 118.01 1hj4 n ASP 481 Ca -0.08 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 52.77 1hj4 n ASP 481 Cb 0.58 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.54 1hj4 n ASP 481 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hj4 n GLY 482 N 1.10 0.91 3.82 6.12 0.00 -1.26 -5.06 105.19 110.82 1hj4 n GLY 482 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1hj4 n GLY 482 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hj4 s SER 483 N -1.86 3.52 -0.40 1.61 1.04 -1.26 -5.01 113.70 111.34 1hj4 s SER 483 Ca 0.00 0.80 -0.19 0.00 0.48 0.00 0.00 55.95 57.04 1hj4 s SER 483 Cb 0.00 -1.25 0.01 0.00 0.10 0.00 0.00 66.02 64.88 1hj4 s SER 483 CO 0.00 -2.52 0.55 -1.81 0.98 0.00 0.00 173.24 170.44 1hj4 s ASP 484 N -4.28 6.30 0.23 7.02 1.01 -1.26 -4.96 116.67 120.73 1hj4 s ASP 484 Ca 0.65 -0.28 -0.31 0.00 0.71 0.00 0.00 52.55 53.31 1hj4 s ASP 484 Cb -0.12 -2.28 -0.14 0.00 1.01 0.00 0.00 42.92 41.39 1hj4 s ASP 484 CO 0.52 -0.63 1.41 -2.65 0.21 0.00 0.00 175.17 174.04 1hj4 n PRO 485 N 5.93 2.00 -1.91 8.23 -0.02 -1.26 -4.96 135.00 143.01 1hj4 n PRO 485 Ca -0.04 0.71 -0.32 0.00 -2.02 0.00 0.00 63.50 61.83 1hj4 n PRO 485 Cb 0.48 -2.37 0.02 0.00 -0.02 0.00 0.00 33.50 31.61 1hj4 n PRO 485 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1hj4 s GLU 486 N -0.31 3.30 0.07 -0.52 -1.05 -1.26 -4.94 118.70 113.98 1hj4 s GLU 486 Ca 0.69 1.04 0.02 0.00 -0.15 0.00 0.00 54.97 56.58 1hj4 s GLU 486 Cb -0.66 -2.04 -0.03 0.00 -0.44 0.00 0.00 34.13 30.96 1hj4 s GLU 486 CO 0.49 -0.82 -0.08 -0.59 0.95 0.00 0.00 175.26 175.21 1hj4 s PHE 487 N -2.75 0.80 0.07 4.83 -0.12 -1.26 -4.45 117.98 115.10 1hj4 s PHE 487 Ca 0.60 -0.66 -0.12 0.00 -0.05 0.00 0.00 56.93 56.70 1hj4 s PHE 487 Cb -0.14 -0.47 -0.06 0.00 -0.63 0.00 0.00 43.02 41.72 1hj4 s PHE 487 CO 0.44 -0.09 0.43 0.21 -0.05 0.00 0.00 175.22 176.16 1hj4 s LYS 488 N -2.50 3.85 -0.32 1.99 2.20 -0.02 -4.85 119.74 120.09 1hj4 s LYS 488 Ca -0.01 0.31 -0.09 0.00 -0.36 0.00 0.00 55.97 55.82 1hj4 s LYS 488 Cb -0.04 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.23 1hj4 s LYS 488 CO -0.01 0.58 0.15 0.99 -0.36 0.00 0.00 175.35 176.70 1hj4 s THR 489 N -1.32 4.51 -0.22 3.43 2.01 -1.26 -0.59 115.64 122.20 1hj4 s THR 489 Ca 0.31 -0.53 -0.18 0.00 0.31 0.00 0.00 61.69 61.61 1hj4 s THR 489 Cb -0.15 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 68.98 1hj4 s THR 489 CO 0.17 0.02 0.48 -0.76 -0.69 0.00 0.00 174.62 173.84 1hj4 s LEU 490 N 1.59 4.12 -1.42 4.42 1.43 -0.18 -4.95 118.68 123.69 1hj4 s LEU 490 Ca 0.04 0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 53.62 1hj4 s LEU 490 Cb -0.17 -2.64 0.06 0.00 0.03 0.00 0.00 46.19 43.47 1hj4 s LEU 490 CO 0.06 -0.18 2.29 -0.81 0.23 0.00 0.00 176.35 177.94 1hj4 n PRO 491 N 4.90 3.47 -0.09 1.29 -0.04 -1.26 -1.66 135.00 141.61 1hj4 n PRO 491 Ca -0.06 -2.90 -0.06 0.00 -0.04 0.00 0.00 63.50 60.44 1hj4 n PRO 491 Cb 0.50 -3.00 0.00 0.00 -0.04 0.00 0.00 33.50 30.96 1hj4 n PRO 491 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1hj4 h ILE 492 N 3.55 0.57 -0.83 0.52 1.08 -1.88 -0.37 117.51 120.15 1hj4 h ILE 492 Ca 0.60 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 65.03 1hj4 h ILE 492 Cb 0.52 0.57 -0.04 0.00 -3.07 0.00 0.00 36.82 34.81 1hj4 h ILE 492 CO 1.74 0.00 0.39 0.00 -0.69 0.00 0.00 178.15 179.59 1hj4 h ALA 493 N 1.21 1.07 -0.66 1.87 0.00 -1.37 -2.28 119.26 119.09 1hj4 h ALA 493 Ca 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1hj4 h ALA 493 Cb 0.32 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1hj4 h ALA 493 CO -0.37 0.65 0.39 1.49 0.00 0.00 0.00 179.25 181.40 1hj4 h GLU 494 N 1.18 0.91 -0.48 0.00 4.81 -1.58 -1.88 114.58 117.54 1hj4 h GLU 494 Ca 0.28 -0.09 0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1hj4 h GLU 494 Cb 0.14 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 1hj4 h GLU 494 CO -0.03 0.66 0.32 -1.49 -0.73 0.00 0.00 179.01 177.74 1hj4 h TRP 495 N 0.90 0.47 0.00 0.92 6.55 -0.69 -1.27 115.95 122.83 1hj4 h TRP 495 Ca 0.24 0.01 0.00 0.00 0.95 0.00 0.00 58.89 60.09 1hj4 h TRP 495 Cb -0.00 -0.16 0.00 0.00 -0.86 0.00 0.00 29.16 28.14 1hj4 h TRP 495 CO -0.01 0.26 0.00 0.00 -1.05 0.00 0.00 178.44 177.64 1hj4 h ALA 496 N 1.73 1.00 -5.59 1.49 0.00 -0.79 -3.48 119.26 113.62 1hj4 h ALA 496 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.82 1hj4 h ALA 496 Cb 0.20 0.00 0.18 0.00 0.00 0.00 0.00 17.79 18.16 1hj4 h ALA 496 CO -0.05 0.00 -0.86 0.41 0.00 0.00 0.00 179.25 178.74 1hj4 n GLY 497 N 0.39 -1.07 3.38 0.00 0.00 -0.48 -5.01 105.19 102.41 1hj4 n GLY 497 Ca 0.02 0.53 -0.35 0.00 0.00 0.00 0.00 46.02 46.21 1hj4 n GLY 497 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hj4 s ILE 498 N -3.41 3.80 -0.12 -0.61 1.01 -1.26 -5.01 121.20 115.61 1hj4 s ILE 498 Ca 0.42 -0.35 -0.28 0.00 0.00 0.00 0.00 60.65 60.44 1hj4 s ILE 498 Cb -0.07 -2.75 -0.25 0.00 0.01 0.00 0.00 42.46 39.41 1hj4 s ILE 498 CO 0.76 0.40 0.85 0.74 0.00 0.00 0.00 174.94 177.69 1hj4 h THR 499 N 5.59 1.70 -3.95 2.92 2.02 -1.94 -3.47 112.91 115.77 1hj4 h THR 499 Ca -0.39 -2.11 -0.50 0.00 0.77 0.00 0.00 66.41 64.18 1hj4 h THR 499 Cb 1.17 3.13 0.04 0.00 -1.74 0.00 0.00 68.15 70.74 1hj4 h THR 499 CO 0.60 0.54 0.46 -1.83 0.37 0.00 0.00 175.52 175.66 1hj4 s GLU 500 N -2.59 4.09 2.14 6.66 1.03 -1.26 -4.92 118.70 123.85 1hj4 s GLU 500 Ca -0.18 1.69 0.00 0.00 0.03 0.00 0.00 54.97 56.51 1hj4 s GLU 500 Cb -0.02 -2.61 0.00 0.00 -0.80 0.00 0.00 34.13 30.70 1hj4 s GLU 500 CO 0.68 -0.25 0.00 0.41 -1.33 0.00 0.00 175.26 174.77 1hj4 n GLY 501 N 0.52 0.32 2.57 -3.83 0.00 -1.26 -4.56 105.19 98.95 1hj4 n GLY 501 Ca 0.05 -0.83 -0.27 0.00 0.00 0.00 0.00 46.02 44.97 1hj4 n GLY 501 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1hj4 n GLN 502 N -0.54 1.38 -1.68 1.61 3.00 -1.26 -5.12 117.38 114.78 1hj4 n GLN 502 Ca 0.00 -4.01 -0.39 0.00 -0.01 0.00 0.00 57.00 52.59 1hj4 n GLN 502 Cb 0.00 -1.97 0.04 0.00 0.00 0.00 0.00 30.24 28.31 1hj4 n GLN 502 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1hj4 n PRO 503 N 1.89 1.44 -3.77 -1.09 -0.04 -1.26 -4.99 135.00 127.18 1hj4 n PRO 503 Ca 0.25 0.53 -0.35 0.00 -0.04 0.00 0.00 63.50 63.89 1hj4 n PRO 503 Cb 0.42 -2.35 -0.08 0.00 -0.04 0.00 0.00 33.50 31.45 1hj4 n PRO 503 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1hj4 s ARG 504 N -2.63 4.08 -0.10 0.54 1.81 -0.41 -4.28 118.95 117.96 1hj4 s ARG 504 Ca 0.70 -0.22 -0.20 0.00 -1.72 0.00 0.00 55.73 54.29 1hj4 s ARG 504 Cb -0.45 -3.38 -0.04 0.00 -0.45 0.00 0.00 34.95 30.63 1hj4 s ARG 504 CO 0.51 0.35 0.55 0.08 -0.68 0.00 0.00 175.30 176.11 1hj4 s VAL 505 N 0.20 5.14 -0.05 3.52 1.01 -0.17 -0.58 120.40 129.47 1hj4 s VAL 505 Ca 0.08 1.11 -0.06 0.00 0.00 0.00 0.00 61.98 63.11 1hj4 s VAL 505 Cb -0.11 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.40 1hj4 s VAL 505 CO -0.01 0.30 0.16 0.54 0.00 0.00 0.00 175.10 176.09 1hj4 s VAL 506 N 0.70 0.01 -0.17 2.92 0.11 -0.53 -3.83 120.40 119.61 1hj4 s VAL 506 Ca 0.30 -0.09 -0.12 0.00 -2.93 0.00 0.00 61.98 59.14 1hj4 s VAL 506 Cb -0.16 -0.26 0.04 0.00 -1.53 0.00 0.00 36.38 34.47 1hj4 s VAL 506 CO 0.13 -0.05 0.23 1.67 -3.33 0.00 0.00 175.10 173.75 1hj4 n GLN 507 N 2.80 -4.33 -2.14 1.54 7.27 -1.26 -1.93 117.38 119.33 1hj4 n GLN 507 Ca -0.14 3.28 -0.41 0.00 0.07 0.00 0.00 57.00 59.81 1hj4 n GLN 507 Cb 0.58 -4.68 -0.02 0.00 2.41 0.00 0.00 30.24 28.53 1hj4 n GLN 507 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1hj4 s GLY 508 N -0.60 2.98 -0.08 1.69 0.00 -1.26 -4.33 107.32 105.72 1hj4 s GLY 508 Ca -0.27 1.23 -0.04 0.00 0.00 0.00 0.00 44.72 45.65 1hj4 s GLY 508 CO 0.73 1.89 0.18 1.85 0.00 0.00 0.00 173.10 177.75 1hj4 s GLU 509 N -1.71 0.12 0.48 2.90 2.56 -0.65 -4.89 118.70 117.52 1hj4 s GLU 509 Ca 0.49 0.46 -0.05 0.00 0.00 0.00 0.00 54.97 55.87 1hj4 s GLU 509 Cb -0.39 -0.17 -0.03 0.00 2.00 0.00 0.00 34.13 35.54 1hj4 s GLU 509 CO 0.52 -0.19 0.79 -0.06 -0.56 0.00 0.00 175.26 175.76 1hj4 s PHE 510 N 1.38 3.54 0.96 5.30 0.40 -1.26 -0.32 117.98 127.99 1hj4 s PHE 510 Ca -0.07 0.79 -0.15 0.00 -0.60 0.00 0.00 56.93 56.89 1hj4 s PHE 510 Cb -0.11 -2.32 0.18 0.00 0.51 0.00 0.00 43.02 41.28 1hj4 s PHE 510 CO -0.07 -0.30 1.24 0.54 0.70 0.00 0.00 175.22 177.34 1hj4 s ASN 511 N -4.12 3.09 0.25 1.36 4.22 -0.70 -4.59 114.94 114.46 1hj4 s ASN 511 Ca 0.48 0.50 -0.05 0.00 -2.14 0.00 0.00 52.86 51.65 1hj4 s ASN 511 Cb -0.10 -0.72 0.32 0.00 1.28 0.00 0.00 41.25 42.03 1hj4 s ASN 511 CO 0.45 -2.77 1.89 0.50 -2.04 0.00 0.00 177.10 175.13 1hj4 h LYS 512 N -1.66 1.17 0.00 3.55 3.64 -1.88 -2.12 116.57 119.27 1hj4 h LYS 512 Ca -0.46 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 1hj4 h LYS 512 Cb 1.27 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1hj4 h LYS 512 CO 0.46 0.77 0.00 -0.25 -2.27 0.00 0.00 179.45 178.16 1hj4 n ASP 513 N -4.48 0.73 -1.95 4.20 8.00 -1.26 -4.91 116.55 116.88 1hj4 n ASP 513 Ca 0.13 0.61 -0.13 0.00 0.71 0.00 0.00 54.79 56.10 1hj4 n ASP 513 Cb 0.11 -0.79 0.03 0.00 -0.02 0.00 0.00 41.12 40.44 1hj4 n ASP 513 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hj4 n GLY 514 N 0.83 -0.01 0.00 0.44 0.00 -0.80 -4.82 105.19 100.83 1hj4 n GLY 514 Ca 0.04 -0.23 0.04 0.00 0.00 0.00 0.00 46.02 45.88 1hj4 n GLY 514 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hj4 n THR 515 N -3.99 0.00 -4.12 2.61 -2.24 -1.26 -4.28 114.28 101.00 1hj4 n THR 515 Ca -0.06 -0.25 -0.15 0.00 -2.27 0.00 0.00 64.05 61.33 1hj4 n THR 515 Cb 0.57 0.62 -0.14 0.00 -2.10 0.00 0.00 70.33 69.28 1hj4 n THR 515 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1hj4 s GLU 516 N -2.26 0.43 -0.09 -0.78 2.02 -1.26 -1.30 118.70 115.46 1hj4 s GLU 516 Ca -0.00 -0.33 0.02 0.00 0.02 0.00 0.00 54.97 54.68 1hj4 s GLU 516 Cb 0.06 -0.35 0.01 0.00 0.10 0.00 0.00 34.13 33.95 1hj4 s GLU 516 CO 0.37 0.09 -0.16 0.54 0.02 0.00 0.00 175.26 176.12 1hj4 s VAL 517 N -0.45 1.47 -0.07 2.63 0.11 -0.60 -1.72 120.40 121.78 1hj4 s VAL 517 Ca -0.01 -0.66 -0.05 0.00 -2.93 0.00 0.00 61.98 58.33 1hj4 s VAL 517 Cb -0.04 -1.33 -0.04 0.00 -1.53 0.00 0.00 36.38 33.44 1hj4 s VAL 517 CO -0.00 0.43 0.15 0.26 -3.33 0.00 0.00 175.10 172.61 1hj4 s TRP 518 N 0.72 3.54 0.02 1.54 0.52 0.56 -0.64 118.94 125.21 1hj4 s TRP 518 Ca -0.13 0.43 0.05 0.00 0.02 0.00 0.00 56.10 56.47 1hj4 s TRP 518 Cb -0.16 -1.88 -0.02 0.00 -1.15 0.00 0.00 33.47 30.26 1hj4 s TRP 518 CO 0.03 0.68 -0.16 -0.06 0.02 0.00 0.00 176.95 177.46 1hj4 s PHE 519 N -1.15 1.39 0.01 -1.98 0.08 -0.07 -1.63 117.98 114.63 1hj4 s PHE 519 Ca 0.20 -0.32 -0.20 0.00 0.12 0.00 0.00 56.93 56.72 1hj4 s PHE 519 Cb -0.12 -0.85 -0.06 0.00 -0.57 0.00 0.00 43.02 41.42 1hj4 s PHE 519 CO 0.10 0.03 0.60 -1.12 -0.10 0.00 0.00 175.22 174.73 1hj4 s SER 520 N -0.87 7.00 -0.71 1.36 0.01 -0.81 -1.07 113.70 118.61 1hj4 s SER 520 Ca 0.04 1.19 -0.04 0.00 1.31 0.00 0.00 55.95 58.46 1hj4 s SER 520 Cb -0.07 -2.37 0.18 0.00 0.21 0.00 0.00 66.02 63.97 1hj4 s SER 520 CO 0.01 0.13 0.55 -0.69 0.41 0.00 0.00 173.24 173.65 1hj4 s VAL 521 N -0.35 4.03 -0.54 3.43 1.01 0.84 -1.45 120.40 127.38 1hj4 s VAL 521 Ca 0.31 -3.16 -0.24 0.00 0.00 0.00 0.00 61.98 58.89 1hj4 s VAL 521 Cb -0.19 -3.58 0.04 0.00 0.00 0.00 0.00 36.38 32.66 1hj4 s VAL 521 CO 0.18 -0.94 0.92 0.86 0.00 0.00 0.00 175.10 176.11 1hj4 s TRP 522 N -0.38 2.82 0.47 5.22 -0.00 0.26 -2.26 118.94 125.07 1hj4 s TRP 522 Ca 0.20 -0.03 0.06 0.00 -0.00 0.00 0.00 56.10 56.33 1hj4 s TRP 522 Cb -0.16 -4.03 -0.01 0.00 -0.00 0.00 0.00 33.47 29.27 1hj4 s TRP 522 CO -0.06 -1.31 0.24 1.21 -0.00 0.00 0.00 176.95 177.03 1hj4 s ASN 523 N 2.79 4.49 1.08 5.86 3.84 -1.26 -1.29 114.94 130.44 1hj4 s ASN 523 Ca 0.30 -1.21 -0.12 0.00 0.21 0.00 0.00 52.86 52.03 1hj4 s ASN 523 Cb -0.13 -0.01 0.22 0.00 -0.55 0.00 0.00 41.25 40.78 1hj4 s ASN 523 CO 0.19 -0.80 0.97 0.61 -2.79 0.00 0.00 177.10 175.28 1hj4 n GLY 524 N -1.44 -1.51 0.35 1.21 0.00 -1.26 -4.29 105.19 98.24 1hj4 n GLY 524 Ca -0.04 -0.98 0.05 0.00 0.00 0.00 0.00 46.02 45.05 1hj4 n GLY 524 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1hj4 h LYS 525 N -2.35 0.75 -0.46 1.61 3.64 -1.98 -0.15 116.57 117.64 1hj4 h LYS 525 Ca -0.54 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1hj4 h LYS 525 Cb 1.31 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1hj4 h LYS 525 CO 0.45 0.50 0.00 -0.25 -2.27 0.00 0.00 179.45 177.88 1hj4 n ASP 526 N -4.47 4.54 -4.73 4.20 8.00 -1.26 -4.81 116.55 118.01 1hj4 n ASP 526 Ca 0.10 -2.73 -0.28 0.00 0.71 0.00 0.00 54.79 52.59 1hj4 n ASP 526 Cb 0.18 -0.56 -0.08 0.00 -0.02 0.00 0.00 41.12 40.65 1hj4 n ASP 526 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1hj4 s GLN 527 N -2.35 2.15 -0.18 -1.24 -0.21 -0.07 -5.11 119.66 112.65 1hj4 s GLN 527 Ca 0.46 -2.07 -0.22 0.00 0.02 0.00 0.00 55.36 53.55 1hj4 s GLN 527 Cb 0.34 -1.79 -0.02 0.00 1.00 0.00 0.00 33.01 32.53 1hj4 s GLN 527 CO 0.16 -0.21 0.68 -2.00 -2.12 0.00 0.00 175.29 171.79 1hj4 s GLU 528 N -3.89 4.26 0.52 2.91 2.12 -1.26 -4.74 118.70 118.61 1hj4 s GLU 528 Ca 0.30 0.73 0.02 0.00 0.36 0.00 0.00 54.97 56.38 1hj4 s GLU 528 Cb 0.04 -3.56 -0.00 0.00 0.26 0.00 0.00 34.13 30.87 1hj4 s GLU 528 CO 0.16 -0.22 0.07 -1.12 -0.54 0.00 0.00 175.26 173.62 1hj4 s SER 529 N 1.13 4.22 0.17 -1.70 0.01 -1.26 -4.52 113.70 111.75 1hj4 s SER 529 Ca 0.32 -1.59 -0.24 0.00 1.31 0.00 0.00 55.95 55.75 1hj4 s SER 529 Cb -0.16 0.51 0.06 0.00 0.21 0.00 0.00 66.02 66.64 1hj4 s SER 529 CO 0.12 -0.90 0.89 0.00 0.41 0.00 0.00 173.24 173.75 1hj4 s ALA 530 N -2.86 -1.57 -0.08 1.44 0.00 -0.96 -4.79 121.76 112.95 1hj4 s ALA 530 Ca 0.10 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.19 1hj4 s ALA 530 Cb 0.01 0.68 -0.02 0.00 0.00 0.00 0.00 23.12 23.79 1hj4 s ALA 530 CO 0.06 -1.01 -0.15 -0.51 0.00 0.00 0.00 175.76 174.15 1hj4 s LEU 531 N -2.90 2.65 -0.17 0.00 1.43 -0.47 -0.11 118.68 119.12 1hj4 s LEU 531 Ca 0.11 -0.28 -0.02 0.00 -1.03 0.00 0.00 54.13 52.92 1hj4 s LEU 531 Cb -0.02 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.63 1hj4 s LEU 531 CO 0.02 0.27 -0.09 -0.69 0.23 0.00 0.00 176.35 176.09 1hj4 s VAL 532 N -0.29 3.19 -0.24 -1.59 1.01 -0.23 -0.19 120.40 122.05 1hj4 s VAL 532 Ca 0.02 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1hj4 s VAL 532 Cb -0.13 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1hj4 s VAL 532 CO 0.03 0.49 0.10 -0.69 0.00 0.00 0.00 175.10 175.02 1hj4 s VAL 533 N 0.82 4.70 -0.13 2.92 1.01 0.28 -0.90 120.40 129.09 1hj4 s VAL 533 Ca -0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 1hj4 s VAL 533 Cb -0.15 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 1hj4 s VAL 533 CO 0.01 0.35 0.02 -0.69 0.00 0.00 0.00 175.10 174.78 1hj4 s VAL 534 N 1.34 4.41 -0.40 2.92 1.01 0.19 -0.70 120.40 129.17 1hj4 s VAL 534 Ca 0.06 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1hj4 s VAL 534 Cb -0.15 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1hj4 s VAL 534 CO 0.05 0.54 1.20 -0.62 0.00 0.00 0.00 175.10 176.26 1hj4 s ASP 535 N -0.21 6.65 0.32 3.32 2.15 -0.07 -1.56 116.67 127.28 1hj4 s ASP 535 Ca 0.06 0.78 0.00 0.00 0.43 0.00 0.00 52.55 53.82 1hj4 s ASP 535 Cb -0.12 -2.55 0.54 0.00 -0.30 0.00 0.00 42.92 40.49 1hj4 s ASP 535 CO 0.02 -1.18 1.97 -0.78 -0.17 0.00 0.00 175.17 175.04 1hj4 h ASP 536 N 9.26 0.81 -0.50 -0.34 3.58 -1.51 0.21 116.42 127.92 1hj4 h ASP 536 Ca -0.24 -0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.09 1hj4 h ASP 536 Cb 1.07 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.90 1hj4 h ASP 536 CO 1.09 0.61 -0.00 0.11 -2.88 0.00 0.00 179.24 178.16 1hj4 h LYS 537 N 0.94 0.94 0.00 0.28 1.79 -1.92 -3.29 116.57 115.31 1hj4 h LYS 537 Ca 0.25 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1hj4 h LYS 537 Cb -0.06 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.49 1hj4 h LYS 537 CO -0.05 0.93 -1.36 0.25 -1.08 0.00 0.00 179.45 178.14 1hj4 n THR 538 N -4.19 0.00 -2.20 -0.16 -2.24 -1.17 -4.99 114.28 99.33 1hj4 n THR 538 Ca 0.03 -0.28 -0.15 0.00 -2.27 0.00 0.00 64.05 61.37 1hj4 n THR 538 Cb 0.33 0.44 -0.01 0.00 -2.10 0.00 0.00 70.33 68.99 1hj4 n THR 538 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1hj4 n LEU 539 N -1.80 -1.63 -4.75 3.22 4.77 0.73 -5.00 117.00 112.54 1hj4 n LEU 539 Ca -0.01 0.03 -0.23 0.00 -0.03 0.00 0.00 56.01 55.77 1hj4 n LEU 539 Cb 0.35 -2.26 -0.06 0.00 -2.33 0.00 0.00 43.42 39.12 1hj4 n LEU 539 CO 0.32 -0.23 -0.23 -1.61 -1.33 0.00 0.00 177.39 174.31 1hj4 s GLU 540 N -4.60 2.69 0.11 3.23 2.02 -1.21 -4.89 118.70 116.06 1hj4 s GLU 540 Ca 0.00 -1.15 -0.31 0.00 0.02 0.00 0.00 54.97 53.53 1hj4 s GLU 540 Cb 0.00 -2.44 -0.10 0.00 0.10 0.00 0.00 34.13 31.70 1hj4 s GLU 540 CO 0.00 0.40 1.76 -1.17 0.02 0.00 0.00 175.26 176.27 1hj4 s LEU 541 N -3.64 4.39 -0.26 1.80 2.96 -1.26 -0.89 118.68 121.77 1hj4 s LEU 541 Ca 0.32 2.67 -0.13 0.00 -0.22 0.00 0.00 54.13 56.78 1hj4 s LEU 541 Cb -0.08 -3.57 -0.14 0.00 0.50 0.00 0.00 46.19 42.90 1hj4 s LEU 541 CO 0.23 -0.96 -0.24 1.17 -1.32 0.00 0.00 176.35 175.23 1hj4 n LYS 542 N 5.48 0.60 -3.57 1.98 3.00 0.12 -4.76 118.16 121.01 1hj4 n LYS 542 Ca 0.17 0.29 -0.15 0.00 -0.00 0.00 0.00 58.31 58.62 1hj4 n LYS 542 Cb 0.39 -1.54 -0.06 0.00 0.00 0.00 0.00 35.03 33.82 1hj4 n LYS 542 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1hj4 s HIS 543 N -2.49 -0.65 -0.23 5.64 2.46 -0.98 -5.00 115.29 114.03 1hj4 s HIS 543 Ca -0.37 1.33 -0.04 0.00 0.47 0.00 0.00 55.06 56.45 1hj4 s HIS 543 Cb 0.13 0.37 -0.00 0.00 -0.13 0.00 0.00 32.58 32.94 1hj4 s HIS 543 CO 0.53 -0.47 -0.02 0.08 -2.47 0.00 0.00 174.74 172.38 1hj4 s VAL 544 N -0.55 3.43 -0.35 0.89 1.01 -1.26 -0.56 120.40 123.01 1hj4 s VAL 544 Ca -0.05 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.22 1hj4 s VAL 544 Cb -0.02 -2.61 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1hj4 s VAL 544 CO 0.05 0.35 0.35 -0.63 0.00 0.00 0.00 175.10 175.22 1hj4 s ILE 545 N 1.47 5.18 -0.01 2.22 1.01 0.73 -4.98 121.20 126.83 1hj4 s ILE 545 Ca 0.05 -0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.65 1hj4 s ILE 545 Cb -0.15 -3.84 -0.00 0.00 0.01 0.00 0.00 42.46 38.48 1hj4 s ILE 545 CO -0.02 -0.13 -0.09 -0.54 0.00 0.00 0.00 174.94 174.15 1hj4 s LYS 546 N 1.97 0.79 -0.17 2.79 1.02 -1.26 -1.36 119.74 123.52 1hj4 s LYS 546 Ca 0.11 -0.32 -0.28 0.00 0.02 0.00 0.00 55.97 55.50 1hj4 s LYS 546 Cb -0.17 -0.76 0.08 0.00 -0.52 0.00 0.00 37.83 36.46 1hj4 s LYS 546 CO 0.12 0.17 0.74 0.34 -0.92 0.00 0.00 175.35 175.79 1hj4 s ASP 547 N -0.09 -0.67 0.58 2.83 -1.08 -1.26 -5.02 116.67 111.95 1hj4 s ASP 547 Ca 0.02 1.04 0.28 0.00 -0.52 0.00 0.00 52.55 53.37 1hj4 s ASP 547 Cb -0.05 0.97 1.73 0.00 -1.46 0.00 0.00 42.92 44.11 1hj4 s ASP 547 CO -0.00 -0.41 2.21 -0.33 0.52 0.00 0.00 175.17 177.16 1hj4 h GLU 548 N 3.95 0.00 0.00 4.34 4.39 -2.01 0.02 114.58 125.27 1hj4 h GLU 548 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 1hj4 h GLU 548 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1hj4 h GLU 548 CO 0.22 0.00 -0.09 0.54 -1.16 0.00 0.00 179.01 178.51 1hj4 n ARG 549 N -3.91 0.11 -2.53 2.33 1.74 -1.26 -4.52 116.66 108.62 1hj4 n ARG 549 Ca -0.02 0.08 -0.43 0.00 -0.77 0.00 0.00 57.85 56.71 1hj4 n ARG 549 Cb 0.15 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1hj4 n ARG 549 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1hj4 n LEU 550 N -1.80 5.46 -4.71 0.55 7.94 -0.01 -4.95 117.00 119.48 1hj4 n LEU 550 Ca 0.06 -4.16 -0.36 0.00 -1.11 0.00 0.00 56.01 50.44 1hj4 n LEU 550 Cb 0.38 -1.68 -0.08 0.00 0.53 0.00 0.00 43.42 42.57 1hj4 n LEU 550 CO 0.30 0.56 -0.08 -0.69 -1.11 0.00 0.00 177.39 176.36 1hj4 s VAL 551 N 3.01 5.34 -1.20 1.96 1.01 -1.26 -4.52 120.40 124.74 1hj4 s VAL 551 Ca 0.49 0.39 -0.32 0.00 0.00 0.00 0.00 61.98 62.53 1hj4 s VAL 551 Cb 0.04 -3.57 0.04 0.00 0.00 0.00 0.00 36.38 32.89 1hj4 s VAL 551 CO 0.03 0.38 0.70 0.35 0.00 0.00 0.00 175.10 176.56 1hj4 n THR 552 N 3.78 -3.35 -2.12 3.92 -2.24 -1.26 -3.52 114.28 109.48 1hj4 n THR 552 Ca -0.13 -0.68 -0.42 0.00 -2.27 0.00 0.00 64.05 60.55 1hj4 n THR 552 Cb 0.52 -2.70 -0.03 0.00 -2.10 0.00 0.00 70.33 66.02 1hj4 n THR 552 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1hj4 s PRO 553 N -7.17 4.28 0.00 -0.78 0.04 -1.26 -1.44 135.00 128.67 1hj4 s PRO 553 Ca 0.49 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.64 1hj4 s PRO 553 Cb -0.25 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 30.86 1hj4 s PRO 553 CO 0.95 -0.55 0.00 0.25 0.04 0.00 0.00 177.00 177.69 1hj4 n THR 554 N 4.35 0.00 -2.11 1.26 -2.24 -0.63 -4.37 114.28 110.54 1hj4 n THR 554 Ca 0.13 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.52 1hj4 n THR 554 Cb 0.42 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 1hj4 n THR 554 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hj4 s GLY 555 N 0.00 2.93 -0.04 3.38 0.00 -1.26 -4.68 107.32 107.65 1hj4 s GLY 555 Ca 0.00 1.19 0.02 0.00 0.00 0.00 0.00 44.72 45.93 1hj4 s GLY 555 CO 0.00 1.77 -0.09 0.54 0.00 0.00 0.00 173.10 175.32 1hj4 s LYS 556 N -2.17 1.17 -0.16 2.90 1.02 -1.26 -0.51 119.74 120.73 1hj4 s LYS 556 Ca 0.55 -0.28 -0.02 0.00 0.02 0.00 0.00 55.97 56.25 1hj4 s LYS 556 Cb -0.37 -1.05 0.05 0.00 -0.52 0.00 0.00 37.83 35.94 1hj4 s LYS 556 CO 0.48 0.03 0.01 -0.06 -0.92 0.00 0.00 175.35 174.88 1hj4 s PHE 557 N 0.57 1.07 0.13 3.18 0.08 -0.44 -4.83 117.98 117.74 1hj4 s PHE 557 Ca -0.10 -0.74 -0.31 0.00 0.12 0.00 0.00 56.93 55.91 1hj4 s PHE 557 Cb -0.13 -1.03 -0.08 0.00 -0.57 0.00 0.00 43.02 41.22 1hj4 s PHE 557 CO 0.01 -0.54 1.31 1.21 -0.10 0.00 0.00 175.22 177.11 1hj4 s ASN 558 N 1.84 6.93 0.14 1.36 3.84 -1.26 -0.63 114.94 127.15 1hj4 s ASN 558 Ca 0.01 2.26 -0.25 0.00 0.21 0.00 0.00 52.86 55.08 1hj4 s ASN 558 Cb -0.16 -2.59 -0.02 0.00 -0.55 0.00 0.00 41.25 37.93 1hj4 s ASN 558 CO -0.07 -0.55 1.62 0.58 -2.79 0.00 0.00 177.10 175.88 1hj4 h VAL 559 N 4.15 0.33 -0.21 -5.21 2.07 -1.07 -1.14 116.25 115.17 1hj4 h VAL 559 Ca -0.43 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1hj4 h VAL 559 Cb 1.21 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1hj4 h VAL 559 CO 0.82 0.00 0.07 0.22 0.02 0.00 0.00 177.57 178.70 1hj4 h TYR 560 N -0.37 0.34 0.00 1.57 3.20 -1.62 -0.69 116.97 119.40 1hj4 h TYR 560 Ca 0.10 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1hj4 h TYR 560 Cb 0.52 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1hj4 h TYR 560 CO -0.38 0.41 -0.20 -0.91 -1.64 0.00 0.00 178.16 175.44 1hj4 h ASN 561 N 0.18 0.00 0.15 -2.11 2.35 -1.81 -2.13 115.58 112.21 1hj4 h ASN 561 Ca 0.07 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.53 1hj4 h ASN 561 Cb 0.23 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.61 1hj4 h ASN 561 CO -0.00 0.20 -1.43 0.74 -1.65 0.00 0.00 177.43 175.29 1hj4 h THR 562 N 0.00 1.10 0.00 2.81 2.02 -0.97 -0.42 112.91 117.44 1hj4 h THR 562 Ca -0.00 -2.48 -0.05 0.00 0.77 0.00 0.00 66.41 64.65 1hj4 h THR 562 Cb 0.46 2.83 -0.01 0.00 -1.74 0.00 0.00 68.15 69.70 1hj4 h THR 562 CO 0.03 0.76 -0.26 0.00 0.37 0.00 0.00 175.52 176.42 1hj4 h MET 563 N -0.16 0.00 -0.03 6.66 -0.00 -0.99 -2.98 114.93 117.43 1hj4 h MET 563 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.41 1hj4 h MET 563 Cb 1.87 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.47 1hj4 h MET 563 CO 0.12 0.26 -0.08 0.25 -0.00 0.00 0.00 176.91 177.46 1hj4 n THR 564 N -4.15 0.00 -3.73 -0.10 -2.24 -0.81 -4.73 114.28 98.52 1hj4 n THR 564 Ca -0.02 -0.46 -0.23 0.00 -2.27 0.00 0.00 64.05 61.07 1hj4 n THR 564 Cb 0.31 1.42 0.02 0.00 -2.10 0.00 0.00 70.33 69.99 1hj4 n THR 564 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1hj4 n ASP 565 N 1.02 -1.52 -4.38 3.42 8.00 -0.96 -4.94 116.55 117.20 1hj4 n ASP 565 Ca 0.12 -0.87 -0.45 0.00 0.71 0.00 0.00 54.79 54.31 1hj4 n ASP 565 Cb 0.53 -3.85 -0.05 0.00 -0.02 0.00 0.00 41.12 37.73 1hj4 n ASP 565 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1hj4 s THR 566 N -3.70 4.97 0.00 -3.53 2.01 -0.21 -5.01 115.64 110.17 1hj4 s THR 566 Ca 0.06 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.05 1hj4 s THR 566 Cb -0.02 -4.37 0.00 0.00 0.01 0.00 0.00 72.50 68.12 1hj4 s THR 566 CO 0.83 -0.94 0.00 0.00 -0.69 0.00 0.00 174.62 173.82