#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yj4 n PRO 5 N 0.00 0.00 0.13 -7.13 -0.02 -1.26 -4.63 135.00 122.09 1yj4 n PRO 5 Ca 0.00 -0.51 0.17 0.00 -2.02 0.00 0.00 63.50 61.14 1yj4 n PRO 5 Cb 0.00 -1.93 0.74 0.00 -0.02 0.00 0.00 33.50 32.28 1yj4 n PRO 5 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1yj4 h THR 6 N 4.08 0.66 -0.14 3.45 2.02 -2.05 -2.20 112.91 118.74 1yj4 h THR 6 Ca 0.04 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.27 1yj4 h THR 6 Cb 0.14 0.82 -0.06 0.00 -1.74 0.00 0.00 68.15 67.30 1yj4 h THR 6 CO 1.04 0.00 -0.27 -0.33 0.37 0.00 0.00 175.52 176.33 1yj4 h GLU 7 N 0.00 -0.32 0.16 6.66 5.08 -2.00 0.11 114.58 124.26 1yj4 h GLU 7 Ca 0.14 0.02 -0.29 0.00 -1.00 0.00 0.00 59.36 58.23 1yj4 h GLU 7 Cb 0.64 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.98 1yj4 h GLU 7 CO -0.00 -0.22 -1.32 -0.92 -1.00 0.00 0.00 179.01 175.56 1yj4 h TYR 8 N -0.33 0.61 -0.75 4.33 3.20 -1.89 -2.86 116.97 119.27 1yj4 h TYR 8 Ca 0.10 -0.45 0.18 0.00 3.14 0.00 0.00 58.73 61.71 1yj4 h TYR 8 Cb 0.49 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1yj4 h TYR 8 CO -0.37 1.36 0.52 0.35 -1.64 0.00 0.00 178.16 178.37 1yj4 h PHE 9 N 0.09 0.27 0.00 -3.82 3.57 -1.07 0.49 116.94 116.47 1yj4 h PHE 9 Ca -0.17 0.01 -0.22 0.00 3.53 0.00 0.00 57.97 61.12 1yj4 h PHE 9 Cb 2.02 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 40.65 1yj4 h PHE 9 CO 0.08 0.09 -1.33 -0.07 -2.23 0.00 0.00 178.31 174.84 1yj4 h LEU 10 N 0.22 0.00 -0.03 0.59 3.38 -0.80 -3.02 115.31 115.65 1yj4 h LEU 10 Ca 0.37 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 1yj4 h LEU 10 Cb 1.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.89 1yj4 h LEU 10 CO -0.08 0.82 -0.34 -1.13 0.09 0.00 0.00 178.44 177.80 1yj4 h ASN 11 N 0.00 0.34 0.11 -0.43 -0.73 -0.57 -2.54 115.58 111.76 1yj4 h ASN 11 Ca -0.16 -0.72 0.01 0.00 1.87 0.00 0.00 56.30 57.30 1yj4 h ASN 11 Cb 1.76 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 40.23 1yj4 h ASN 11 CO 0.08 1.01 -0.17 0.74 -0.37 0.00 0.00 177.43 178.72 1yj4 h THR 12 N -0.30 0.61 -0.58 -3.57 2.02 -0.30 -2.62 112.91 108.18 1yj4 h THR 12 Ca -0.03 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.26 1yj4 h THR 12 Cb 1.04 0.61 -0.09 0.00 -1.74 0.00 0.00 68.15 67.98 1yj4 h THR 12 CO 0.07 0.00 0.09 0.74 0.37 0.00 0.00 175.52 176.79 1yj4 h THR 13 N -0.34 0.62 0.57 3.16 2.02 -1.59 -1.44 112.91 115.92 1yj4 h THR 13 Ca 0.02 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1yj4 h THR 13 Cb 0.35 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1yj4 h THR 13 CO -0.08 0.04 -0.34 0.58 0.37 0.00 0.00 175.52 176.09 1yj4 h VAL 14 N 0.22 0.31 -0.87 3.16 2.07 -1.25 -2.44 116.25 117.45 1yj4 h VAL 14 Ca 0.30 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.97 1yj4 h VAL 14 Cb 0.45 0.31 -0.10 0.00 -1.52 0.00 0.00 31.29 30.44 1yj4 h VAL 14 CO -0.41 0.00 0.46 0.03 0.02 0.00 0.00 177.57 177.66 1yj4 h ARG 15 N -0.85 0.62 -0.05 1.57 3.08 -1.21 -0.70 114.38 116.84 1yj4 h ARG 15 Ca -0.07 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 59.98 1yj4 h ARG 15 Cb 0.69 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.55 1yj4 h ARG 15 CO 0.08 0.41 -0.26 1.25 -1.07 0.00 0.00 179.97 180.38 1yj4 h LEU 16 N 0.64 -0.80 -1.31 3.04 5.85 -0.89 0.47 115.31 122.32 1yj4 h LEU 16 Ca 0.48 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 59.25 1yj4 h LEU 16 Cb 0.69 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1yj4 h LEU 16 CO -0.37 -0.32 -0.31 -0.07 -0.34 0.00 0.00 178.44 177.02 1yj4 h LEU 17 N -0.38 0.00 -0.09 2.25 3.38 -0.92 -2.36 115.31 117.19 1yj4 h LEU 17 Ca 0.08 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1yj4 h LEU 17 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1yj4 h LEU 17 CO -0.27 0.31 -0.23 -0.33 0.09 0.00 0.00 178.44 178.02 1yj4 h GLU 18 N 0.00 0.31 -0.18 1.13 5.08 -0.14 0.48 114.58 121.26 1yj4 h GLU 18 Ca -0.00 -0.22 0.02 0.00 -1.00 0.00 0.00 59.36 58.16 1yj4 h GLU 18 Cb 0.66 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 1yj4 h GLU 18 CO 0.04 0.82 0.07 1.88 -1.00 0.00 0.00 179.01 180.83 1yj4 h TYR 19 N -0.15 0.13 0.00 4.33 -1.99 0.10 -2.37 116.97 117.03 1yj4 h TYR 19 Ca -0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1yj4 h TYR 19 Cb 0.83 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.53 1yj4 h TYR 19 CO 0.11 0.07 0.00 0.44 -0.00 0.00 0.00 178.16 178.79 1yj4 n ILE 20 N -5.03 0.04 -2.90 -2.88 -5.35 -0.91 -4.89 119.36 97.43 1yj4 n ILE 20 Ca -0.03 0.01 -0.10 0.00 -0.27 0.00 0.00 62.75 62.36 1yj4 n ILE 20 Cb 0.06 -0.61 0.04 0.00 -1.74 0.00 0.00 39.64 37.39 1yj4 n ILE 20 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1yj4 n ARG 21 N -1.05 -3.63 -1.65 6.28 1.74 -0.89 -4.95 116.66 112.51 1yj4 n ARG 21 Ca 0.18 0.41 -0.47 0.00 -0.77 0.00 0.00 57.85 57.20 1yj4 n ARG 21 Cb 0.10 -4.14 -0.04 0.00 -1.02 0.00 0.00 32.46 27.36 1yj4 n ARG 21 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1yj4 n TYR 22 N -3.26 2.08 -3.60 -1.55 9.36 0.16 -4.94 117.16 115.41 1yj4 n TYR 22 Ca -0.05 0.39 -0.00 0.00 3.32 0.00 0.00 57.90 61.55 1yj4 n TYR 22 Cb 0.55 -2.48 0.00 0.00 -0.63 0.00 0.00 39.34 36.79 1yj4 n TYR 22 CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 1yj4 n ARG 23 N 2.87 0.11 -2.64 2.98 1.85 -1.26 -4.95 116.66 115.62 1yj4 n ARG 23 Ca 0.16 -0.28 -0.35 0.00 -1.00 0.00 0.00 57.85 56.39 1yj4 n ARG 23 Cb 0.28 0.39 -0.05 0.00 -1.05 0.00 0.00 32.46 32.02 1yj4 n ARG 23 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1yj4 s ASP 24 N -1.53 6.69 0.28 2.89 1.01 -1.26 -5.08 116.67 119.68 1yj4 s ASP 24 Ca 0.05 1.88 0.11 0.00 0.71 0.00 0.00 52.55 55.30 1yj4 s ASP 24 Cb -0.00 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 1yj4 s ASP 24 CO 0.01 -0.54 -0.14 -0.94 0.21 0.00 0.00 175.17 173.77 1yj4 s SER 25 N -1.91 3.83 -0.02 0.27 1.04 -1.26 -5.00 113.70 110.65 1yj4 s SER 25 Ca 0.62 -0.95 0.02 0.00 0.48 0.00 0.00 55.95 56.12 1yj4 s SER 25 Cb -0.16 -0.43 0.10 0.00 0.10 0.00 0.00 66.02 65.63 1yj4 s SER 25 CO 0.20 0.01 0.78 0.59 0.98 0.00 0.00 173.24 175.80 1yj4 n ASN 26 N -0.70 1.30 -4.38 7.02 3.02 -1.26 -4.57 115.26 115.68 1yj4 n ASN 26 Ca -0.05 -2.09 -0.46 0.00 -0.03 0.00 0.00 54.58 51.96 1yj4 n ASN 26 Cb 0.60 -0.39 -0.03 0.00 -0.61 0.00 0.00 39.78 39.35 1yj4 n ASN 26 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1yj4 s TYR 27 N -1.41 3.42 0.76 3.10 5.04 -1.26 -5.04 117.35 121.96 1yj4 s TYR 27 Ca 0.07 -1.63 -0.11 0.00 -2.44 0.00 0.00 57.07 52.96 1yj4 s TYR 27 Cb 0.05 -4.02 0.05 0.00 0.35 0.00 0.00 41.96 38.39 1yj4 s TYR 27 CO 0.03 -1.22 1.08 0.95 -1.34 0.00 0.00 175.55 175.05 1yj4 s THR 28 N 1.45 3.48 0.30 4.34 -4.23 -1.26 -4.87 115.64 114.85 1yj4 s THR 28 Ca 0.23 0.48 0.01 0.00 -1.18 0.00 0.00 61.69 61.22 1yj4 s THR 28 Cb -0.10 -3.10 0.28 0.00 1.34 0.00 0.00 72.50 70.92 1yj4 s THR 28 CO -0.07 -0.63 1.91 -0.09 -0.54 0.00 0.00 174.62 175.20 1yj4 h ARG 29 N -1.02 0.99 -0.43 3.99 2.43 -1.90 -1.37 114.38 117.07 1yj4 h ARG 29 Ca -0.45 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 58.56 1yj4 h ARG 29 Cb 1.23 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1yj4 h ARG 29 CO 0.55 0.66 -0.13 0.93 -1.51 0.00 0.00 179.97 180.46 1yj4 h GLU 30 N 1.02 0.79 -0.50 0.20 3.07 -1.96 -1.77 114.58 115.43 1yj4 h GLU 30 Ca 0.39 -0.27 -0.09 0.00 -0.50 0.00 0.00 59.36 58.89 1yj4 h GLU 30 Cb 0.19 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.02 1yj4 h GLU 30 CO -0.14 0.88 -0.04 0.93 -1.40 0.00 0.00 179.01 179.24 1yj4 h GLU 31 N 0.71 0.87 -0.01 2.33 5.08 -1.65 -1.78 114.58 120.12 1yj4 h GLU 31 Ca 0.12 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1yj4 h GLU 31 Cb 0.62 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1yj4 h GLU 31 CO 0.04 0.89 0.01 0.00 -1.00 0.00 0.00 179.01 178.95 1yj4 h ARG 32 N 0.79 0.02 -1.00 2.33 3.08 -0.96 -1.32 114.38 117.33 1yj4 h ARG 32 Ca 0.14 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.24 1yj4 h ARG 32 Cb 0.53 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.52 1yj4 h ARG 32 CO 0.03 0.19 0.65 0.82 -1.07 0.00 0.00 179.97 180.59 1yj4 h ILE 33 N -0.15 1.13 -0.30 2.04 2.04 -1.23 0.56 117.51 121.60 1yj4 h ILE 33 Ca 0.00 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1yj4 h ILE 33 Cb 0.17 -0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.04 1yj4 h ILE 33 CO -0.00 0.22 0.16 -0.08 0.00 0.00 0.00 178.15 178.45 1yj4 h GLU 34 N 1.22 0.43 0.03 2.37 4.81 -1.09 -1.83 114.58 120.52 1yj4 h GLU 34 Ca 0.42 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.59 1yj4 h GLU 34 Cb 0.09 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1yj4 h GLU 34 CO -0.15 0.39 -0.01 -0.91 -0.73 0.00 0.00 179.01 177.59 1yj4 h ASN 35 N 0.36 -0.03 -0.77 1.04 2.35 -0.47 -2.67 115.58 115.38 1yj4 h ASN 35 Ca 0.11 -0.51 0.18 0.00 -0.55 0.00 0.00 56.30 55.53 1yj4 h ASN 35 Cb 0.09 0.01 -0.13 0.00 0.05 0.00 0.00 38.32 38.34 1yj4 h ASN 35 CO -0.02 0.50 0.06 -0.07 -1.65 0.00 0.00 177.43 176.26 1yj4 h LEU 36 N -0.59 -0.25 -0.57 1.61 3.38 0.10 -0.58 115.31 118.41 1yj4 h LEU 36 Ca -0.00 0.19 -0.15 0.00 0.09 0.00 0.00 57.88 58.00 1yj4 h LEU 36 Cb 0.54 0.31 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1yj4 h LEU 36 CO 0.01 -0.16 -0.55 -0.74 0.09 0.00 0.00 178.44 177.09 1yj4 h HIS 37 N 0.14 0.59 -0.21 1.13 2.76 -1.36 -1.08 115.15 117.11 1yj4 h HIS 37 Ca 0.44 -0.21 -0.06 0.00 -2.20 0.00 0.00 60.37 58.34 1yj4 h HIS 37 Cb 0.79 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.63 1yj4 h HIS 37 CO -0.38 0.92 -0.10 -0.92 -1.30 0.00 0.00 177.93 176.14 1yj4 h TYR 38 N 0.36 0.52 -0.04 5.26 3.20 -0.83 0.11 116.97 125.55 1yj4 h TYR 38 Ca 0.01 -0.13 -0.00 0.00 3.14 0.00 0.00 58.73 61.74 1yj4 h TYR 38 Cb 1.08 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.23 1yj4 h TYR 38 CO 0.04 0.73 0.01 0.00 -1.64 0.00 0.00 178.16 177.30 1yj4 h ALA 39 N 0.71 0.05 -0.68 1.82 0.00 -1.18 -2.38 119.26 117.59 1yj4 h ALA 39 Ca 0.05 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1yj4 h ALA 39 Cb 0.60 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1yj4 h ALA 39 CO 0.03 -0.33 0.44 -0.92 0.00 0.00 0.00 179.25 178.47 1yj4 h TYR 40 N -0.17 0.82 -0.66 0.00 3.20 -1.20 -1.75 116.97 117.21 1yj4 h TYR 40 Ca 0.01 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 1yj4 h TYR 40 Cb 0.25 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 1yj4 h TYR 40 CO 0.01 0.48 0.24 -0.97 -1.64 0.00 0.00 178.16 176.28 1yj4 h ASN 41 N 0.87 0.94 -0.10 -2.11 -1.24 -0.85 0.33 115.58 113.41 1yj4 h ASN 41 Ca 0.27 -0.19 -0.06 0.00 0.71 0.00 0.00 56.30 57.03 1yj4 h ASN 41 Cb -0.02 -0.24 -0.00 0.00 0.73 0.00 0.00 38.32 38.79 1yj4 h ASN 41 CO -0.09 0.87 -0.16 0.50 -1.29 0.00 0.00 177.43 177.26 1yj4 h LYS 42 N 0.94 0.28 -0.89 6.67 3.64 -1.26 -2.49 116.57 123.46 1yj4 h LYS 42 Ca 0.22 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1yj4 h LYS 42 Cb 0.25 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 1yj4 h LYS 42 CO -0.01 0.75 0.59 0.00 -2.27 0.00 0.00 179.45 178.50 1yj4 h ALA 43 N 0.53 1.14 -0.85 5.00 0.00 -1.22 -1.73 119.26 122.12 1yj4 h ALA 43 Ca 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1yj4 h ALA 43 Cb 0.72 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1yj4 h ALA 43 CO 0.04 0.51 0.48 0.00 0.00 0.00 0.00 179.25 180.28 1yj4 h ALA 44 N 1.34 1.09 -0.13 0.00 0.00 -0.32 -1.51 119.26 119.74 1yj4 h ALA 44 Ca 0.33 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 1yj4 h ALA 44 Cb -0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 1yj4 h ALA 44 CO -0.08 0.59 -0.39 0.45 0.00 0.00 0.00 179.25 179.81 1yj4 h HIS 45 N 1.19 0.33 0.61 0.00 -0.00 -0.96 -2.70 115.15 113.61 1yj4 h HIS 45 Ca 0.30 -0.09 -0.03 0.00 -0.00 0.00 0.00 60.37 60.56 1yj4 h HIS 45 Cb 0.01 -0.07 0.01 0.00 -0.00 0.00 0.00 27.41 27.35 1yj4 h HIS 45 CO 0.00 0.64 -0.29 1.25 -0.00 0.00 0.00 177.93 179.53 1yj4 h HIS 46 N 0.24 -0.75 0.00 2.45 6.17 -0.51 -3.06 115.15 119.69 1yj4 h HIS 46 Ca 0.02 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.09 1yj4 h HIS 46 Cb 0.80 0.25 0.00 0.00 2.52 0.00 0.00 27.41 30.98 1yj4 h HIS 46 CO 0.02 -0.43 0.00 1.19 0.71 0.00 0.00 177.93 179.42 1yj4 n PHE 47 N -5.39 0.53 1.01 5.26 3.72 -0.65 -2.42 117.46 119.52 1yj4 n PHE 47 Ca -0.12 0.22 0.13 0.00 -0.05 0.00 0.00 57.45 57.62 1yj4 n PHE 47 Cb 0.35 -0.85 0.35 0.00 -0.94 0.00 0.00 39.48 38.39 1yj4 n PHE 47 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yj4 n ALA 48 N -1.68 3.22 -1.75 4.37 0.00 -1.02 -4.05 120.51 119.60 1yj4 n ALA 48 Ca 0.02 -0.29 -0.36 0.00 0.00 0.00 0.00 53.44 52.81 1yj4 n ALA 48 Cb 0.17 -1.21 0.03 0.00 0.00 0.00 0.00 19.45 18.44 1yj4 n ALA 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1yj4 s GLN 49 N -2.99 3.05 0.17 0.00 -0.21 -1.02 -4.24 119.66 114.42 1yj4 s GLN 49 Ca 0.12 1.87 -0.19 0.00 0.02 0.00 0.00 55.36 57.18 1yj4 s GLN 49 Cb 0.18 -2.00 0.10 0.00 1.00 0.00 0.00 33.01 32.29 1yj4 s GLN 49 CO 0.65 -1.15 1.63 -1.35 -2.12 0.00 0.00 175.29 172.95 1yj4 h PRO 50 N 1.04 -0.12 -0.53 2.91 0.11 -1.91 0.10 132.00 133.61 1yj4 h PRO 50 Ca -0.50 0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.64 1yj4 h PRO 50 Cb 1.29 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.40 1yj4 h PRO 50 CO 0.56 -0.08 0.32 -0.09 -0.21 0.00 0.00 178.00 178.49 1yj4 h ARG 51 N -0.13 0.61 -0.49 1.05 2.43 -1.96 0.98 114.38 116.88 1yj4 h ARG 51 Ca 0.19 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.20 1yj4 h ARG 51 Cb 0.42 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1yj4 h ARG 51 CO -0.47 0.40 -0.18 1.96 -1.51 0.00 0.00 179.97 180.17 1yj4 h GLN 52 N 0.63 0.97 -0.79 0.20 1.08 -1.74 -1.71 115.11 113.75 1yj4 h GLN 52 Ca 0.21 -0.39 -0.03 0.00 -1.45 0.00 0.00 58.65 57.00 1yj4 h GLN 52 Cb 0.02 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.37 1yj4 h GLN 52 CO -0.09 1.06 0.39 1.96 -0.95 0.00 0.00 178.83 181.20 1yj4 h GLN 53 N 0.85 1.14 0.16 1.46 1.08 -0.26 -2.18 115.11 117.35 1yj4 h GLN 53 Ca 0.12 -0.16 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 1yj4 h GLN 53 Cb 0.74 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 1yj4 h GLN 53 CO 0.06 0.87 -0.08 0.37 -0.95 0.00 0.00 178.83 179.10 1yj4 h GLN 54 N 1.12 -0.21 -0.05 1.46 4.15 -0.60 -3.36 115.11 117.61 1yj4 h GLN 54 Ca 0.27 0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.58 1yj4 h GLN 54 Cb 0.10 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1yj4 h GLN 54 CO -0.04 0.23 -0.55 -0.07 -1.93 0.00 0.00 178.83 176.47 1yj4 h LEU 55 N -0.80 0.18 -8.14 -2.39 3.38 -1.37 -3.39 115.31 102.77 1yj4 h LEU 55 Ca -0.02 -0.09 -0.66 0.00 0.09 0.00 0.00 57.88 57.19 1yj4 h LEU 55 Cb 0.53 -0.05 -0.16 0.00 0.09 0.00 0.00 40.66 41.07 1yj4 h LEU 55 CO 0.04 0.69 0.59 -0.22 0.09 0.00 0.00 178.44 179.63 1yj4 s LEU 56 N -7.93 4.77 -0.96 1.67 2.96 -0.82 -4.72 118.68 113.64 1yj4 s LEU 56 Ca -0.03 -1.44 -0.24 0.00 -0.22 0.00 0.00 54.13 52.20 1yj4 s LEU 56 Cb 0.13 -2.40 0.04 0.00 0.50 0.00 0.00 46.19 44.46 1yj4 s LEU 56 CO 0.78 -1.26 1.48 -0.54 -1.32 0.00 0.00 176.35 175.49 1yj4 s LYS 57 N 3.37 3.42 0.01 1.98 -0.14 -1.26 -4.80 119.74 122.31 1yj4 s LYS 57 Ca 0.24 -0.89 0.01 0.00 -1.36 0.00 0.00 55.97 53.97 1yj4 s LYS 57 Cb -0.13 -5.15 -0.01 0.00 -1.68 0.00 0.00 37.83 30.86 1yj4 s LYS 57 CO 0.02 -2.32 -0.03 0.08 -0.76 0.00 0.00 175.35 172.35 1yj4 s VAL 58 N 5.63 0.20 -0.06 3.17 1.01 -1.26 -5.04 120.40 124.05 1yj4 s VAL 58 Ca 0.47 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.79 1yj4 s VAL 58 Cb -0.02 -0.22 -0.06 0.00 0.00 0.00 0.00 36.38 36.08 1yj4 s VAL 58 CO -0.05 -0.11 1.68 -0.62 0.00 0.00 0.00 175.10 176.00 1yj4 s ASP 59 N -0.51 6.63 0.21 3.32 2.15 -1.26 -4.84 116.67 122.37 1yj4 s ASP 59 Ca -0.04 2.24 -0.12 0.00 0.43 0.00 0.00 52.55 55.06 1yj4 s ASP 59 Cb -0.04 -2.53 0.27 0.00 -0.30 0.00 0.00 42.92 40.32 1yj4 s ASP 59 CO -0.00 -0.96 1.31 -2.65 -0.17 0.00 0.00 175.17 172.70 1yj4 n PRO 60 N 7.20 -0.15 0.13 4.34 -0.02 -1.26 0.65 135.00 145.89 1yj4 n PRO 60 Ca 0.18 1.30 0.09 0.00 -2.02 0.00 0.00 63.50 63.05 1yj4 n PRO 60 Cb 0.43 -1.94 0.58 0.00 -0.02 0.00 0.00 33.50 32.55 1yj4 n PRO 60 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1yj4 h LYS 61 N 0.00 0.16 0.00 -0.52 1.57 -1.99 0.65 116.57 116.45 1yj4 h LYS 61 Ca 0.33 -0.01 -0.23 0.00 -1.87 0.00 0.00 60.65 58.88 1yj4 h LYS 61 Cb 0.54 -0.04 0.02 0.00 0.08 0.00 0.00 32.23 32.84 1yj4 h LYS 61 CO -0.85 0.11 -0.89 0.00 -0.57 0.00 0.00 179.45 177.25 1yj4 h ARG 62 N 0.17 0.60 -0.25 3.15 2.47 -0.15 -2.24 114.38 118.12 1yj4 h ARG 62 Ca 0.10 -0.65 -0.01 0.00 -1.26 0.00 0.00 59.98 58.16 1yj4 h ARG 62 Cb 0.18 0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.67 1yj4 h ARG 62 CO -0.02 1.25 0.12 1.25 0.56 0.00 0.00 179.97 183.14 1yj4 h LEU 63 N 0.22 0.33 -0.59 3.04 5.85 -0.36 -0.45 115.31 123.36 1yj4 h LEU 63 Ca -0.11 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.54 1yj4 h LEU 63 Cb 1.57 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.46 1yj4 h LEU 63 CO 0.18 0.37 0.30 -0.61 -0.34 0.00 0.00 178.44 178.33 1yj4 h GLN 64 N 0.28 0.54 -0.10 1.25 5.75 -0.94 0.13 115.11 122.02 1yj4 h GLN 64 Ca 0.09 -0.03 -0.18 0.00 -0.15 0.00 0.00 58.65 58.37 1yj4 h GLN 64 Cb 0.12 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.55 1yj4 h GLN 64 CO -0.01 0.36 -0.71 0.00 -2.65 0.00 0.00 178.83 175.81 1yj4 h ALA 65 N 1.33 0.58 -0.34 3.38 0.00 -1.18 -2.80 119.26 120.23 1yj4 h ALA 65 Ca 0.27 -0.59 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 1yj4 h ALA 65 Cb 0.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1yj4 h ALA 65 CO -0.20 0.74 -0.12 0.77 0.00 0.00 0.00 179.25 180.45 1yj4 h SER 66 N 0.32 0.69 -0.67 0.00 0.02 -0.71 -2.26 113.55 110.94 1yj4 h SER 66 Ca -0.03 -0.39 0.01 0.00 -0.84 0.00 0.00 61.79 60.55 1yj4 h SER 66 Cb 1.29 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.60 1yj4 h SER 66 CO 0.13 0.92 0.43 0.25 -1.14 0.00 0.00 176.83 177.42 1yj4 h LEU 67 N 0.45 0.74 -0.70 5.07 5.85 -0.99 -1.66 115.31 124.07 1yj4 h LEU 67 Ca 0.08 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 1yj4 h LEU 67 Cb 0.64 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1yj4 h LEU 67 CO 0.04 0.53 0.06 1.56 -0.34 0.00 0.00 178.44 180.29 1yj4 h GLN 68 N 0.88 1.06 -0.58 1.25 4.20 -1.40 -0.95 115.11 119.56 1yj4 h GLN 68 Ca 0.25 -0.30 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 1yj4 h GLN 68 Cb -0.06 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 1yj4 h GLN 68 CO -0.07 1.00 0.05 1.15 -0.67 0.00 0.00 178.83 180.29 1yj4 h THR 69 N 0.98 1.26 -0.01 -0.54 2.02 -1.08 -2.47 112.91 113.07 1yj4 h THR 69 Ca 0.19 -1.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.31 1yj4 h THR 69 Cb 0.49 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1yj4 h THR 69 CO 0.02 0.38 -0.01 0.40 0.37 0.00 0.00 175.52 176.68 1yj4 h ILE 70 N 0.88 1.39 -0.93 3.11 1.08 -1.14 -1.75 117.51 120.15 1yj4 h ILE 70 Ca 0.17 -1.18 0.14 0.00 -0.39 0.00 0.00 64.86 63.61 1yj4 h ILE 70 Cb 0.47 2.17 -0.09 0.00 -3.07 0.00 0.00 36.82 36.30 1yj4 h ILE 70 CO 0.02 0.31 0.54 0.58 -0.69 0.00 0.00 178.15 178.90 1yj4 h VAL 71 N -0.46 0.80 -0.69 1.67 2.07 -1.21 0.11 116.25 118.54 1yj4 h VAL 71 Ca 0.00 -0.27 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1yj4 h VAL 71 Cb 0.51 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 1yj4 h VAL 71 CO 0.00 0.14 0.13 1.23 0.02 0.00 0.00 177.57 179.10 1yj4 h GLY 72 N 0.78 1.20 0.86 2.17 0.00 -1.34 -0.56 103.07 106.18 1yj4 h GLY 72 Ca 0.49 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 1yj4 h GLY 72 CO -0.33 0.73 0.05 1.98 0.00 0.00 0.00 176.54 178.97 1yj4 h MET 73 N 1.05 0.20 0.28 4.80 -1.53 0.03 -2.37 114.93 117.39 1yj4 h MET 73 Ca 0.21 -0.04 -0.01 0.00 -3.44 0.00 0.00 59.70 56.42 1yj4 h MET 73 Cb 0.42 -0.03 0.00 0.00 -0.55 0.00 0.00 31.60 31.44 1yj4 h MET 73 CO 0.01 0.31 -0.14 0.28 0.14 0.00 0.00 176.91 177.52 1yj4 h VAL 74 N 0.05 0.74 -0.43 -5.77 2.07 -0.82 -1.55 116.25 110.53 1yj4 h VAL 74 Ca 0.04 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.06 1yj4 h VAL 74 Cb 0.19 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1yj4 h VAL 74 CO -0.00 0.11 0.29 0.58 0.02 0.00 0.00 177.57 178.58 1yj4 h VAL 75 N -0.70 0.94 0.00 2.57 2.07 -1.18 0.59 116.25 120.54 1yj4 h VAL 75 Ca -0.04 -0.11 -0.16 0.00 0.82 0.00 0.00 66.70 67.21 1yj4 h VAL 75 Cb 0.48 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1yj4 h VAL 75 CO 0.06 0.06 -1.00 1.88 0.02 0.00 0.00 177.57 178.59 1yj4 h TYR 76 N 0.31 0.00 0.00 1.57 -1.99 -1.40 -3.38 116.97 112.08 1yj4 h TYR 76 Ca 0.19 0.00 -0.30 0.00 2.00 0.00 0.00 58.73 60.62 1yj4 h TYR 76 Cb 0.37 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.04 1yj4 h TYR 76 CO -0.00 0.66 -2.13 0.43 -0.00 0.00 0.00 178.16 177.12 1yj4 n SER 77 N -3.12 1.45 -2.97 3.88 7.64 -0.59 -3.98 113.62 115.93 1yj4 n SER 77 Ca -0.04 -0.03 -0.37 0.00 1.01 0.00 0.00 58.87 59.44 1yj4 n SER 77 Cb 0.83 0.52 0.01 0.00 -1.01 0.00 0.00 64.21 64.56 1yj4 n SER 77 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 1yj4 n TRP 78 N -2.75 2.55 0.34 1.43 8.01 0.16 -3.40 117.44 123.78 1yj4 n TRP 78 Ca -0.29 -2.30 0.21 0.00 -1.31 0.00 0.00 57.50 53.81 1yj4 n TRP 78 Cb 0.98 -1.29 1.13 0.00 -2.01 0.00 0.00 31.31 30.12 1yj4 n TRP 78 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1yj4 h ALA 79 N 3.33 1.09 -0.35 6.99 0.00 -1.77 -3.02 119.26 125.53 1yj4 h ALA 79 Ca 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1yj4 h ALA 79 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1yj4 h ALA 79 CO 1.25 -0.08 0.00 1.63 0.00 0.00 0.00 179.25 182.05 1yj4 n LYS 80 N -3.04 2.29 -3.43 0.00 5.02 -1.26 -4.98 118.16 112.75 1yj4 n LYS 80 Ca -0.03 -2.09 -0.21 0.00 -2.02 0.00 0.00 58.31 53.96 1yj4 n LYS 80 Cb 0.14 -1.42 -0.00 0.00 -0.02 0.00 0.00 35.03 33.73 1yj4 n LYS 80 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1yj4 s VAL 81 N -1.25 4.42 1.11 -0.18 -7.23 -1.14 -5.08 120.40 111.06 1yj4 s VAL 81 Ca 0.32 -0.80 -0.12 0.00 -1.81 0.00 0.00 61.98 59.57 1yj4 s VAL 81 Cb 0.19 -3.58 0.25 0.00 0.56 0.00 0.00 36.38 33.80 1yj4 s VAL 81 CO 0.26 -0.29 1.05 -1.54 -0.31 0.00 0.00 175.10 174.27 1yj4 n SER 82 N -1.73 -1.20 -0.10 4.85 3.41 -1.26 -4.78 113.62 112.82 1yj4 n SER 82 Ca -0.02 -0.01 -0.06 0.00 -0.26 0.00 0.00 58.87 58.52 1yj4 n SER 82 Cb 0.57 -1.32 0.13 0.00 -0.26 0.00 0.00 64.21 63.34 1yj4 n SER 82 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1yj4 h LYS 83 N -2.50 0.78 -0.43 4.33 1.57 -1.98 -1.85 116.57 116.50 1yj4 h LYS 83 Ca -0.57 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 57.95 1yj4 h LYS 83 Cb 1.32 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 1yj4 h LYS 83 CO 0.47 0.85 0.23 0.93 -0.57 0.00 0.00 179.45 181.36 1yj4 h GLU 84 N 0.71 0.60 -0.91 3.15 4.39 -1.98 -0.64 114.58 119.91 1yj4 h GLU 84 Ca 0.12 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 1yj4 h GLU 84 Cb 0.57 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 1yj4 h GLU 84 CO 0.04 0.49 0.50 0.00 -1.16 0.00 0.00 179.01 178.87 1yj4 h MET 86 N 1.27 0.87 -0.06 0.00 2.86 -0.85 -1.20 114.93 117.82 1yj4 h MET 86 Ca 0.32 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.82 1yj4 h MET 86 Cb 0.02 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.52 1yj4 h MET 86 CO -0.05 0.71 0.01 0.00 1.06 0.00 0.00 176.91 178.64 1yj4 h ALA 87 N 1.12 0.07 -0.53 6.32 0.00 -0.49 -0.61 119.26 125.14 1yj4 h ALA 87 Ca 0.21 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1yj4 h ALA 87 Cb 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1yj4 h ALA 87 CO -0.03 -0.30 0.04 -0.44 0.00 0.00 0.00 179.25 178.52 1yj4 h ASP 88 N -0.13 0.83 0.22 0.00 3.32 -1.03 -1.73 116.42 117.89 1yj4 h ASP 88 Ca 0.02 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 56.77 1yj4 h ASP 88 Cb 0.25 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1yj4 h ASP 88 CO 0.00 0.87 -0.38 -0.07 -1.72 0.00 0.00 179.24 177.94 1yj4 h LEU 89 N 0.81 0.24 -0.60 1.55 3.38 -1.18 -2.23 115.31 117.28 1yj4 h LEU 89 Ca 0.16 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1yj4 h LEU 89 Cb 0.44 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1yj4 h LEU 89 CO 0.02 0.61 -0.06 0.28 0.09 0.00 0.00 178.44 179.37 1yj4 h SER 90 N 0.20 1.04 -0.12 -0.43 0.02 -0.42 -0.90 113.55 112.94 1yj4 h SER 90 Ca 0.02 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.64 1yj4 h SER 90 Cb 0.77 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 1yj4 h SER 90 CO 0.06 1.12 0.05 0.40 -1.14 0.00 0.00 176.83 177.32 1yj4 h ILE 91 N 0.94 1.13 -0.03 3.27 2.04 -1.10 -1.57 117.51 122.20 1yj4 h ILE 91 Ca 0.16 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1yj4 h ILE 91 Cb 0.62 1.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1yj4 h ILE 91 CO 0.04 0.12 0.02 -0.74 0.00 0.00 0.00 178.15 177.59 1yj4 h HIS 92 N 0.05 0.04 0.00 1.37 2.76 -1.24 -1.83 115.15 116.29 1yj4 h HIS 92 Ca 0.04 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1yj4 h HIS 92 Cb 0.14 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.09 1yj4 h HIS 92 CO -0.02 0.03 0.00 1.88 -1.30 0.00 0.00 177.93 178.52 1yj4 h TYR 93 N 0.03 0.00 0.05 5.26 0.05 -1.18 -1.83 116.97 119.35 1yj4 h TYR 93 Ca 0.01 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.56 1yj4 h TYR 93 Cb 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 1yj4 h TYR 93 CO -0.08 0.00 -1.08 1.15 -1.05 0.00 0.00 178.16 177.10 1yj4 h THR 94 N 0.00 1.61 -0.56 -2.88 2.02 -0.76 -2.28 112.91 110.06 1yj4 h THR 94 Ca 0.00 -3.19 -0.05 0.00 0.77 0.00 0.00 66.41 63.94 1yj4 h THR 94 Cb 0.47 2.85 -0.02 0.00 -1.74 0.00 0.00 68.15 69.70 1yj4 h THR 94 CO 0.00 0.92 0.15 1.88 0.37 0.00 0.00 175.52 178.85 1yj4 h TYR 95 N 0.04 0.92 -0.40 3.16 0.05 -0.53 -1.54 116.97 118.67 1yj4 h TYR 95 Ca -0.06 -0.10 -0.06 0.00 0.05 0.00 0.00 58.73 58.55 1yj4 h TYR 95 Cb 1.82 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 39.29 1yj4 h TYR 95 CO 0.03 0.78 0.01 1.79 -1.05 0.00 0.00 178.16 179.72 1yj4 h THR 96 N 0.78 1.26 -0.19 -2.88 1.35 -1.43 -1.57 112.91 110.24 1yj4 h THR 96 Ca 0.18 -0.99 -0.05 0.00 -0.55 0.00 0.00 66.41 65.00 1yj4 h THR 96 Cb 0.31 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 67.84 1yj4 h THR 96 CO -0.00 0.33 -0.10 0.25 -0.25 0.00 0.00 175.52 175.75 1yj4 h LEU 97 N 0.52 0.27 -0.58 3.87 5.85 -1.29 -1.33 115.31 122.63 1yj4 h LEU 97 Ca 0.11 -0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.63 1yj4 h LEU 97 Cb 0.46 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1yj4 h LEU 97 CO 0.02 0.41 -0.42 0.58 -0.34 0.00 0.00 178.44 178.69 1yj4 h VAL 98 N 0.28 1.30 -0.08 1.05 2.07 -0.95 -2.86 116.25 117.06 1yj4 h VAL 98 Ca 0.06 -1.60 -0.11 0.00 0.82 0.00 0.00 66.70 65.87 1yj4 h VAL 98 Cb 0.36 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1yj4 h VAL 98 CO 0.02 0.51 -0.45 0.25 0.02 0.00 0.00 177.57 177.92 1yj4 h LEU 99 N 0.54 0.19 -1.87 2.57 5.85 -0.71 -2.70 115.31 119.18 1yj4 h LEU 99 Ca 0.04 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1yj4 h LEU 99 Cb 0.95 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.93 1yj4 h LEU 99 CO 0.09 0.62 -0.09 -0.78 -0.34 0.00 0.00 178.44 177.94 1yj4 h ASP 100 N 0.15 0.00 0.35 1.25 1.82 -1.03 -2.53 116.42 116.43 1yj4 h ASP 100 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1yj4 h ASP 100 Cb 0.86 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.87 1yj4 h ASP 100 CO 0.07 0.09 -1.14 0.47 -1.61 0.00 0.00 179.24 177.12 1yj4 n ASP 101 N -4.33 0.59 -4.73 2.28 8.00 -1.05 -4.97 116.55 112.33 1yj4 n ASP 101 Ca -0.03 -0.26 -0.36 0.00 0.71 0.00 0.00 54.79 54.85 1yj4 n ASP 101 Cb 0.17 0.95 0.07 0.00 -0.02 0.00 0.00 41.12 42.29 1yj4 n ASP 101 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1yj4 s SER 102 N -3.94 4.56 0.00 -2.24 0.15 -0.95 -4.94 113.70 106.34 1yj4 s SER 102 Ca 0.03 2.56 0.02 0.00 0.70 0.00 0.00 55.95 59.26 1yj4 s SER 102 Cb 0.14 -2.61 0.04 0.00 -1.71 0.00 0.00 66.02 61.88 1yj4 s SER 102 CO 0.82 -2.03 0.92 0.29 1.20 0.00 0.00 173.24 174.44 1yj4 n LYS 103 N -2.03 2.03 -2.61 5.44 5.02 -1.26 -5.02 118.16 119.73 1yj4 n LYS 103 Ca 0.15 -1.34 -0.42 0.00 -2.02 0.00 0.00 58.31 54.69 1yj4 n LYS 103 Cb 0.49 -1.04 -0.03 0.00 -0.02 0.00 0.00 35.03 34.43 1yj4 n LYS 103 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1yj4 s ASP 104 N -0.78 7.26 0.05 4.39 1.11 -1.26 -4.99 116.67 122.44 1yj4 s ASP 104 Ca 0.03 1.78 -0.30 0.00 0.18 0.00 0.00 52.55 54.24 1yj4 s ASP 104 Cb 0.02 -2.57 -0.08 0.00 1.07 0.00 0.00 42.92 41.35 1yj4 s ASP 104 CO 0.02 -0.34 1.73 -0.62 1.18 0.00 0.00 175.17 177.14 1yj4 s ASP 105 N 1.04 6.57 0.08 0.27 2.15 -1.26 -4.92 116.67 120.60 1yj4 s ASP 105 Ca 0.54 2.50 -0.14 0.00 0.43 0.00 0.00 52.55 55.88 1yj4 s ASP 105 Cb -0.24 -2.55 -0.16 0.00 -0.30 0.00 0.00 42.92 39.67 1yj4 s ASP 105 CO 0.28 -0.94 1.29 -0.65 -0.17 0.00 0.00 175.17 174.98 1yj4 h PRO 106 N 9.01 0.72 -0.49 4.34 0.11 -1.96 -3.39 132.00 140.34 1yj4 h PRO 106 Ca -0.44 -0.58 0.06 0.00 0.11 0.00 0.00 66.00 65.15 1yj4 h PRO 106 Cb 1.20 0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.37 1yj4 h PRO 106 CO 0.94 1.19 -0.25 0.98 -0.21 0.00 0.00 178.00 180.65 1yj4 n TYR 107 N -4.03 -0.13 -0.34 0.65 4.19 -1.26 -0.72 117.16 115.52 1yj4 n TYR 107 Ca -0.08 0.61 0.03 0.00 3.31 0.00 0.00 57.90 61.78 1yj4 n TYR 107 Cb 0.70 -0.59 0.20 0.00 0.49 0.00 0.00 39.34 40.14 1yj4 n TYR 107 CO 0.00 0.00 0.00 -1.35 0.91 0.00 0.00 176.86 176.42 1yj4 h PRO 108 N 0.00 1.08 -0.01 2.98 0.11 -2.01 -2.44 132.00 131.71 1yj4 h PRO 108 Ca 0.11 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1yj4 h PRO 108 Cb 0.24 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.10 1yj4 h PRO 108 CO -0.47 0.72 -0.10 0.25 -0.21 0.00 0.00 178.00 178.18 1yj4 n THR 109 N -4.50 0.00 0.61 -1.15 -2.24 0.11 -3.67 114.28 103.44 1yj4 n THR 109 Ca 0.15 -0.11 0.09 0.00 -2.27 0.00 0.00 64.05 61.91 1yj4 n THR 109 Cb 0.19 0.08 0.10 0.00 -2.10 0.00 0.00 70.33 68.61 1yj4 n THR 109 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1yj4 n MET 110 N -0.67 1.75 -0.19 -0.78 2.81 -0.93 -3.80 117.12 115.31 1yj4 n MET 110 Ca 0.16 -1.72 0.03 0.00 -1.81 0.00 0.00 57.70 54.36 1yj4 n MET 110 Cb 0.29 -1.37 0.30 0.00 -0.71 0.00 0.00 33.22 31.73 1yj4 n MET 110 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1yj4 h VAL 111 N 3.59 1.11 -0.09 2.03 2.07 -1.61 -2.88 116.25 120.47 1yj4 h VAL 111 Ca 0.00 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 1yj4 h VAL 111 Cb 0.79 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1yj4 h VAL 111 CO 0.00 0.16 -0.28 0.59 0.02 0.00 0.00 177.57 178.07 1yj4 n ASN 112 N -4.45 2.14 0.04 0.57 3.02 -1.26 -4.86 115.26 110.46 1yj4 n ASN 112 Ca 0.09 -3.66 -0.15 0.00 -0.03 0.00 0.00 54.58 50.83 1yj4 n ASN 112 Cb 0.12 -0.53 -0.09 0.00 -0.61 0.00 0.00 39.78 38.67 1yj4 n ASN 112 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1yj4 h TYR 113 N 0.84 -1.48 -0.38 3.10 3.20 -1.76 -1.96 116.97 118.54 1yj4 h TYR 113 Ca 0.05 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1yj4 h TYR 113 Cb 1.17 0.65 -0.02 0.00 1.54 0.00 0.00 36.73 40.07 1yj4 h TYR 113 CO 0.65 -0.55 0.20 0.35 -1.64 0.00 0.00 178.16 177.17 1yj4 h PHE 114 N -0.63 0.53 -0.56 -3.82 3.57 -1.89 -0.30 116.94 113.85 1yj4 h PHE 114 Ca 0.03 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1yj4 h PHE 114 Cb 0.70 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.24 1yj4 h PHE 114 CO -0.51 0.43 0.23 -0.44 -2.23 0.00 0.00 178.31 175.79 1yj4 h ASP 115 N 0.48 0.73 -0.05 0.41 3.32 -1.92 0.21 116.42 119.60 1yj4 h ASP 115 Ca 0.13 -0.09 -0.20 0.00 0.02 0.00 0.00 57.03 56.89 1yj4 h ASP 115 Cb 0.08 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1yj4 h ASP 115 CO -0.02 0.65 -0.71 0.44 -1.72 0.00 0.00 179.24 177.89 1yj4 h ASP 116 N 0.80 0.80 0.55 6.45 3.32 -1.18 -1.36 116.42 125.79 1yj4 h ASP 116 Ca 0.19 -0.50 -0.03 0.00 0.02 0.00 0.00 57.03 56.71 1yj4 h ASP 116 Cb 0.15 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1yj4 h ASP 116 CO -0.02 1.28 -0.27 0.25 -1.72 0.00 0.00 179.24 178.76 1yj4 h LEU 117 N 0.49 -0.63 -1.46 1.55 5.85 -0.43 0.98 115.31 121.65 1yj4 h LEU 117 Ca -0.03 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1yj4 h LEU 117 Cb 1.31 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.47 1yj4 h LEU 117 CO 0.14 -0.45 0.41 -0.61 -0.34 0.00 0.00 178.44 177.59 1yj4 h GLN 118 N -0.74 0.67 0.00 1.25 5.75 -0.64 -2.06 115.11 119.34 1yj4 h GLN 118 Ca -0.07 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1yj4 h GLN 118 Cb 0.57 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.97 1yj4 h GLN 118 CO 0.12 0.44 -0.30 0.00 -2.65 0.00 0.00 178.83 176.44 1yj4 n ALA 119 N -2.46 2.95 -2.25 3.38 0.00 -0.52 -4.94 120.51 116.67 1yj4 n ALA 119 Ca 0.08 -0.23 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 1yj4 n ALA 119 Cb 0.16 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1yj4 n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yj4 n GLY 120 N 1.47 0.40 3.88 0.00 0.00 -0.07 -5.05 105.19 105.82 1yj4 n GLY 120 Ca 0.06 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 1yj4 n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yj4 s ARG 121 N -4.48 3.30 0.29 1.61 0.52 0.14 -5.04 118.95 115.29 1yj4 s ARG 121 Ca 0.03 -0.47 -0.30 0.00 -0.52 0.00 0.00 55.73 54.47 1yj4 s ARG 121 Cb -0.01 -2.97 -0.11 0.00 0.52 0.00 0.00 34.95 32.38 1yj4 s ARG 121 CO 0.03 0.62 1.52 -2.00 0.02 0.00 0.00 175.30 175.50 1yj4 s GLU 122 N -2.30 4.17 0.70 3.54 2.12 -1.26 -4.47 118.70 121.20 1yj4 s GLU 122 Ca 0.31 2.48 -0.16 0.00 0.36 0.00 0.00 54.97 57.96 1yj4 s GLU 122 Cb -0.13 -3.04 0.02 0.00 0.26 0.00 0.00 34.13 31.24 1yj4 s GLU 122 CO 0.24 -0.54 1.24 -0.65 -0.54 0.00 0.00 175.26 175.01 1yj4 s GLN 123 N -0.69 2.26 0.11 4.30 -1.52 -1.26 -4.94 119.66 117.91 1yj4 s GLN 123 Ca 0.60 1.88 -0.00 0.00 -1.95 0.00 0.00 55.36 55.89 1yj4 s GLN 123 Cb -0.46 -1.83 -0.20 0.00 -0.22 0.00 0.00 33.01 30.30 1yj4 s GLN 123 CO 0.48 -1.78 1.23 0.00 -0.25 0.00 0.00 175.29 174.98 1yj4 h ALA 124 N -0.00 0.25 -2.00 6.09 0.00 -1.92 -3.42 119.26 118.26 1yj4 h ALA 124 Ca -0.49 -0.85 -0.57 0.00 0.00 0.00 0.00 54.91 53.00 1yj4 h ALA 124 Cb 1.31 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1yj4 h ALA 124 CO 0.51 1.02 0.88 -1.58 0.00 0.00 0.00 179.25 180.08 1yj4 s HIS 125 N -2.81 3.02 0.37 0.00 5.04 -1.25 -4.91 115.29 114.76 1yj4 s HIS 125 Ca -0.03 1.12 0.14 0.00 -1.54 0.00 0.00 55.06 54.75 1yj4 s HIS 125 Cb 0.08 -3.66 0.97 0.00 0.04 0.00 0.00 32.58 30.01 1yj4 s HIS 125 CO 0.86 -1.10 1.80 -1.00 -2.34 0.00 0.00 174.74 172.96 1yj4 h PRO 126 N 8.32 0.52 -0.36 2.88 0.13 -1.89 -0.87 132.00 140.72 1yj4 h PRO 126 Ca -0.22 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1yj4 h PRO 126 Cb 1.08 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.07 1yj4 h PRO 126 CO 1.02 0.34 0.23 2.35 -0.23 0.00 0.00 178.00 181.71 1yj4 h TRP 127 N 0.53 0.47 -0.78 1.56 7.01 -1.91 -1.10 115.95 121.73 1yj4 h TRP 127 Ca 0.55 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.53 1yj4 h TRP 127 Cb 1.18 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 28.04 1yj4 h TRP 127 CO -0.00 0.31 0.38 -1.49 -2.79 0.00 0.00 178.44 174.85 1yj4 h TRP 128 N 0.48 1.12 -1.00 2.65 -0.00 -1.58 -0.65 115.95 116.99 1yj4 h TRP 128 Ca 0.13 -0.05 0.03 0.00 -0.00 0.00 0.00 58.89 59.00 1yj4 h TRP 128 Cb -0.03 -0.35 -0.05 0.00 -0.00 0.00 0.00 29.16 28.73 1yj4 h TRP 128 CO -0.05 0.82 0.66 0.00 -0.00 0.00 0.00 178.44 179.87 1yj4 h ALA 129 N 1.20 1.32 0.01 1.49 0.00 -0.64 -1.77 119.26 120.87 1yj4 h ALA 129 Ca 0.27 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1yj4 h ALA 129 Cb 0.11 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1yj4 h ALA 129 CO -0.04 0.60 -0.12 -0.07 0.00 0.00 0.00 179.25 179.63 1yj4 h LEU 130 N 1.30 0.08 -0.98 0.00 3.38 -0.78 -3.14 115.31 115.17 1yj4 h LEU 130 Ca 0.38 -0.89 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1yj4 h LEU 130 Cb -0.06 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 1yj4 h LEU 130 CO -0.11 0.96 0.64 0.58 0.09 0.00 0.00 178.44 180.60 1yj4 h VAL 131 N -0.78 1.25 0.00 1.22 2.07 -1.10 -1.29 116.25 117.61 1yj4 h VAL 131 Ca -0.02 -0.48 -0.13 0.00 0.82 0.00 0.00 66.70 66.90 1yj4 h VAL 131 Cb 0.99 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1yj4 h VAL 131 CO 0.02 0.25 -0.60 0.78 0.02 0.00 0.00 177.57 178.04 1yj4 h ASN 132 N 1.33 0.00 0.33 0.57 2.35 -1.47 0.24 115.58 118.92 1yj4 h ASN 132 Ca 0.36 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.93 1yj4 h ASN 132 Cb -0.14 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 1yj4 h ASN 132 CO -0.08 0.60 -0.72 -0.08 -1.65 0.00 0.00 177.43 175.51 1yj4 h GLU 133 N 0.00 0.34 0.00 0.81 4.81 -1.43 -3.26 114.58 115.85 1yj4 h GLU 133 Ca -0.01 -0.27 -0.17 0.00 -0.13 0.00 0.00 59.36 58.78 1yj4 h GLU 133 Cb 1.25 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.66 1yj4 h GLU 133 CO 0.08 0.92 -1.25 1.25 -0.73 0.00 0.00 179.01 179.28 1yj4 h HIS 134 N 0.23 0.00 -1.00 0.92 2.76 -1.10 -3.41 115.15 113.55 1yj4 h HIS 134 Ca -0.03 0.00 0.31 0.00 -2.20 0.00 0.00 60.37 58.45 1yj4 h HIS 134 Cb 1.28 0.00 -0.18 0.00 1.55 0.00 0.00 27.41 30.06 1yj4 h HIS 134 CO 0.04 0.61 0.15 0.34 -1.30 0.00 0.00 177.93 177.76 1yj4 n PHE 135 N -2.98 0.77 -0.05 5.26 -0.00 0.82 -0.85 117.46 120.43 1yj4 n PHE 135 Ca -0.08 1.20 0.19 0.00 -0.00 0.00 0.00 57.45 58.76 1yj4 n PHE 135 Cb 0.84 -1.33 0.64 0.00 -0.00 0.00 0.00 39.48 39.63 1yj4 n PHE 135 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 1yj4 h PRO 136 N 0.00 0.11 0.00 -7.13 0.11 -1.79 0.26 132.00 123.55 1yj4 h PRO 136 Ca 0.66 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.75 1yj4 h PRO 136 Cb 1.49 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.57 1yj4 h PRO 136 CO -0.90 0.07 -0.10 -0.91 -0.21 0.00 0.00 178.00 175.96 1yj4 h ASN 137 N 0.11 0.00 0.01 -2.05 4.21 -1.32 -0.52 115.58 116.02 1yj4 h ASN 137 Ca 0.29 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 57.52 1yj4 h ASN 137 Cb 0.98 0.00 -0.04 0.00 -1.12 0.00 0.00 38.32 38.14 1yj4 h ASN 137 CO -0.03 0.10 -1.48 0.52 -1.29 0.00 0.00 177.43 175.24 1yj4 n VAL 138 N -3.69 1.56 0.26 2.81 0.31 0.74 -4.37 118.33 115.94 1yj4 n VAL 138 Ca -0.02 -0.13 0.12 0.00 -0.01 0.00 0.00 64.34 64.31 1yj4 n VAL 138 Cb 0.21 -1.99 0.78 0.00 -0.91 0.00 0.00 33.84 31.92 1yj4 n VAL 138 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1yj4 h LEU 139 N -0.89 0.00 -2.30 7.52 3.38 -0.89 -2.42 115.31 119.71 1yj4 h LEU 139 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1yj4 h LEU 139 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1yj4 h LEU 139 CO -0.21 0.00 0.00 0.08 0.09 0.00 0.00 178.44 178.40 1yj4 h ARG 140 N 0.00 0.00 -0.01 1.13 0.11 -1.29 -0.82 114.38 113.50 1yj4 h ARG 140 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1yj4 h ARG 140 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 1yj4 h ARG 140 CO -0.00 0.00 -0.12 0.72 0.10 0.00 0.00 179.97 180.67 1yj4 n HIS 141 N -2.71 0.00 -4.23 4.08 8.25 -0.91 -4.94 115.22 114.76 1yj4 n HIS 141 Ca -0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.31 1yj4 n HIS 141 Cb 0.05 -0.10 -0.10 0.00 1.12 0.00 0.00 29.99 30.96 1yj4 n HIS 141 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1yj4 s PHE 142 N -2.32 1.15 1.10 4.41 0.40 -0.31 -0.96 117.98 121.45 1yj4 s PHE 142 Ca 0.32 -0.85 -0.18 0.00 -0.60 0.00 0.00 56.93 55.61 1yj4 s PHE 142 Cb 0.20 -0.62 0.25 0.00 0.51 0.00 0.00 43.02 43.36 1yj4 s PHE 142 CO 0.44 -0.04 1.22 0.20 0.70 0.00 0.00 175.22 177.75 1yj4 s GLY 143 N -3.14 1.69 0.21 4.36 0.00 -1.26 -4.78 107.32 104.40 1yj4 s GLY 143 Ca 0.17 -1.12 -0.09 0.00 0.00 0.00 0.00 44.72 43.67 1yj4 s GLY 143 CO -0.00 -0.27 1.81 -0.56 0.00 0.00 0.00 173.10 174.08 1yj4 h PRO 144 N -2.17 1.08 0.13 2.90 0.13 -1.99 -1.94 132.00 130.14 1yj4 h PRO 144 Ca -0.44 -0.14 -0.01 0.00 -0.87 0.00 0.00 66.00 64.54 1yj4 h PRO 144 Cb 1.26 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1yj4 h PRO 144 CO 0.34 0.83 -0.06 0.35 -0.23 0.00 0.00 178.00 179.22 1yj4 h PHE 145 N 1.07 -0.16 -0.86 1.56 3.57 -1.97 -1.05 116.94 119.10 1yj4 h PHE 145 Ca 0.27 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 1yj4 h PHE 145 Cb 0.08 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 1yj4 h PHE 145 CO 0.01 0.02 0.51 0.00 -2.23 0.00 0.00 178.31 176.62 1yj4 h SER 147 N 1.19 0.84 -0.62 0.00 0.02 -1.15 -2.00 113.55 111.83 1yj4 h SER 147 Ca 0.31 -0.10 0.04 0.00 -0.84 0.00 0.00 61.79 61.20 1yj4 h SER 147 Cb -0.04 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.24 1yj4 h SER 147 CO -0.06 0.70 0.36 0.25 -1.14 0.00 0.00 176.83 176.95 1yj4 h LEU 148 N 0.91 0.57 -1.02 5.07 5.85 -0.68 -1.78 115.31 124.23 1yj4 h LEU 148 Ca 0.23 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1yj4 h LEU 148 Cb 0.05 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1yj4 h LEU 148 CO -0.04 0.39 0.44 0.78 -0.34 0.00 0.00 178.44 179.67 1yj4 h ASN 149 N 0.70 1.01 -0.47 1.25 2.35 -0.89 -1.69 115.58 117.84 1yj4 h ASN 149 Ca 0.26 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.80 1yj4 h ASN 149 Cb 0.08 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 1yj4 h ASN 149 CO -0.13 0.81 -0.17 -0.07 -1.65 0.00 0.00 177.43 176.21 1yj4 h LEU 150 N 1.13 0.98 -0.27 1.61 4.07 -0.89 -2.28 115.31 119.66 1yj4 h LEU 150 Ca 0.29 -0.35 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 1yj4 h LEU 150 Cb 0.03 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.49 1yj4 h LEU 150 CO -0.05 1.13 0.03 0.40 -1.08 0.00 0.00 178.44 178.88 1yj4 h ILE 151 N 0.85 1.24 -0.02 1.22 2.04 -0.96 -1.97 117.51 119.92 1yj4 h ILE 151 Ca 0.12 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 1yj4 h ILE 151 Cb 0.73 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 38.06 1yj4 h ILE 151 CO 0.06 0.26 0.01 0.03 0.00 0.00 0.00 178.15 178.51 1yj4 h ARG 152 N 0.27 0.02 -0.98 2.37 3.08 -1.34 -2.13 114.38 115.67 1yj4 h ARG 152 Ca 0.08 -0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.23 1yj4 h ARG 152 Cb 0.36 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.33 1yj4 h ARG 152 CO 0.01 0.19 0.63 1.03 -1.07 0.00 0.00 179.97 180.76 1yj4 h SER 153 N -0.15 0.93 0.46 7.04 0.87 -1.40 0.26 113.55 121.56 1yj4 h SER 153 Ca 0.01 0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.44 1yj4 h SER 153 Cb 0.18 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1yj4 h SER 153 CO -0.00 0.53 -0.68 0.74 -0.53 0.00 0.00 176.83 176.89 1yj4 h THR 154 N 1.02 1.43 -0.19 2.23 2.02 -1.25 -0.26 112.91 117.91 1yj4 h THR 154 Ca 0.46 -2.18 -0.09 0.00 0.77 0.00 0.00 66.41 65.38 1yj4 h THR 154 Cb 0.40 2.15 -0.00 0.00 -1.74 0.00 0.00 68.15 68.95 1yj4 h THR 154 CO -0.22 0.64 -0.24 0.25 0.37 0.00 0.00 175.52 176.32 1yj4 h LEU 155 N 0.13 0.53 -0.41 2.58 5.85 -0.53 -1.79 115.31 121.67 1yj4 h LEU 155 Ca -0.02 -0.50 0.04 0.00 0.84 0.00 0.00 57.88 58.24 1yj4 h LEU 155 Cb 1.21 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 1yj4 h LEU 155 CO 0.10 0.93 0.19 0.44 -0.34 0.00 0.00 178.44 179.77 1yj4 h ASP 156 N 0.15 0.27 -0.79 1.25 3.32 -0.46 -1.84 116.42 118.32 1yj4 h ASP 156 Ca 0.02 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.16 1yj4 h ASP 156 Cb 0.80 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.28 1yj4 h ASP 156 CO 0.06 0.20 0.52 0.15 -1.72 0.00 0.00 179.24 178.44 1yj4 h PHE 157 N 0.40 0.89 -0.68 4.55 3.57 -0.73 0.34 116.94 125.28 1yj4 h PHE 157 Ca 0.18 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 1yj4 h PHE 157 Cb 0.10 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.52 1yj4 h PHE 157 CO -0.11 0.48 0.28 0.35 -2.23 0.00 0.00 178.31 177.08 1yj4 h PHE 158 N 0.89 1.02 -0.23 0.41 3.57 -0.50 -1.67 116.94 120.44 1yj4 h PHE 158 Ca 0.33 -0.07 -0.11 0.00 3.53 0.00 0.00 57.97 61.66 1yj4 h PHE 158 Cb 0.19 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1yj4 h PHE 158 CO -0.00 0.79 -0.32 1.49 -2.23 0.00 0.00 178.31 178.04 1yj4 h GLU 159 N 0.96 0.47 -0.43 1.11 4.81 -0.85 -2.63 114.58 118.02 1yj4 h GLU 159 Ca 0.23 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1yj4 h GLU 159 Cb 0.19 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1yj4 h GLU 159 CO -0.02 0.73 0.24 0.78 -0.73 0.00 0.00 179.01 180.01 1yj4 h GLY 160 N 1.06 0.64 1.59 1.92 0.00 -0.44 -0.88 103.07 106.96 1yj4 h GLY 160 Ca 0.05 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.04 1yj4 h GLY 160 CO 0.06 0.27 -0.07 0.00 0.00 0.00 0.00 176.54 176.80 1yj4 h TRP 162 N 0.47 -0.57 -0.62 0.00 2.91 -1.01 -2.29 115.95 114.84 1yj4 h TRP 162 Ca 0.09 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.08 1yj4 h TRP 162 Cb 0.42 0.19 -0.03 0.00 -0.51 0.00 0.00 29.16 29.22 1yj4 h TRP 162 CO 0.01 -0.35 0.32 0.82 -1.03 0.00 0.00 178.44 178.22 1yj4 h ILE 163 N -0.62 1.20 0.00 2.65 2.04 -0.91 -2.52 117.51 119.35 1yj4 h ILE 163 Ca -0.06 -0.52 -0.04 0.00 1.00 0.00 0.00 64.86 65.24 1yj4 h ILE 163 Cb 0.47 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1yj4 h ILE 163 CO 0.10 0.22 -0.18 -0.33 0.00 0.00 0.00 178.15 177.97 1yj4 h GLU 164 N 0.87 0.00 0.00 2.37 5.08 -0.66 -2.12 114.58 120.12 1yj4 h GLU 164 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1yj4 h GLU 164 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1yj4 h GLU 164 CO -0.03 0.18 0.00 1.96 -1.00 0.00 0.00 179.01 180.12 1yj4 h GLN 165 N 0.00 0.00 -0.01 2.33 4.20 -0.95 0.85 115.11 121.53 1yj4 h GLN 165 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1yj4 h GLN 165 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1yj4 h GLN 165 CO 0.02 0.00 -0.09 0.66 -0.67 0.00 0.00 178.83 178.75 1yj4 n TYR 166 N -2.47 0.00 -4.15 2.96 4.02 -0.80 -4.94 117.16 111.78 1yj4 n TYR 166 Ca -0.01 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.52 1yj4 n TYR 166 Cb 0.07 -0.06 -0.04 0.00 -0.02 0.00 0.00 39.34 39.28 1yj4 n TYR 166 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1yj4 n ASN 167 N -0.33 -1.18 -4.44 7.72 3.02 0.29 -4.89 115.26 115.46 1yj4 n ASN 167 Ca 0.17 -1.22 -0.35 0.00 -0.03 0.00 0.00 54.58 53.15 1yj4 n ASN 167 Cb 0.32 -1.49 -0.13 0.00 -0.61 0.00 0.00 39.78 37.88 1yj4 n ASN 167 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1yj4 s PHE 168 N -4.00 3.02 -2.45 3.10 5.36 -1.26 -4.96 117.98 116.78 1yj4 s PHE 168 Ca 0.21 -0.48 0.23 0.00 -0.96 0.00 0.00 56.93 55.92 1yj4 s PHE 168 Cb -0.12 -2.05 0.63 0.00 -0.34 0.00 0.00 43.02 41.14 1yj4 s PHE 168 CO 0.93 -0.23 1.50 0.41 -1.46 0.00 0.00 175.22 176.36 1yj4 n GLY 169 N 4.14 0.75 0.00 13.12 0.00 -1.26 -5.02 105.19 116.93 1yj4 n GLY 169 Ca -0.17 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1yj4 n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yj4 n GLY 170 N 1.27 1.07 3.77 -0.02 0.00 -1.26 -4.23 105.19 105.79 1yj4 n GLY 170 Ca 0.17 -1.62 -0.36 0.00 0.00 0.00 0.00 46.02 44.21 1yj4 n GLY 170 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yj4 s PHE 171 N -2.26 2.69 0.17 1.61 0.08 -1.26 -4.47 117.98 114.53 1yj4 s PHE 171 Ca 0.00 1.52 -0.31 0.00 0.12 0.00 0.00 56.93 58.26 1yj4 s PHE 171 Cb 0.00 -3.40 -0.09 0.00 -0.57 0.00 0.00 43.02 38.95 1yj4 s PHE 171 CO 0.00 -1.76 1.49 -2.14 -0.10 0.00 0.00 175.22 172.71 1yj4 s PRO 172 N -3.00 4.26 0.00 0.24 0.02 -1.26 -1.78 135.00 133.49 1yj4 s PRO 172 Ca 0.69 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.97 1yj4 s PRO 172 Cb -0.28 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.06 1yj4 s PRO 172 CO 0.33 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.90 1yj4 n GLY 173 N 3.34 2.44 2.78 0.52 0.00 0.46 -4.98 105.19 109.75 1yj4 n GLY 173 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1yj4 n GLY 173 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1yj4 n SER 174 N 0.00 4.16 0.19 1.61 2.88 -0.73 -4.78 113.62 116.94 1yj4 n SER 174 Ca 0.00 -2.90 0.18 0.00 -1.33 0.00 0.00 58.87 54.82 1yj4 n SER 174 Cb 0.00 -1.62 0.81 0.00 -0.75 0.00 0.00 64.21 62.65 1yj4 n SER 174 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 1yj4 h HIS 175 N 5.99 0.00 0.00 0.66 3.86 -1.86 -2.27 115.15 121.53 1yj4 h HIS 175 Ca 0.53 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.74 1yj4 h HIS 175 Cb 0.64 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.11 1yj4 h HIS 175 CO 1.41 0.00 -0.58 -0.25 0.86 0.00 0.00 177.93 179.37 1yj4 n ASP 176 N -3.54 0.60 0.15 2.45 8.00 -1.26 -4.45 116.55 118.50 1yj4 n ASP 176 Ca 0.03 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.39 1yj4 n ASP 176 Cb 0.45 0.19 -0.08 0.00 -0.02 0.00 0.00 41.12 41.66 1yj4 n ASP 176 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1yj4 h TYR 177 N 0.00 -0.30 -0.49 1.24 3.20 -1.82 -2.89 116.97 115.91 1yj4 h TYR 177 Ca 0.00 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.92 1yj4 h TYR 177 Cb 0.66 0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.94 1yj4 h TYR 177 CO 0.00 -0.13 -0.50 -1.35 -1.64 0.00 0.00 178.16 174.54 1yj4 h PRO 178 N -0.40 -0.26 0.00 1.82 0.11 -1.78 -1.04 132.00 130.46 1yj4 h PRO 178 Ca -0.03 0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 1yj4 h PRO 178 Cb 0.30 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 1yj4 h PRO 178 CO 0.05 -0.17 -0.25 1.96 -0.21 0.00 0.00 178.00 179.38 1yj4 h GLN 179 N -0.27 0.00 -0.45 1.05 4.20 -1.86 -1.90 115.11 115.87 1yj4 h GLN 179 Ca 0.08 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1yj4 h GLN 179 Cb 0.49 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1yj4 h GLN 179 CO -0.60 0.25 0.08 0.35 -0.67 0.00 0.00 178.83 178.24 1yj4 h PHE 180 N 0.00 0.80 -0.21 2.96 3.57 -1.08 -0.85 116.94 122.13 1yj4 h PHE 180 Ca -0.00 -0.11 -0.13 0.00 3.53 0.00 0.00 57.97 61.26 1yj4 h PHE 180 Cb 0.56 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1yj4 h PHE 180 CO 0.00 0.75 -0.38 1.25 -2.23 0.00 0.00 178.31 177.70 1yj4 h LEU 181 N 0.61 0.69 0.06 0.59 5.85 -0.97 -1.44 115.31 120.71 1yj4 h LEU 181 Ca 0.14 -0.54 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 1yj4 h LEU 181 Cb 0.38 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1yj4 h LEU 181 CO 0.01 1.10 -0.03 -0.09 -0.34 0.00 0.00 178.44 179.09 1yj4 h ARG 182 N 0.31 -0.08 -0.68 1.25 9.65 -1.30 -1.69 114.38 121.83 1yj4 h ARG 182 Ca 0.01 0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.94 1yj4 h ARG 182 Cb 0.98 0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.53 1yj4 h ARG 182 CO 0.09 0.01 0.40 -0.09 2.80 0.00 0.00 179.97 183.18 1yj4 h ARG 183 N -0.15 0.74 -0.67 0.20 2.43 -1.20 0.24 114.38 115.97 1yj4 h ARG 183 Ca -0.01 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.21 1yj4 h ARG 183 Cb 0.13 -0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 29.44 1yj4 h ARG 183 CO 0.01 0.49 0.31 1.98 -1.51 0.00 0.00 179.97 181.26 1yj4 h MET 184 N 0.77 0.52 -0.26 0.20 4.05 -0.72 -2.95 114.93 116.54 1yj4 h MET 184 Ca 0.29 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.57 1yj4 h MET 184 Cb 0.11 -0.12 -0.07 0.00 -0.80 0.00 0.00 31.60 30.72 1yj4 h MET 184 CO -0.14 0.35 -0.12 0.27 0.23 0.00 0.00 176.91 177.49 1yj4 n ASN 185 N -4.90 2.59 -0.29 1.39 0.23 -0.69 -2.50 115.26 111.09 1yj4 n ASN 185 Ca 0.10 -3.62 0.12 0.00 -0.53 0.00 0.00 54.58 50.65 1yj4 n ASN 185 Cb 0.26 -0.59 0.13 0.00 -2.08 0.00 0.00 39.78 37.51 1yj4 n ASN 185 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1yj4 n GLY 186 N -1.05 -0.46 2.42 4.83 0.00 0.05 -4.95 105.19 106.02 1yj4 n GLY 186 Ca 0.28 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.65 1yj4 n GLY 186 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yj4 n LEU 187 N -0.60 -1.14 -0.03 0.99 4.77 -1.26 -4.85 117.00 114.88 1yj4 n LEU 187 Ca 0.09 0.20 -0.08 0.00 -0.03 0.00 0.00 56.01 56.19 1yj4 n LEU 187 Cb 0.39 -2.14 -0.03 0.00 -2.33 0.00 0.00 43.42 39.32 1yj4 n LEU 187 CO 0.30 -0.15 0.82 1.23 -1.33 0.00 0.00 177.39 178.27 1yj4 h GLY 188 N 0.00 0.12 2.00 -0.72 0.00 -1.86 -0.25 103.07 102.36 1yj4 h GLY 188 Ca -0.29 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1yj4 h GLY 188 CO 0.35 -0.09 0.00 1.42 0.00 0.00 0.00 176.54 178.22 1yj4 n HIS 189 N -5.21 0.80 -0.03 5.60 8.25 -1.26 -1.35 115.22 122.02 1yj4 n HIS 189 Ca -0.02 0.27 -0.16 0.00 -0.26 0.00 0.00 57.72 57.54 1yj4 n HIS 189 Cb 0.14 -0.94 -0.14 0.00 1.12 0.00 0.00 29.99 30.17 1yj4 n HIS 189 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yj4 h VAL 191 N -0.77 1.09 -0.26 0.00 2.07 -0.99 -1.61 116.25 115.78 1yj4 h VAL 191 Ca -0.06 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.03 1yj4 h VAL 191 Cb 1.24 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1yj4 h VAL 191 CO 0.05 0.11 0.17 1.23 0.02 0.00 0.00 177.57 179.16 1yj4 h GLY 192 N -0.26 0.29 1.08 2.17 0.00 -1.35 -2.62 103.07 102.37 1yj4 h GLY 192 Ca -0.01 -0.10 -0.17 0.00 0.00 0.00 0.00 47.33 47.05 1yj4 h GLY 192 CO 0.01 0.09 -1.35 0.00 0.00 0.00 0.00 176.54 175.30 1yj4 h ALA 193 N 1.85 0.66 0.00 3.60 0.00 -1.47 -3.32 119.26 120.58 1yj4 h ALA 193 Ca 0.10 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1yj4 h ALA 193 Cb 0.09 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1yj4 h ALA 193 CO -0.02 0.92 0.00 -1.13 0.00 0.00 0.00 179.25 179.02 1yj4 n SER 194 N -2.92 0.00 -0.21 0.00 3.41 -0.61 -2.70 113.62 110.59 1yj4 n SER 194 Ca -0.09 -1.16 0.13 0.00 -0.26 0.00 0.00 58.87 57.49 1yj4 n SER 194 Cb 0.84 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 65.25 1yj4 n SER 194 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1yj4 n LEU 195 N -0.83 0.85 -3.22 1.04 4.77 -1.19 -4.53 117.00 113.88 1yj4 n LEU 195 Ca 0.14 -0.17 -0.26 0.00 -0.03 0.00 0.00 56.01 55.68 1yj4 n LEU 195 Cb 0.06 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 40.95 1yj4 n LEU 195 CO 0.10 0.16 0.06 0.79 -1.33 0.00 0.00 177.39 177.18 1yj4 n TRP 196 N -0.74 3.37 -1.68 -1.77 7.02 -1.10 -5.01 117.44 117.53 1yj4 n TRP 196 Ca 0.13 -4.04 -0.44 0.00 -1.02 0.00 0.00 57.50 52.13 1yj4 n TRP 196 Cb 0.32 -0.51 -0.02 0.00 -2.42 0.00 0.00 31.31 28.68 1yj4 n TRP 196 CO 0.00 0.00 0.00 -2.30 -2.02 0.00 0.00 177.69 173.37 1yj4 n PRO 197 N 0.46 2.10 0.29 -0.99 -0.02 -1.26 -4.69 135.00 130.88 1yj4 n PRO 197 Ca 0.30 0.74 0.15 0.00 -2.02 0.00 0.00 63.50 62.67 1yj4 n PRO 197 Cb 0.42 -2.38 0.85 0.00 -0.02 0.00 0.00 33.50 32.38 1yj4 n PRO 197 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1yj4 h LYS 198 N 3.66 0.00 0.00 -0.52 2.10 -1.21 -0.12 116.57 120.47 1yj4 h LYS 198 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1yj4 h LYS 198 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1yj4 h LYS 198 CO 0.71 0.06 0.00 -0.85 -2.00 0.00 0.00 179.45 177.37 1yj4 n GLU 199 N -3.62 0.21 -0.05 0.07 0.28 -1.26 -3.51 120.64 112.75 1yj4 n GLU 199 Ca -0.02 0.39 -0.06 0.00 -0.16 0.00 0.00 57.16 57.31 1yj4 n GLU 199 Cb 0.17 -1.86 -0.06 0.00 1.43 0.00 0.00 31.44 31.11 1yj4 n GLU 199 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1yj4 n GLN 200 N -2.25 1.55 -4.64 3.44 3.00 -0.66 -5.04 117.38 112.78 1yj4 n GLN 200 Ca 0.03 0.03 -0.24 0.00 -0.01 0.00 0.00 57.00 56.80 1yj4 n GLN 200 Cb 0.26 -1.22 -0.14 0.00 0.00 0.00 0.00 30.24 29.13 1yj4 n GLN 200 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1yj4 s PHE 201 N -2.21 1.59 -0.45 1.08 0.40 -0.15 -5.04 117.98 113.20 1yj4 s PHE 201 Ca -0.09 -0.34 -0.20 0.00 -0.60 0.00 0.00 56.93 55.70 1yj4 s PHE 201 Cb 0.03 -0.97 0.03 0.00 0.51 0.00 0.00 43.02 42.62 1yj4 s PHE 201 CO 0.31 0.04 0.60 1.21 0.70 0.00 0.00 175.22 178.07 1yj4 s ASN 202 N -0.90 6.28 0.53 1.36 3.84 -1.26 -4.16 114.94 120.63 1yj4 s ASN 202 Ca 0.06 -0.52 0.29 0.00 0.21 0.00 0.00 52.86 52.90 1yj4 s ASN 202 Cb -0.08 -2.29 1.45 0.00 -0.55 0.00 0.00 41.25 39.77 1yj4 s ASN 202 CO 0.01 -0.77 1.93 -0.08 -2.79 0.00 0.00 177.10 175.40 1yj4 h GLU 203 N 8.88 0.00 0.11 0.43 4.81 -1.91 -0.56 114.58 126.33 1yj4 h GLU 203 Ca -0.26 -0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.67 1yj4 h GLU 203 Cb 1.10 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 1yj4 h GLU 203 CO 0.89 0.00 -1.55 0.00 -0.73 0.00 0.00 179.01 177.62 1yj4 h ARG 204 N 0.01 0.23 -0.20 1.92 3.08 -1.98 -2.63 114.38 114.81 1yj4 h ARG 204 Ca 0.36 -0.39 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1yj4 h ARG 204 Cb 1.43 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.61 1yj4 h ARG 204 CO -0.01 1.19 -0.06 0.77 -1.07 0.00 0.00 179.97 180.79 1yj4 h SER 205 N -0.28 0.28 -0.25 7.04 0.02 -1.85 -2.91 113.55 115.61 1yj4 h SER 205 Ca -0.34 -0.05 -0.14 0.00 -0.84 0.00 0.00 61.79 60.42 1yj4 h SER 205 Cb 1.79 -0.07 -0.08 0.00 0.14 0.00 0.00 62.40 64.17 1yj4 h SER 205 CO 0.04 0.39 -0.25 0.18 -1.14 0.00 0.00 176.83 176.05 1yj4 n LEU 206 N -4.31 3.71 -0.10 5.07 4.77 -0.27 -4.80 117.00 121.07 1yj4 n LEU 206 Ca -0.00 -3.88 -0.06 0.00 -0.03 0.00 0.00 56.01 52.04 1yj4 n LEU 206 Cb 0.24 -0.59 0.01 0.00 -2.33 0.00 0.00 43.42 40.74 1yj4 n LEU 206 CO 0.38 1.36 0.82 0.15 -1.33 0.00 0.00 177.39 178.77 1yj4 h PHE 207 N 1.05 -0.11 -0.64 -1.77 3.57 -1.26 0.19 116.94 117.97 1yj4 h PHE 207 Ca 0.16 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 1yj4 h PHE 207 Cb 1.42 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 40.24 1yj4 h PHE 207 CO 0.95 -0.11 0.19 -0.07 -2.23 0.00 0.00 178.31 177.03 1yj4 h LEU 208 N 0.04 0.94 -0.09 0.59 3.38 -1.87 -0.58 115.31 117.73 1yj4 h LEU 208 Ca 0.17 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1yj4 h LEU 208 Cb 0.24 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1yj4 h LEU 208 CO -0.32 0.91 0.02 -0.33 0.09 0.00 0.00 178.44 178.81 1yj4 h GLU 209 N 0.93 0.15 -0.34 1.13 3.07 -1.76 -1.81 114.58 115.95 1yj4 h GLU 209 Ca 0.21 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 59.02 1yj4 h GLU 209 Cb 0.31 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 1yj4 h GLU 209 CO -0.00 0.35 0.18 0.82 -1.40 0.00 0.00 179.01 178.95 1yj4 h ILE 210 N -0.07 1.15 -0.81 3.13 2.04 -0.54 -0.76 117.51 121.65 1yj4 h ILE 210 Ca 0.03 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1yj4 h ILE 210 Cb 0.27 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 1yj4 h ILE 210 CO 0.00 0.15 0.51 0.74 0.00 0.00 0.00 178.15 179.55 1yj4 h THR 211 N 0.42 1.22 -0.38 -0.27 2.02 -1.10 -0.17 112.91 114.65 1yj4 h THR 211 Ca 0.12 -0.44 -0.13 0.00 0.77 0.00 0.00 66.41 66.73 1yj4 h THR 211 Cb 0.08 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 1yj4 h THR 211 CO -0.02 0.22 -0.28 0.28 0.37 0.00 0.00 175.52 176.09 1yj4 h SER 212 N 1.11 0.83 0.12 4.18 0.02 -1.02 -2.00 113.55 116.79 1yj4 h SER 212 Ca 0.29 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1yj4 h SER 212 Cb -0.08 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.23 1yj4 h SER 212 CO -0.06 1.06 -0.06 0.00 -1.14 0.00 0.00 176.83 176.63 1yj4 h ALA 213 N 0.99 -0.17 -0.23 3.77 0.00 -0.27 -0.97 119.26 122.39 1yj4 h ALA 213 Ca 0.08 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1yj4 h ALA 213 Cb 0.82 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1yj4 h ALA 213 CO 0.07 -0.56 -0.10 0.82 0.00 0.00 0.00 179.25 179.47 1yj4 h ILE 214 N -0.23 0.66 -0.18 0.00 2.04 -0.98 0.89 117.51 119.72 1yj4 h ILE 214 Ca -0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.88 1yj4 h ILE 214 Cb 0.18 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 1yj4 h ILE 214 CO 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 178.15 178.13 1yj4 h ALA 215 N 1.13 0.12 0.10 1.87 0.00 -1.19 -1.92 119.26 119.37 1yj4 h ALA 215 Ca 0.12 0.07 -0.27 0.00 0.00 0.00 0.00 54.91 54.83 1yj4 h ALA 215 Cb 0.25 0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1yj4 h ALA 215 CO -0.28 -0.48 -1.19 1.96 0.00 0.00 0.00 179.25 179.26 1yj4 h GLN 216 N -0.00 0.44 0.00 0.00 4.20 -0.89 -3.31 115.11 115.54 1yj4 h GLN 216 Ca 0.09 -0.61 -0.04 0.00 0.06 0.00 0.00 58.65 58.15 1yj4 h GLN 216 Cb 0.14 0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1yj4 h GLN 216 CO -0.19 1.26 -0.19 1.98 -0.67 0.00 0.00 178.83 181.01 1yj4 h MET 217 N 0.18 0.00 -0.38 1.46 4.05 0.84 -2.87 114.93 118.21 1yj4 h MET 217 Ca -0.15 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 1yj4 h MET 217 Cb 1.87 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 32.65 1yj4 h MET 217 CO 0.21 0.19 0.24 1.49 0.23 0.00 0.00 176.91 179.28 1yj4 h GLU 218 N 0.00 0.51 0.07 0.39 4.81 -1.43 -1.32 114.58 117.61 1yj4 h GLU 218 Ca -0.00 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 58.94 1yj4 h GLU 218 Cb 0.70 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1yj4 h GLU 218 CO 0.03 0.36 -1.11 -0.91 -0.73 0.00 0.00 179.01 176.65 1yj4 h ASN 219 N 0.51 0.40 -0.02 1.04 2.35 -1.71 -2.94 115.58 115.22 1yj4 h ASN 219 Ca 0.14 -0.39 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1yj4 h ASN 219 Cb -0.03 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 1yj4 h ASN 219 CO -0.03 1.26 0.01 -0.25 -1.65 0.00 0.00 177.43 176.77 1yj4 h TRP 220 N 0.11 0.03 0.33 1.19 7.01 -1.43 -1.44 115.95 121.76 1yj4 h TRP 220 Ca -0.10 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.88 1yj4 h TRP 220 Cb 1.80 -0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 28.85 1yj4 h TRP 220 CO 0.05 0.22 -0.19 1.98 -2.79 0.00 0.00 178.44 177.71 1yj4 h MET 221 N -0.16 -0.48 -0.75 2.65 4.05 -1.34 -0.17 114.93 118.73 1yj4 h MET 221 Ca 0.01 0.03 -0.02 0.00 -0.28 0.00 0.00 59.70 59.44 1yj4 h MET 221 Cb 0.20 0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.08 1yj4 h MET 221 CO -0.00 -0.32 0.38 -0.39 0.23 0.00 0.00 176.91 176.81 1yj4 h VAL 222 N -0.50 1.24 -0.44 -5.77 -1.51 -1.53 -1.95 116.25 105.78 1yj4 h VAL 222 Ca -0.04 -0.63 -0.11 0.00 -1.23 0.00 0.00 66.70 64.70 1yj4 h VAL 222 Cb 0.41 0.27 -0.02 0.00 -2.13 0.00 0.00 31.29 29.82 1yj4 h VAL 222 CO 0.04 0.27 -0.16 -0.50 -1.23 0.00 0.00 177.57 176.00 1yj4 h TRP 223 N 1.05 0.94 -0.39 5.19 6.55 -1.14 -1.14 115.95 127.01 1yj4 h TRP 223 Ca 0.26 -0.19 -0.11 0.00 0.95 0.00 0.00 58.89 59.80 1yj4 h TRP 223 Cb 0.08 -0.23 -0.01 0.00 -0.86 0.00 0.00 29.16 28.14 1yj4 h TRP 223 CO 0.01 0.93 -0.20 0.28 -1.05 0.00 0.00 178.44 178.41 1yj4 h VAL 224 N 0.75 1.27 -0.34 1.49 2.07 -0.84 -1.69 116.25 118.95 1yj4 h VAL 224 Ca 0.11 -1.30 -0.09 0.00 0.82 0.00 0.00 66.70 66.24 1yj4 h VAL 224 Cb 0.67 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1yj4 h VAL 224 CO 0.05 0.43 -0.18 -1.13 0.02 0.00 0.00 177.57 176.76 1yj4 h ASN 225 N 0.66 0.62 -0.34 0.57 -0.73 -1.08 -2.03 115.58 113.25 1yj4 h ASN 225 Ca 0.10 -0.20 -0.10 0.00 1.87 0.00 0.00 56.30 57.97 1yj4 h ASN 225 Cb 0.70 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 39.11 1yj4 h ASN 225 CO 0.05 0.81 -0.18 0.44 -0.37 0.00 0.00 177.43 178.19 1yj4 h ASP 226 N 0.56 0.74 -0.24 1.15 3.32 -0.88 -1.37 116.42 119.70 1yj4 h ASP 226 Ca 0.09 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 56.72 1yj4 h ASP 226 Cb 0.62 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1yj4 h ASP 226 CO 0.04 0.99 0.11 0.25 -1.72 0.00 0.00 179.24 178.91 1yj4 h LEU 227 N 0.48 0.32 -1.52 1.55 5.85 -1.20 -2.20 115.31 118.61 1yj4 h LEU 227 Ca 0.07 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1yj4 h LEU 227 Cb 0.72 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1yj4 h LEU 227 CO 0.05 0.38 -0.23 0.24 -0.34 0.00 0.00 178.44 178.54 1yj4 h MET 228 N 0.25 0.00 -0.02 1.25 2.86 -1.36 -2.50 114.93 115.42 1yj4 h MET 228 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1yj4 h MET 228 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1yj4 h MET 228 CO -0.01 0.23 0.00 0.43 1.06 0.00 0.00 176.91 178.62 1yj4 n SER 229 N -3.73 1.56 0.30 1.22 7.64 -0.52 -4.10 113.62 115.99 1yj4 n SER 229 Ca -0.01 -1.52 0.17 0.00 1.01 0.00 0.00 58.87 58.52 1yj4 n SER 229 Cb 0.34 -0.00 0.93 0.00 -1.01 0.00 0.00 64.21 64.47 1yj4 n SER 229 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1yj4 h PHE 230 N 2.45 0.00 0.00 1.43 3.57 -0.92 -2.67 116.94 120.80 1yj4 h PHE 230 Ca 0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1yj4 h PHE 230 Cb 0.52 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 1yj4 h PHE 230 CO 0.00 0.04 -0.06 -0.92 -2.23 0.00 0.00 178.31 175.14 1yj4 h TYR 231 N 0.00 0.00 0.00 0.41 3.20 -1.79 -1.01 116.97 117.78 1yj4 h TYR 231 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1yj4 h TYR 231 Cb 0.18 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1yj4 h TYR 231 CO 0.00 0.06 0.00 0.36 -1.64 0.00 0.00 178.16 176.94 1yj4 n LYS 232 N -4.75 0.07 -0.05 1.82 2.85 -1.20 -2.30 118.16 114.60 1yj4 n LYS 232 Ca -0.01 0.06 -0.11 0.00 -1.05 0.00 0.00 58.31 57.19 1yj4 n LYS 232 Cb 0.06 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 32.90 1yj4 n LYS 232 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1yj4 n GLU 233 N -1.06 0.22 0.32 -1.58 1.02 -1.01 -4.39 120.64 114.16 1yj4 n GLU 233 Ca 0.02 0.10 0.21 0.00 -0.02 0.00 0.00 57.16 57.46 1yj4 n GLU 233 Cb 0.01 -0.87 1.04 0.00 -0.02 0.00 0.00 31.44 31.60 1yj4 n GLU 233 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1yj4 h PHE 234 N -0.38 0.00 0.00 -0.32 3.57 -1.06 -3.01 116.94 115.74 1yj4 h PHE 234 Ca -0.27 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.23 1yj4 h PHE 234 Cb 1.23 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.97 1yj4 h PHE 234 CO -0.03 0.01 0.00 -3.47 -2.23 0.00 0.00 178.31 172.58 1yj4 n ASP 235 N -3.13 0.00 -4.05 0.41 -0.08 -0.97 -4.65 116.55 104.07 1yj4 n ASP 235 Ca -0.02 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.83 1yj4 n ASP 235 Cb 0.15 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.61 1yj4 n ASP 235 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1yj4 n ASP 236 N 0.00 5.29 -3.46 1.67 8.00 -1.26 -4.97 116.55 121.82 1yj4 n ASP 236 Ca 0.00 -3.11 0.00 0.00 0.71 0.00 0.00 54.79 52.39 1yj4 n ASP 236 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 39.63 1yj4 n ASP 236 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1yj4 n GLU 237 N 3.98 2.24 0.00 -1.24 0.28 -1.14 -4.82 120.64 119.94 1yj4 n GLU 237 Ca 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.37 1yj4 n GLU 237 Cb 0.38 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.25 1yj4 n GLU 237 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1yj4 n ARG 238 N 0.00 0.00 -1.45 3.44 1.74 -1.26 -4.90 116.66 114.22 1yj4 n ARG 238 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 1yj4 n ARG 238 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.40 1yj4 n ARG 238 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1yj4 n ASP 239 N 0.00 -2.93 -4.75 0.55 8.00 -1.26 -4.88 116.55 111.28 1yj4 n ASP 239 Ca 0.00 0.26 -0.31 0.00 0.71 0.00 0.00 54.79 55.46 1yj4 n ASP 239 Cb 0.00 -2.78 0.11 0.00 -0.02 0.00 0.00 41.12 38.42 1yj4 n ASP 239 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1yj4 s GLN 240 N -3.17 1.97 0.15 -1.24 -1.52 -1.26 -5.01 119.66 109.59 1yj4 s GLN 240 Ca 0.00 1.09 0.10 0.00 -1.95 0.00 0.00 55.36 54.60 1yj4 s GLN 240 Cb 0.00 -1.87 -0.04 0.00 -0.22 0.00 0.00 33.01 30.88 1yj4 s GLN 240 CO 0.00 -1.82 -0.17 0.96 -0.25 0.00 0.00 175.29 174.01 1yj4 s ILE 241 N -2.90 2.84 0.14 1.08 -4.36 -1.26 -5.01 121.20 111.72 1yj4 s ILE 241 Ca 0.62 -1.68 -0.25 0.00 -0.26 0.00 0.00 60.65 59.09 1yj4 s ILE 241 Cb -0.17 -2.35 0.07 0.00 1.25 0.00 0.00 42.46 41.26 1yj4 s ILE 241 CO 0.56 -0.02 0.76 -0.94 0.24 0.00 0.00 174.94 175.55 1yj4 s SER 242 N -2.48 -0.39 0.20 4.36 1.04 -1.26 -4.97 113.70 110.19 1yj4 s SER 242 Ca 0.21 -0.19 -0.14 0.00 0.48 0.00 0.00 55.95 56.31 1yj4 s SER 242 Cb -0.09 0.55 0.20 0.00 0.10 0.00 0.00 66.02 66.77 1yj4 s SER 242 CO 0.12 -0.94 1.65 0.25 0.98 0.00 0.00 173.24 175.30 1yj4 h LEU 243 N 2.00 -0.46 -0.22 2.42 5.85 -1.98 0.48 115.31 123.40 1yj4 h LEU 243 Ca -0.26 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1yj4 h LEU 243 Cb 1.27 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 42.61 1yj4 h LEU 243 CO 0.31 -0.17 -0.00 0.58 -0.34 0.00 0.00 178.44 178.82 1yj4 h VAL 244 N 0.02 1.26 0.00 1.05 2.07 -1.96 -1.16 116.25 117.53 1yj4 h VAL 244 Ca 0.27 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1yj4 h VAL 244 Cb 0.41 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1yj4 h VAL 244 CO -0.55 0.28 0.00 0.11 0.02 0.00 0.00 177.57 177.43 1yj4 h LYS 245 N 0.15 0.00 0.03 1.57 1.57 -1.69 -2.39 116.57 115.82 1yj4 h LYS 245 Ca 0.06 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.54 1yj4 h LYS 245 Cb 0.41 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 1yj4 h LYS 245 CO 0.01 0.00 -1.74 -0.91 -0.57 0.00 0.00 179.45 176.24 1yj4 h ASN 246 N 0.00 0.11 -0.70 0.86 2.35 0.28 -3.17 115.58 115.32 1yj4 h ASN 246 Ca 0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1yj4 h ASN 246 Cb 0.28 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 1yj4 h ASN 246 CO 0.00 1.22 0.44 1.88 -1.65 0.00 0.00 177.43 179.32 1yj4 h TYR 247 N 0.02 0.91 0.50 1.19 0.05 -0.71 0.13 116.97 119.07 1yj4 h TYR 247 Ca -0.31 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.46 1yj4 h TYR 247 Cb 2.01 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 39.45 1yj4 h TYR 247 CO 0.02 0.60 -0.29 0.28 -1.05 0.00 0.00 178.16 177.71 1yj4 h VAL 248 N 0.96 0.40 -0.41 -2.88 2.07 -1.62 0.36 116.25 115.13 1yj4 h VAL 248 Ca 0.25 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.75 1yj4 h VAL 248 Cb -0.07 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1yj4 h VAL 248 CO -0.05 0.00 0.14 0.58 0.02 0.00 0.00 177.57 178.26 1yj4 h VAL 249 N -0.75 1.21 0.20 2.57 2.07 -1.48 -0.16 116.25 119.90 1yj4 h VAL 249 Ca -0.06 -0.68 -0.33 0.00 0.82 0.00 0.00 66.70 66.46 1yj4 h VAL 249 Cb 0.61 0.88 0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1yj4 h VAL 249 CO 0.07 0.24 -1.53 0.28 0.02 0.00 0.00 177.57 176.66 1yj4 h SER 250 N 0.52 0.65 -0.18 0.57 0.02 -0.75 -3.34 113.55 111.05 1yj4 h SER 250 Ca 0.13 -0.79 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 1yj4 h SER 250 Cb 0.23 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1yj4 h SER 250 CO -0.01 1.63 0.00 0.47 -1.14 0.00 0.00 176.83 177.79 1yj4 n ASP 251 N -3.61 2.68 -3.72 3.07 8.00 0.13 -0.40 116.55 122.70 1yj4 n ASP 251 Ca -0.18 -1.87 -0.30 0.00 0.71 0.00 0.00 54.79 53.16 1yj4 n ASP 251 Cb 1.08 -0.11 0.03 0.00 -0.02 0.00 0.00 41.12 42.10 1yj4 n ASP 251 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1yj4 n GLU 252 N 1.03 -1.09 -4.44 -1.24 1.02 -0.10 -4.95 120.64 110.86 1yj4 n GLU 252 Ca 0.17 0.55 -0.22 0.00 -0.02 0.00 0.00 57.16 57.63 1yj4 n GLU 252 Cb 0.51 -3.61 -0.09 0.00 -0.02 0.00 0.00 31.44 28.23 1yj4 n GLU 252 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1yj4 s ILE 253 N -3.33 0.75 0.46 -3.67 -4.36 -1.01 -5.05 121.20 104.99 1yj4 s ILE 253 Ca 0.34 -2.00 -0.14 0.00 -0.26 0.00 0.00 60.65 58.59 1yj4 s ILE 253 Cb -0.14 -2.55 -0.07 0.00 1.25 0.00 0.00 42.46 40.94 1yj4 s ILE 253 CO 0.88 0.00 0.89 -0.94 0.24 0.00 0.00 174.94 176.01 1yj4 s SER 254 N -3.50 6.58 0.50 4.36 1.04 -1.26 -4.55 113.70 116.87 1yj4 s SER 254 Ca 0.31 1.37 0.26 0.00 0.48 0.00 0.00 55.95 58.38 1yj4 s SER 254 Cb 0.06 -2.43 1.34 0.00 0.10 0.00 0.00 66.02 65.09 1yj4 s SER 254 CO 0.15 -0.50 1.89 0.25 0.98 0.00 0.00 173.24 176.00 1yj4 h LEU 255 N 1.08 0.14 -0.02 2.42 5.85 -1.97 0.30 115.31 123.10 1yj4 h LEU 255 Ca -0.47 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.22 1yj4 h LEU 255 Cb 1.19 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1yj4 h LEU 255 CO 0.63 0.05 -0.18 -0.74 -0.34 0.00 0.00 178.44 177.86 1yj4 h HIS 256 N 0.14 0.22 -0.80 1.25 2.76 -1.98 -1.76 115.15 114.98 1yj4 h HIS 256 Ca 0.43 -0.11 0.10 0.00 -2.20 0.00 0.00 60.37 58.59 1yj4 h HIS 256 Cb 1.48 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 30.33 1yj4 h HIS 256 CO -0.00 0.84 0.45 0.93 -1.30 0.00 0.00 177.93 178.84 1yj4 h GLU 257 N -0.45 0.72 0.91 5.26 5.08 -1.42 -0.08 114.58 124.60 1yj4 h GLU 257 Ca -0.02 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1yj4 h GLU 257 Cb 0.87 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.97 1yj4 h GLU 257 CO 0.04 0.48 -0.44 0.00 -1.00 0.00 0.00 179.01 178.09 1yj4 h ALA 258 N 1.45 -1.28 -0.12 3.43 0.00 -1.03 -0.86 119.26 120.85 1yj4 h ALA 258 Ca 0.39 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1yj4 h ALA 258 Cb 0.37 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1yj4 h ALA 258 CO -0.25 -1.19 0.24 1.25 0.00 0.00 0.00 179.25 179.30 1yj4 h LEU 259 N -1.27 0.00 0.03 0.00 5.85 -1.07 0.11 115.31 118.96 1yj4 h LEU 259 Ca -0.13 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.42 1yj4 h LEU 259 Cb 0.94 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.98 1yj4 h LEU 259 CO 0.21 0.00 -0.69 -0.08 -0.34 0.00 0.00 178.44 177.54 1yj4 h GLU 260 N 0.00 0.41 -0.62 1.25 4.57 -0.62 -2.48 114.58 117.09 1yj4 h GLU 260 Ca 0.06 -0.49 0.04 0.00 -1.18 0.00 0.00 59.36 57.80 1yj4 h GLU 260 Cb 0.54 0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 29.24 1yj4 h GLU 260 CO -0.00 1.15 0.36 -0.22 -1.18 0.00 0.00 179.01 179.12 1yj4 h LYS 261 N -0.12 0.66 -0.27 1.92 3.64 0.63 -0.91 116.57 122.12 1yj4 h LYS 261 Ca -0.10 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1yj4 h LYS 261 Cb 1.42 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 1yj4 h LYS 261 CO 0.13 0.44 0.17 1.25 -2.27 0.00 0.00 179.45 179.17 1yj4 h LEU 262 N 0.68 0.32 -0.97 5.20 5.85 -1.37 -2.31 115.31 122.72 1yj4 h LEU 262 Ca 0.27 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 59.01 1yj4 h LEU 262 Cb 0.11 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 40.99 1yj4 h LEU 262 CO -0.15 0.26 0.62 0.74 -0.34 0.00 0.00 178.44 179.58 1yj4 h THR 263 N 0.35 1.08 -0.64 1.05 2.02 -0.87 -0.38 112.91 115.52 1yj4 h THR 263 Ca 0.10 -0.39 -0.06 0.00 0.77 0.00 0.00 66.41 66.83 1yj4 h THR 263 Cb -0.01 -0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.23 1yj4 h THR 263 CO -0.02 0.21 0.15 1.56 0.37 0.00 0.00 175.52 177.79 1yj4 h GLN 264 N 1.13 1.01 -0.13 6.66 1.08 -0.83 -1.83 115.11 122.19 1yj4 h GLN 264 Ca 0.42 -0.23 -0.09 0.00 -1.45 0.00 0.00 58.65 57.29 1yj4 h GLN 264 Cb 0.17 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1yj4 h GLN 264 CO -0.17 0.90 -0.29 -0.44 -0.95 0.00 0.00 178.83 177.88 1yj4 h ASP 265 N 0.96 0.48 -0.97 1.46 3.32 -0.82 -1.47 116.42 119.38 1yj4 h ASP 265 Ca 0.20 -0.57 0.01 0.00 0.02 0.00 0.00 57.03 56.70 1yj4 h ASP 265 Cb 0.35 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 1yj4 h ASP 265 CO 0.00 0.96 0.64 0.74 -1.72 0.00 0.00 179.24 179.86 1yj4 h THR 266 N 0.02 1.23 -0.08 0.35 2.02 -1.01 0.43 112.91 115.87 1yj4 h THR 266 Ca 0.00 -0.44 -0.05 0.00 0.77 0.00 0.00 66.41 66.69 1yj4 h THR 266 Cb 0.89 -0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1yj4 h THR 266 CO 0.06 0.24 -0.13 -0.07 0.37 0.00 0.00 175.52 175.99 1yj4 h LEU 267 N 1.30 0.25 -0.90 2.58 3.38 -1.35 -0.80 115.31 119.77 1yj4 h LEU 267 Ca 0.36 -0.54 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1yj4 h LEU 267 Cb -0.12 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1yj4 h LEU 267 CO -0.09 0.74 0.55 -0.74 0.09 0.00 0.00 178.44 179.00 1yj4 h HIS 268 N -0.24 1.17 -0.65 1.13 2.76 -1.02 0.11 115.15 118.42 1yj4 h HIS 268 Ca 0.01 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.13 1yj4 h HIS 268 Cb 0.69 -0.39 -0.03 0.00 1.55 0.00 0.00 27.41 29.24 1yj4 h HIS 268 CO 0.11 0.77 0.20 1.03 -1.30 0.00 0.00 177.93 178.74 1yj4 h SER 269 N 1.23 0.95 -0.24 3.26 0.87 -0.11 -1.35 113.55 118.16 1yj4 h SER 269 Ca 0.32 -0.21 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1yj4 h SER 269 Cb -0.07 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.63 1yj4 h SER 269 CO -0.06 0.91 0.07 0.28 -0.53 0.00 0.00 176.83 177.49 1yj4 h SER 270 N 0.94 0.36 -0.26 6.23 0.02 -0.44 -1.62 113.55 118.77 1yj4 h SER 270 Ca 0.21 -0.22 0.05 0.00 -0.84 0.00 0.00 61.79 60.99 1yj4 h SER 270 Cb 0.30 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 62.70 1yj4 h SER 270 CO -0.01 0.48 -0.05 0.50 -1.14 0.00 0.00 176.83 176.61 1yj4 h LYS 271 N 0.22 0.01 0.00 3.45 3.64 -0.57 -2.34 116.57 120.99 1yj4 h LYS 271 Ca 0.08 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1yj4 h LYS 271 Cb 0.25 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1yj4 h LYS 271 CO -0.00 0.01 -0.34 1.96 -2.27 0.00 0.00 179.45 178.81 1yj4 h GLN 272 N 0.01 0.00 -0.09 1.90 1.08 -1.15 -2.65 115.11 114.21 1yj4 h GLN 272 Ca 0.12 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.32 1yj4 h GLN 272 Cb 0.18 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1yj4 h GLN 272 CO -0.25 0.34 0.05 0.52 -0.95 0.00 0.00 178.83 178.54 1yj4 h MET 273 N 0.00 0.12 -0.04 1.46 2.86 -0.74 -2.26 114.93 116.33 1yj4 h MET 273 Ca -0.00 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1yj4 h MET 273 Cb 0.68 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.32 1yj4 h MET 273 CO 0.04 0.13 0.02 0.28 1.06 0.00 0.00 176.91 178.44 1yj4 h VAL 274 N 0.08 1.11 -0.77 -2.22 2.07 -1.38 -2.46 116.25 112.68 1yj4 h VAL 274 Ca 0.03 -0.31 0.07 0.00 0.82 0.00 0.00 66.70 67.30 1yj4 h VAL 274 Cb 0.04 1.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 1yj4 h VAL 274 CO -0.01 0.09 0.45 0.00 0.02 0.00 0.00 177.57 178.12 1yj4 h ALA 275 N 0.89 1.06 -0.08 1.67 0.00 -1.41 -0.50 119.26 120.88 1yj4 h ALA 275 Ca 0.01 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1yj4 h ALA 275 Cb 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1yj4 h ALA 275 CO -0.00 0.15 -0.34 0.28 0.00 0.00 0.00 179.25 179.34 1yj4 h VAL 276 N 0.82 1.41 0.00 0.00 2.07 -1.38 -3.37 116.25 115.80 1yj4 h VAL 276 Ca 0.35 -1.72 0.00 0.00 0.82 0.00 0.00 66.70 66.14 1yj4 h VAL 276 Cb 0.21 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1yj4 h VAL 276 CO -0.19 0.50 -0.71 0.49 0.02 0.00 0.00 177.57 177.69 1yj4 n PHE 277 N -4.40 0.04 -0.20 1.57 3.72 -0.93 -4.34 117.46 112.91 1yj4 n PHE 277 Ca -0.08 0.01 0.05 0.00 -0.05 0.00 0.00 57.45 57.38 1yj4 n PHE 277 Cb 0.51 -0.21 0.32 0.00 -0.94 0.00 0.00 39.48 39.16 1yj4 n PHE 277 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1yj4 h SER 278 N 0.00 0.73 -0.62 4.37 4.64 -1.25 -2.15 113.55 119.27 1yj4 h SER 278 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yj4 h SER 278 Cb 0.53 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1yj4 h SER 278 CO 0.00 0.49 0.00 -0.90 -0.87 0.00 0.00 176.83 175.55 1yj4 n ASP 279 N -4.47 4.74 -3.91 4.97 5.75 -1.26 -4.97 116.55 117.40 1yj4 n ASP 279 Ca 0.10 -2.48 -0.15 0.00 -0.01 0.00 0.00 54.79 52.25 1yj4 n ASP 279 Cb 0.18 -0.57 0.06 0.00 -1.03 0.00 0.00 41.12 39.76 1yj4 n ASP 279 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1yj4 n LYS 280 N 1.02 0.44 -1.71 0.11 4.01 -0.81 -4.98 118.16 116.24 1yj4 n LYS 280 Ca 0.25 -2.03 -0.63 0.00 -0.51 0.00 0.00 58.31 55.40 1yj4 n LYS 280 Cb 0.90 -0.30 -0.09 0.00 -0.51 0.00 0.00 35.03 35.02 1yj4 n LYS 280 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1yj4 n ASP 281 N -2.72 1.77 -0.28 4.39 -0.08 -1.26 -4.76 116.55 113.61 1yj4 n ASP 281 Ca 0.11 1.11 0.24 0.00 -1.51 0.00 0.00 54.79 54.74 1yj4 n ASP 281 Cb 0.41 -1.01 0.56 0.00 2.34 0.00 0.00 41.12 43.43 1yj4 n ASP 281 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1yj4 h PRO 282 N 6.30 0.30 -0.35 -0.67 0.11 -1.93 0.09 132.00 135.85 1yj4 h PRO 282 Ca -0.44 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 1yj4 h PRO 282 Cb 1.35 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1yj4 h PRO 282 CO 0.98 0.20 -0.13 0.37 -0.21 0.00 0.00 178.00 179.20 1yj4 h GLN 283 N 0.30 0.71 0.43 1.05 4.15 -1.99 -1.18 115.11 118.59 1yj4 h GLN 283 Ca 0.53 -0.30 -0.02 0.00 0.77 0.00 0.00 58.65 59.63 1yj4 h GLN 283 Cb 1.50 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.17 1yj4 h GLN 283 CO -0.19 0.89 -0.21 0.28 -1.93 0.00 0.00 178.83 177.68 1yj4 h VAL 284 N 0.50 0.58 -0.66 2.39 2.07 -1.36 -1.73 116.25 118.03 1yj4 h VAL 284 Ca 0.08 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1yj4 h VAL 284 Cb 0.66 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1yj4 h VAL 284 CO 0.04 0.02 0.29 -0.03 0.02 0.00 0.00 177.57 177.92 1yj4 h MET 285 N -0.64 0.49 -0.29 1.57 1.85 -1.36 -0.70 114.93 115.84 1yj4 h MET 285 Ca -0.06 -0.03 0.03 0.00 -0.61 0.00 0.00 59.70 59.04 1yj4 h MET 285 Cb 0.48 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.36 1yj4 h MET 285 CO 0.10 0.32 0.09 0.22 -0.40 0.00 0.00 176.91 177.24 1yj4 h ASP 286 N 0.50 0.08 -0.75 1.39 3.58 -1.00 0.26 116.42 120.48 1yj4 h ASP 286 Ca 0.33 0.04 -0.05 0.00 0.42 0.00 0.00 57.03 57.77 1yj4 h ASP 286 Cb 0.39 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.44 1yj4 h ASP 286 CO -0.29 0.08 0.28 0.74 -2.88 0.00 0.00 179.24 177.16 1yj4 h THR 287 N 0.21 1.26 -0.23 2.25 2.02 -0.61 0.63 112.91 118.44 1yj4 h THR 287 Ca 0.13 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 1yj4 h THR 287 Cb 0.11 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 1yj4 h THR 287 CO -0.15 0.34 0.05 0.40 0.37 0.00 0.00 175.52 176.53 1yj4 h ILE 288 N 1.09 1.22 -0.17 3.11 2.04 -0.64 -1.49 117.51 122.66 1yj4 h ILE 288 Ca 0.25 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 1yj4 h ILE 288 Cb 0.25 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1yj4 h ILE 288 CO -0.02 0.22 0.06 -0.08 0.00 0.00 0.00 178.15 178.34 1yj4 h GLU 289 N 0.18 0.25 -0.79 2.37 4.81 -0.29 -1.89 114.58 119.22 1yj4 h GLU 289 Ca 0.07 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.33 1yj4 h GLU 289 Cb 0.29 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 1yj4 h GLU 289 CO 0.00 0.34 0.52 0.00 -0.73 0.00 0.00 179.01 179.14 1yj4 h PHE 291 N 0.81 0.19 -0.33 0.00 3.57 -0.85 -0.15 116.94 120.18 1yj4 h PHE 291 Ca 0.35 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.84 1yj4 h PHE 291 Cb 0.32 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 1yj4 h PHE 291 CO -0.00 0.45 0.17 0.52 -2.23 0.00 0.00 178.31 177.22 1yj4 h MET 292 N -0.12 0.34 -0.11 1.11 2.86 -0.87 0.30 114.93 118.45 1yj4 h MET 292 Ca 0.03 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1yj4 h MET 292 Cb 0.38 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 1yj4 h MET 292 CO 0.01 0.22 -0.06 0.45 1.06 0.00 0.00 176.91 178.59 1yj4 h HIS 293 N 0.35 0.27 -0.50 -0.22 3.86 -1.35 -2.05 115.15 115.50 1yj4 h HIS 293 Ca 0.14 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1yj4 h HIS 293 Cb 0.04 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.43 1yj4 h HIS 293 CO -0.10 0.59 0.32 0.78 0.86 0.00 0.00 177.93 180.38 1yj4 h GLY 294 N -0.13 0.71 0.99 2.45 0.00 -0.89 0.18 103.07 106.38 1yj4 h GLY 294 Ca 0.02 -0.25 0.05 0.00 0.00 0.00 0.00 47.33 47.15 1yj4 h GLY 294 CO 0.02 0.23 0.55 -1.82 0.00 0.00 0.00 176.54 175.52 1yj4 h TYR 295 N 0.65 0.99 -0.11 5.60 3.20 -0.37 0.27 116.97 127.20 1yj4 h TYR 295 Ca 0.19 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 1yj4 h TYR 295 Cb -0.04 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 37.91 1yj4 h TYR 295 CO -0.05 0.55 -0.29 0.28 -1.64 0.00 0.00 178.16 177.01 1yj4 h VAL 296 N 1.00 1.39 -0.60 1.81 2.07 -0.64 -2.63 116.25 118.66 1yj4 h VAL 296 Ca 0.35 -1.60 0.08 0.00 0.82 0.00 0.00 66.70 66.35 1yj4 h VAL 296 Cb 0.11 2.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.95 1yj4 h VAL 296 CO -0.11 0.47 0.25 0.74 0.02 0.00 0.00 177.57 178.94 1yj4 h THR 297 N -0.03 0.83 -0.50 2.57 2.02 0.05 -1.49 112.91 116.36 1yj4 h THR 297 Ca -0.00 -0.16 0.07 0.00 0.77 0.00 0.00 66.41 67.08 1yj4 h THR 297 Cb 0.90 0.33 -0.06 0.00 -1.74 0.00 0.00 68.15 67.59 1yj4 h THR 297 CO 0.06 0.08 0.18 -0.25 0.37 0.00 0.00 175.52 175.97 1yj4 h TRP 298 N 0.46 0.33 -0.35 3.16 7.01 -0.40 -0.57 115.95 125.59 1yj4 h TRP 298 Ca 0.29 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.28 1yj4 h TRP 298 Cb 0.31 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.28 1yj4 h TRP 298 CO -0.14 0.11 0.09 0.45 -2.79 0.00 0.00 178.44 176.16 1yj4 h HIS 299 N 0.37 0.59 -0.28 2.65 3.86 -0.98 -0.85 115.15 120.49 1yj4 h HIS 299 Ca 0.24 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.39 1yj4 h HIS 299 Cb 0.25 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 1yj4 h HIS 299 CO -0.16 0.59 0.17 -0.07 0.86 0.00 0.00 177.93 179.33 1yj4 h LEU 300 N 0.41 0.29 0.02 2.43 3.38 -0.88 -3.33 115.31 117.63 1yj4 h LEU 300 Ca 0.11 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1yj4 h LEU 300 Cb 0.30 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1yj4 h LEU 300 CO 0.00 0.21 -0.01 0.00 0.09 0.00 0.00 178.44 178.73 1yj4 n ASP 302 N -4.72 3.25 -0.30 0.00 -0.08 -0.33 -4.90 116.55 109.47 1yj4 n ASP 302 Ca -0.09 1.11 -0.01 0.00 -1.51 0.00 0.00 54.79 54.29 1yj4 n ASP 302 Cb 0.37 -1.48 0.12 0.00 2.34 0.00 0.00 41.12 42.47 1yj4 n ASP 302 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1yj4 h ARG 303 N 5.34 0.97 -1.16 -0.67 2.47 -1.89 -2.90 114.38 116.54 1yj4 h ARG 303 Ca -0.45 -0.06 0.41 0.00 -1.26 0.00 0.00 59.98 58.62 1yj4 h ARG 303 Cb 1.25 -0.22 -0.13 0.00 -1.65 0.00 0.00 29.97 29.22 1yj4 h ARG 303 CO 0.84 0.64 0.73 -2.13 0.56 0.00 0.00 179.97 180.61 1yj4 n ARG 304 N -4.60 -0.03 -0.01 0.04 0.63 -1.26 0.22 116.66 111.64 1yj4 n ARG 304 Ca 0.11 1.11 0.13 0.00 -0.92 0.00 0.00 57.85 58.28 1yj4 n ARG 304 Cb 0.13 -2.16 0.24 0.00 0.45 0.00 0.00 32.46 31.11 1yj4 n ARG 304 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1yj4 n PHE 305 N -4.53 0.04 -4.49 -0.14 3.01 -1.09 -4.88 117.46 105.37 1yj4 n PHE 305 Ca 0.35 -0.02 -0.41 0.00 1.01 0.00 0.00 57.45 58.38 1yj4 n PHE 305 Cb 1.33 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 40.73 1yj4 n PHE 305 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1yj4 n ARG 306 N 1.00 -1.09 0.00 -1.08 1.74 0.59 -4.41 116.66 113.40 1yj4 n ARG 306 Ca 0.16 0.17 0.11 0.00 -0.77 0.00 0.00 57.85 57.52 1yj4 n ARG 306 Cb 0.52 -4.71 0.67 0.00 -1.02 0.00 0.00 32.46 27.92 1yj4 n ARG 306 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1yj4 n LEU 307 N -4.14 0.00 0.05 0.55 4.77 -1.26 -2.86 117.00 114.11 1yj4 n LEU 307 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 1yj4 n LEU 307 Cb 0.47 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.55 1yj4 n LEU 307 CO 0.95 0.00 0.28 0.77 -1.33 0.00 0.00 177.39 178.05 1yj4 h SER 308 N 0.00 0.54 -0.44 -1.43 4.64 -1.86 -3.18 113.55 111.82 1yj4 h SER 308 Ca 0.00 -0.38 -0.09 0.00 -0.47 0.00 0.00 61.79 60.84 1yj4 h SER 308 Cb 0.00 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 1yj4 h SER 308 CO 0.00 1.15 -0.06 -0.33 -0.87 0.00 0.00 176.83 176.72 1yj4 h GLU 309 N 0.28 0.88 -0.39 4.77 5.08 -1.92 -2.27 114.58 121.01 1yj4 h GLU 309 Ca -0.05 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1yj4 h GLU 309 Cb 1.42 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1yj4 h GLU 309 CO 0.14 0.92 0.00 -0.89 -1.00 0.00 0.00 179.01 178.18 1yj4 n ILE 310 N -4.17 0.00 0.00 3.13 2.08 -1.20 -3.77 119.36 115.42 1yj4 n ILE 310 Ca 0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.33 1yj4 n ILE 310 Cb 0.35 -0.26 0.00 0.00 -0.75 0.00 0.00 39.64 38.98 1yj4 n ILE 310 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1yj4 n TYR 311 N 0.01 0.00 -0.29 1.39 9.36 -0.85 -4.64 117.16 122.14 1yj4 n TYR 311 Ca 0.00 0.00 0.07 0.00 3.32 0.00 0.00 57.90 61.29 1yj4 n TYR 311 Cb 0.10 -0.02 0.17 0.00 -0.63 0.00 0.00 39.34 38.96 1yj4 n TYR 311 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1yj4 h GLU 312 N 0.00 0.04 0.00 2.98 3.07 -1.72 0.18 114.58 119.14 1yj4 h GLU 312 Ca 0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1yj4 h GLU 312 Cb 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 1yj4 h GLU 312 CO 0.00 0.03 0.16 1.63 -1.40 0.00 0.00 179.01 179.43 1yj4 n LYS 313 N -5.45 0.00 0.00 2.33 5.02 -1.26 -1.68 118.16 117.12 1yj4 n LYS 313 Ca 0.16 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 1yj4 n LYS 313 Cb 0.53 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1yj4 n LYS 313 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1yj4 n VAL 314 N -1.23 0.00 0.22 -0.18 0.24 0.49 -4.88 118.33 112.99 1yj4 n VAL 314 Ca 0.00 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.38 1yj4 n VAL 314 Cb 0.16 1.08 0.52 0.00 -1.47 0.00 0.00 33.84 34.12 1yj4 n VAL 314 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1yj4 h LYS 315 N 0.00 0.00 -1.53 7.34 2.10 -0.21 -3.13 116.57 121.13 1yj4 h LYS 315 Ca 0.00 0.00 -0.63 0.00 -2.00 0.00 0.00 60.65 58.02 1yj4 h LYS 315 Cb 0.73 0.00 -0.39 0.00 -0.90 0.00 0.00 32.23 31.67 1yj4 h LYS 315 CO 0.00 0.24 -0.32 0.39 -2.00 0.00 0.00 179.45 177.76 1yj4 n GLU 316 N -3.69 3.29 -4.62 0.07 1.02 -1.26 -5.03 120.64 110.42 1yj4 n GLU 316 Ca -0.01 -4.24 -0.29 0.00 -0.02 0.00 0.00 57.16 52.60 1yj4 n GLU 316 Cb 0.36 -2.26 -0.08 0.00 -0.02 0.00 0.00 31.44 29.44 1yj4 n GLU 316 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1yj4 s GLU 317 N -3.66 2.02 -0.47 3.49 2.02 -1.19 -5.12 118.70 115.80 1yj4 s GLU 317 Ca 0.50 -2.25 0.05 0.00 0.02 0.00 0.00 54.97 53.29 1yj4 s GLU 317 Cb 0.41 -1.10 0.18 0.00 0.10 0.00 0.00 34.13 33.73 1yj4 s GLU 317 CO -0.21 -0.37 0.41 1.63 0.02 0.00 0.00 175.26 176.74 1yj4 n LYS 318 N -1.05 0.65 -4.51 1.61 5.02 -1.26 -4.85 118.16 113.77 1yj4 n LYS 318 Ca -0.11 -3.47 -0.24 0.00 -2.02 0.00 0.00 58.31 52.46 1yj4 n LYS 318 Cb 0.66 -1.74 -0.11 0.00 -0.02 0.00 0.00 35.03 33.83 1yj4 n LYS 318 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1yj4 s THR 319 N -0.50 1.71 -1.54 -0.18 2.01 -1.26 -5.03 115.64 110.86 1yj4 s THR 319 Ca 0.32 -2.06 0.27 0.00 0.31 0.00 0.00 61.69 60.53 1yj4 s THR 319 Cb 0.05 -2.74 0.27 0.00 0.01 0.00 0.00 72.50 70.08 1yj4 s THR 319 CO -0.17 -0.11 1.64 1.21 -0.69 0.00 0.00 174.62 176.49 1yj4 n GLU 320 N -0.76 0.59 -0.02 4.92 2.13 -1.26 -3.33 120.64 122.91 1yj4 n GLU 320 Ca -0.04 -0.30 -0.06 0.00 0.66 0.00 0.00 57.16 57.42 1yj4 n GLU 320 Cb 0.65 -1.49 -0.02 0.00 0.27 0.00 0.00 31.44 30.85 1yj4 n GLU 320 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1yj4 n ASP 321 N -0.94 1.24 0.07 4.31 8.00 -1.26 -4.26 116.55 123.71 1yj4 n ASP 321 Ca 0.11 0.19 0.05 0.00 0.71 0.00 0.00 54.79 55.85 1yj4 n ASP 321 Cb 0.33 -0.45 0.26 0.00 -0.02 0.00 0.00 41.12 41.24 1yj4 n ASP 321 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yj4 n ALA 322 N -3.76 1.07 -0.06 2.24 0.00 -1.26 -0.82 120.51 117.92 1yj4 n ALA 322 Ca -0.10 0.08 -0.10 0.00 0.00 0.00 0.00 53.44 53.31 1yj4 n ALA 322 Cb 0.33 -1.15 -0.15 0.00 0.00 0.00 0.00 19.45 18.49 1yj4 n ALA 322 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1yj4 n GLN 323 N -1.81 0.66 0.14 0.00 7.27 -1.21 -3.95 117.38 118.48 1yj4 n GLN 323 Ca -0.00 0.17 0.13 0.00 0.07 0.00 0.00 57.00 57.36 1yj4 n GLN 323 Cb 0.03 -1.67 0.30 0.00 2.41 0.00 0.00 30.24 31.32 1yj4 n GLN 323 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1yj4 h LYS 324 N 0.00 0.00 -0.30 3.69 1.57 -1.32 -3.20 116.57 117.02 1yj4 h LYS 324 Ca -0.41 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.33 1yj4 h LYS 324 Cb 2.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.40 1yj4 h LYS 324 CO 0.05 0.00 0.03 0.35 -0.57 0.00 0.00 179.45 179.32 1yj4 h PHE 325 N 0.00 0.53 -0.10 -1.35 3.57 -1.10 -2.59 116.94 115.90 1yj4 h PHE 325 Ca 0.00 -0.08 -0.21 0.00 3.53 0.00 0.00 57.97 61.21 1yj4 h PHE 325 Cb 0.83 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1yj4 h PHE 325 CO 0.00 0.60 -0.78 0.00 -2.23 0.00 0.00 178.31 175.91 1yj4 h LYS 327 N 0.39 0.27 -0.01 0.00 1.57 -1.53 0.89 116.57 118.15 1yj4 h LYS 327 Ca -0.05 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1yj4 h LYS 327 Cb 1.38 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1yj4 h LYS 327 CO 0.15 0.18 -0.03 0.74 -0.57 0.00 0.00 179.45 179.91 1yj4 h PHE 328 N 0.28 0.05 -0.71 -1.35 0.04 -1.44 -2.65 116.94 111.17 1yj4 h PHE 328 Ca 0.33 -0.02 0.14 0.00 2.80 0.00 0.00 57.97 61.21 1yj4 h PHE 328 Cb 0.49 -0.01 -0.10 0.00 2.20 0.00 0.00 35.95 38.53 1yj4 h PHE 328 CO -0.24 0.66 0.23 -0.92 -0.60 0.00 0.00 178.31 177.44 1yj4 h TYR 329 N -0.57 0.38 -0.21 -0.55 5.03 -0.20 0.26 116.97 121.11 1yj4 h TYR 329 Ca -0.00 0.04 -0.13 0.00 2.58 0.00 0.00 58.73 61.22 1yj4 h TYR 329 Cb 0.66 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.87 1yj4 h TYR 329 CO 0.14 0.00 -0.41 0.93 -1.32 0.00 0.00 178.16 177.51 1yj4 h GLU 330 N 0.35 0.49 -0.51 1.82 5.08 0.73 -1.79 114.58 120.75 1yj4 h GLU 330 Ca 0.39 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1yj4 h GLU 330 Cb 0.60 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1yj4 h GLU 330 CO -0.43 0.82 0.27 1.96 -1.00 0.00 0.00 179.01 180.63 1yj4 h GLN 331 N 0.40 0.71 0.38 2.33 4.20 -0.70 0.12 115.11 122.56 1yj4 h GLN 331 Ca 0.03 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1yj4 h GLN 331 Cb 0.89 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.53 1yj4 h GLN 331 CO 0.08 0.53 -0.18 0.00 -0.67 0.00 0.00 178.83 178.59 1yj4 h ALA 332 N 1.58 -1.12 -0.99 3.87 0.00 -0.34 -3.08 119.26 119.18 1yj4 h ALA 332 Ca 0.18 -0.11 0.19 0.00 0.00 0.00 0.00 54.91 55.17 1yj4 h ALA 332 Cb 0.04 0.20 -0.10 0.00 0.00 0.00 0.00 17.79 17.93 1yj4 h ALA 332 CO -0.03 -1.08 0.61 0.00 0.00 0.00 0.00 179.25 178.76 1yj4 h ALA 333 N -1.76 1.76 -0.73 0.00 0.00 -1.12 2.77 119.26 120.18 1yj4 h ALA 333 Ca -0.05 0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.14 1yj4 h ALA 333 Cb 0.39 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1yj4 h ALA 333 CO 0.09 -0.12 0.78 -0.97 0.00 0.00 0.00 179.25 179.02 1yj4 h ASN 334 N 0.71 0.00 0.00 0.00 -1.24 -0.66 -1.55 115.58 112.84 1yj4 h ASN 334 Ca 0.56 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.57 1yj4 h ASN 334 Cb 0.95 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.00 1yj4 h ASN 334 CO -0.35 0.00 0.00 0.55 -1.29 0.00 0.00 177.43 176.34 1yj4 n VAL 335 N -3.58 0.00 -0.08 2.57 3.14 -0.38 -4.87 118.33 115.12 1yj4 n VAL 335 Ca 0.15 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.44 1yj4 n VAL 335 Cb 1.03 0.91 -0.15 0.00 -1.06 0.00 0.00 33.84 34.57 1yj4 n VAL 335 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1yj4 n GLY 336 N 0.00 -1.00 3.58 7.55 0.00 0.92 -4.76 105.19 111.47 1yj4 n GLY 336 Ca 0.00 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1yj4 n GLY 336 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yj4 s ALA 337 N -2.55 2.88 -0.03 4.61 0.00 -0.61 -4.90 121.76 121.16 1yj4 s ALA 337 Ca -0.09 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.15 1yj4 s ALA 337 Cb 0.07 -4.08 0.02 0.00 0.00 0.00 0.00 23.12 19.12 1yj4 s ALA 337 CO 0.83 -2.83 -0.04 0.08 0.00 0.00 0.00 175.76 173.80 1yj4 s VAL 338 N 5.63 0.46 0.06 0.00 1.01 -1.26 -4.92 120.40 121.38 1yj4 s VAL 338 Ca 0.49 -0.11 -0.31 0.00 0.00 0.00 0.00 61.98 62.05 1yj4 s VAL 338 Cb -0.10 -0.48 -0.06 0.00 0.00 0.00 0.00 36.38 35.75 1yj4 s VAL 338 CO 0.25 0.19 1.28 -0.55 0.00 0.00 0.00 175.10 176.28 1yj4 s SER 339 N 0.71 6.97 0.44 3.32 0.15 -1.26 -4.90 113.70 119.12 1yj4 s SER 339 Ca -0.09 2.11 0.22 0.00 0.70 0.00 0.00 55.95 58.89 1yj4 s SER 339 Cb -0.12 -2.58 1.20 0.00 -1.71 0.00 0.00 66.02 62.81 1yj4 s SER 339 CO -0.00 -0.57 1.83 -0.65 1.20 0.00 0.00 173.24 175.05 1yj4 h PRO 340 N 6.98 0.29 0.00 5.44 0.11 -2.00 0.30 132.00 143.12 1yj4 h PRO 340 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1yj4 h PRO 340 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1yj4 h PRO 340 CO 0.84 0.19 0.08 0.66 -0.21 0.00 0.00 178.00 179.56 1yj4 h SER 341 N 0.30 0.00 0.58 -2.05 4.64 -1.91 0.30 113.55 115.41 1yj4 h SER 341 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1yj4 h SER 341 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1yj4 h SER 341 CO -0.18 0.00 -0.21 -0.62 -0.87 0.00 0.00 176.83 174.95 1yj4 n GLU 342 N -2.60 0.29 0.00 4.77 1.02 0.11 -4.70 120.64 119.53 1yj4 n GLU 342 Ca -0.02 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1yj4 n GLU 342 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1yj4 n GLU 342 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 1yj4 n TRP 343 N -1.26 0.00 -2.62 -0.32 4.27 0.08 -4.89 117.44 112.70 1yj4 n TRP 343 Ca 0.09 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.27 1yj4 n TRP 343 Cb 0.32 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.27 1yj4 n TRP 343 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1yj4 n ALA 344 N -1.37 3.62 -3.52 -1.67 0.00 0.84 -4.56 120.51 113.85 1yj4 n ALA 344 Ca 0.00 -3.90 -0.15 0.00 0.00 0.00 0.00 53.44 49.39 1yj4 n ALA 344 Cb 0.00 -3.53 -0.05 0.00 0.00 0.00 0.00 19.45 15.87 1yj4 n ALA 344 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1yj4 s TYR 345 N 3.85 -0.55 0.94 0.00 -0.85 -1.26 -4.65 117.35 114.83 1yj4 s TYR 345 Ca 0.52 0.83 -0.14 0.00 -0.52 0.00 0.00 57.07 57.76 1yj4 s TYR 345 Cb 0.03 0.45 0.20 0.00 0.38 0.00 0.00 41.96 43.02 1yj4 s TYR 345 CO 0.07 -0.57 1.29 -1.25 -1.52 0.00 0.00 175.55 173.56 1yj4 s PRO 346 N -1.66 0.67 0.50 -3.49 0.04 -1.26 -4.85 135.00 124.95 1yj4 s PRO 346 Ca -0.06 -0.57 -0.22 0.00 0.04 0.00 0.00 61.00 60.19 1yj4 s PRO 346 Cb -0.00 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.57 1yj4 s PRO 346 CO 0.03 -2.35 1.24 -1.25 0.04 0.00 0.00 177.00 174.72 1yj4 s PRO 347 N -5.81 3.46 0.23 0.56 0.04 -1.26 -4.90 135.00 127.32 1yj4 s PRO 347 Ca 0.74 1.96 -0.07 0.00 0.04 0.00 0.00 61.00 63.68 1yj4 s PRO 347 Cb -0.03 -2.32 0.39 0.00 0.04 0.00 0.00 34.50 32.58 1yj4 s PRO 347 CO 0.52 -0.85 1.72 0.28 0.04 0.00 0.00 177.00 178.71 1yj4 h VAL 348 N 1.64 0.64 -0.87 -0.36 2.07 -1.96 -0.61 116.25 116.80 1yj4 h VAL 348 Ca -0.50 -0.12 0.11 0.00 0.82 0.00 0.00 66.70 67.00 1yj4 h VAL 348 Cb 1.27 0.25 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 1yj4 h VAL 348 CO 0.59 0.07 0.56 0.00 0.02 0.00 0.00 177.57 178.81 1yj4 h ALA 349 N 1.52 1.70 -0.41 1.67 0.00 -1.92 0.04 119.26 121.87 1yj4 h ALA 349 Ca 0.37 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.15 1yj4 h ALA 349 Cb 0.56 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1yj4 h ALA 349 CO -0.41 0.11 -0.28 0.37 0.00 0.00 0.00 179.25 179.04 1yj4 h GLN 350 N 0.81 0.88 -0.15 0.00 4.15 -1.48 -2.84 115.11 116.47 1yj4 h GLN 350 Ca 0.41 -0.40 -0.11 0.00 0.77 0.00 0.00 58.65 59.32 1yj4 h GLN 350 Cb 0.48 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1yj4 h GLN 350 CO -0.18 1.05 -0.38 -0.07 -1.93 0.00 0.00 178.83 177.32 1yj4 h LEU 351 N 0.75 0.35 0.00 -2.39 3.38 -0.86 -3.50 115.31 113.04 1yj4 h LEU 351 Ca 0.09 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1yj4 h LEU 351 Cb 0.84 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1yj4 h LEU 351 CO 0.07 0.70 0.00 0.00 0.09 0.00 0.00 178.44 179.31