#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j37 s GLN 24 N 0.00 3.84 0.00 9.51 -0.21 -1.26 -4.91 119.66 126.63 1j37 s GLN 24 Ca 0.00 -0.31 0.21 0.00 0.02 0.00 0.00 55.36 55.28 1j37 s GLN 24 Cb 0.00 -3.70 -0.02 0.00 1.00 0.00 0.00 33.01 30.29 1j37 s GLN 24 CO 0.00 -0.29 1.04 0.00 -2.12 0.00 0.00 175.29 173.92 1j37 n ALA 25 N 5.17 3.53 -0.10 6.09 0.00 -1.26 -4.21 120.51 129.73 1j37 n ALA 25 Ca -0.12 -0.63 0.20 0.00 0.00 0.00 0.00 53.44 52.89 1j37 n ALA 25 Cb 0.51 -0.75 0.62 0.00 0.00 0.00 0.00 19.45 19.83 1j37 n ALA 25 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1j37 h LYS 26 N 2.27 0.17 -0.08 0.00 2.10 -1.99 0.72 116.57 119.76 1j37 h LYS 26 Ca 0.00 -0.01 -0.21 0.00 -2.00 0.00 0.00 60.65 58.43 1j37 h LYS 26 Cb 0.72 -0.04 0.01 0.00 -0.90 0.00 0.00 32.23 32.02 1j37 h LYS 26 CO 0.00 0.11 -0.76 0.93 -2.00 0.00 0.00 179.45 177.73 1j37 h GLU 27 N 0.18 0.66 0.71 0.07 5.08 -2.00 -2.22 114.58 117.06 1j37 h GLU 27 Ca 0.34 -0.60 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 1j37 h GLU 27 Cb 1.07 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1j37 h GLU 27 CO -0.06 1.21 -0.39 -0.92 -1.00 0.00 0.00 179.01 177.85 1j37 h TYR 28 N 0.31 -1.04 -0.80 4.33 3.20 -0.05 -1.92 116.97 121.01 1j37 h TYR 28 Ca -0.07 -0.02 0.14 0.00 3.14 0.00 0.00 58.73 61.92 1j37 h TYR 28 Cb 1.41 0.36 -0.09 0.00 1.54 0.00 0.00 36.73 39.95 1j37 h TYR 28 CO 0.11 -0.61 0.37 -0.07 -1.64 0.00 0.00 178.16 176.32 1j37 h LEU 29 N -1.02 0.42 -0.34 2.82 3.38 -0.18 0.18 115.31 120.57 1j37 h LEU 29 Ca -0.10 0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1j37 h LEU 29 Cb 0.80 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1j37 h LEU 29 CO 0.13 0.18 0.22 -0.08 0.09 0.00 0.00 178.44 178.97 1j37 h GLU 30 N 0.55 0.43 -0.34 1.13 4.81 -1.36 0.26 114.58 120.06 1j37 h GLU 30 Ca 0.43 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.63 1j37 h GLU 30 Cb 0.62 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 1j37 h GLU 30 CO -0.37 0.29 0.17 -0.91 -0.73 0.00 0.00 179.01 177.46 1j37 h ASN 31 N 0.44 0.43 -0.43 1.04 -0.26 -0.31 -2.58 115.58 113.91 1j37 h ASN 31 Ca 0.13 -0.11 -0.06 0.00 -0.56 0.00 0.00 56.30 55.71 1j37 h ASN 31 Cb -0.03 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.10 1j37 h ASN 31 CO -0.04 0.41 0.05 0.25 -1.06 0.00 0.00 177.43 177.04 1j37 h LEU 32 N 0.42 0.71 -0.43 1.61 5.85 -0.33 -2.76 115.31 120.38 1j37 h LEU 32 Ca 0.12 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1j37 h LEU 32 Cb 0.09 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1j37 h LEU 32 CO -0.02 0.81 0.21 0.78 -0.34 0.00 0.00 178.44 179.88 1j37 h ASN 33 N 0.58 0.55 -0.30 1.25 -0.26 -0.47 0.35 115.58 117.29 1j37 h ASN 33 Ca 0.13 -0.12 0.07 0.00 -0.56 0.00 0.00 56.30 55.82 1j37 h ASN 33 Cb 0.42 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 37.52 1j37 h ASN 33 CO 0.01 0.52 0.21 0.50 -1.06 0.00 0.00 177.43 177.61 1j37 h LYS 34 N 0.55 0.07 0.05 0.81 3.64 -1.38 0.15 116.57 120.47 1j37 h LYS 34 Ca 0.15 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.45 1j37 h LYS 34 Cb 0.10 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1j37 h LYS 34 CO -0.02 0.05 -0.33 1.49 -2.27 0.00 0.00 179.45 178.37 1j37 h GLU 35 N 0.07 0.13 -0.94 1.90 4.57 -1.08 -2.80 114.58 116.44 1j37 h GLU 35 Ca 0.14 -0.21 0.10 0.00 -1.18 0.00 0.00 59.36 58.21 1j37 h GLU 35 Cb 0.45 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 29.04 1j37 h GLU 35 CO -0.01 1.09 0.58 -0.07 -1.18 0.00 0.00 179.01 179.41 1j37 h LEU 36 N -0.72 0.85 -1.27 1.64 3.38 -0.28 0.99 115.31 119.89 1j37 h LEU 36 Ca -0.06 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1j37 h LEU 36 Cb 1.25 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1j37 h LEU 36 CO 0.06 0.47 -0.32 0.00 0.09 0.00 0.00 178.44 178.75 1j37 h ALA 37 N 1.50 1.20 0.03 1.53 0.00 -0.80 0.36 119.26 123.08 1j37 h ALA 37 Ca 0.45 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1j37 h ALA 37 Cb 0.40 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1j37 h ALA 37 CO -0.25 0.40 -0.01 -0.22 0.00 0.00 0.00 179.25 179.17 1j37 h LYS 38 N 0.00 -0.03 0.00 0.00 1.63 -0.40 -2.95 116.57 114.81 1j37 h LYS 38 Ca -0.00 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1j37 h LYS 38 Cb 0.69 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.32 1j37 h LYS 38 CO 0.04 0.67 -0.09 0.00 -3.45 0.00 0.00 179.45 176.63 1j37 h ARG 39 N -0.84 0.00 0.00 1.90 3.08 0.12 -2.21 114.38 116.42 1j37 h ARG 39 Ca -0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 1j37 h ARG 39 Cb 0.72 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.75 1j37 h ARG 39 CO 0.01 0.09 -1.06 1.15 -1.07 0.00 0.00 179.97 179.08 1j37 h THR 40 N 0.00 1.14 0.02 2.04 2.02 -0.38 -3.20 112.91 114.56 1j37 h THR 40 Ca -0.00 -2.75 0.03 0.00 0.77 0.00 0.00 66.41 64.46 1j37 h THR 40 Cb 0.42 2.53 -0.04 0.00 -1.74 0.00 0.00 68.15 69.32 1j37 h THR 40 CO 0.01 0.65 -0.23 -1.13 0.37 0.00 0.00 175.52 175.20 1j37 h ASN 41 N 0.00 -0.66 -0.34 4.18 -1.24 -1.21 0.19 115.58 116.49 1j37 h ASN 41 Ca -0.08 0.09 0.08 0.00 0.71 0.00 0.00 56.30 57.09 1j37 h ASN 41 Cb 1.68 0.27 -0.08 0.00 0.73 0.00 0.00 38.32 40.92 1j37 h ASN 41 CO 0.09 -0.30 -0.23 0.58 -1.29 0.00 0.00 177.43 176.28 1j37 h VAL 42 N -0.37 0.38 -0.92 2.57 2.07 -1.58 -1.02 116.25 117.37 1j37 h VAL 42 Ca 0.05 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.63 1j37 h VAL 42 Cb 0.44 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 1j37 h VAL 42 CO -0.19 0.00 0.60 -0.08 0.02 0.00 0.00 177.57 177.92 1j37 h GLU 43 N -0.19 1.07 -0.33 1.57 4.81 -1.40 -2.43 114.58 117.68 1j37 h GLU 43 Ca 0.17 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 1j37 h GLU 43 Cb 0.45 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1j37 h GLU 43 CO -0.45 0.71 -0.12 1.15 -0.73 0.00 0.00 179.01 179.56 1j37 h THR 44 N 1.10 1.24 -0.03 0.32 2.02 0.62 -1.35 112.91 116.83 1j37 h THR 44 Ca 0.38 -1.06 -0.10 0.00 0.77 0.00 0.00 66.41 66.40 1j37 h THR 44 Cb 0.12 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1j37 h THR 44 CO -0.13 0.35 -0.46 -0.33 0.37 0.00 0.00 175.52 175.32 1j37 h GLU 45 N 0.52 0.07 0.14 6.66 4.39 -0.86 -0.38 114.58 125.13 1j37 h GLU 45 Ca 0.09 -0.04 -0.28 0.00 0.34 0.00 0.00 59.36 59.47 1j37 h GLU 45 Cb 0.52 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1j37 h GLU 45 CO 0.03 0.52 -1.26 0.00 -1.16 0.00 0.00 179.01 177.15 1j37 h ALA 46 N 1.47 0.07 -0.60 3.43 0.00 -1.32 -1.38 119.26 120.92 1j37 h ALA 46 Ca 0.00 -0.86 -0.06 0.00 0.00 0.00 0.00 54.91 53.99 1j37 h ALA 46 Cb 0.84 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1j37 h ALA 46 CO 0.06 0.89 0.13 0.00 0.00 0.00 0.00 179.25 180.33 1j37 h ALA 47 N 0.50 0.80 0.00 0.00 0.00 -1.10 -1.84 119.26 117.62 1j37 h ALA 47 Ca -0.15 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 1j37 h ALA 47 Cb 1.97 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1j37 h ALA 47 CO 0.22 0.52 -0.38 2.35 0.00 0.00 0.00 179.25 181.96 1j37 h TRP 48 N 0.88 0.00 0.03 0.00 2.91 -1.06 -1.97 115.95 116.75 1j37 h TRP 48 Ca 0.19 0.00 -0.21 0.00 1.13 0.00 0.00 58.89 59.99 1j37 h TRP 48 Cb 0.38 0.00 0.02 0.00 -0.51 0.00 0.00 29.16 29.04 1j37 h TRP 48 CO 0.03 0.38 -0.85 0.00 -1.03 0.00 0.00 178.44 176.96 1j37 h ALA 49 N 1.62 0.06 0.79 2.65 0.00 -0.98 -3.07 119.26 120.33 1j37 h ALA 49 Ca -0.00 -0.65 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 1j37 h ALA 49 Cb 0.86 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1j37 h ALA 49 CO 0.05 0.50 -0.48 -0.92 0.00 0.00 0.00 179.25 178.40 1j37 h TYR 50 N 0.07 -1.28 0.00 0.00 3.20 -1.29 -1.11 116.97 116.57 1j37 h TYR 50 Ca -0.12 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.74 1j37 h TYR 50 Cb 1.55 0.45 0.00 0.00 1.54 0.00 0.00 36.73 40.27 1j37 h TYR 50 CO 0.13 -0.72 0.00 0.54 -1.64 0.00 0.00 178.16 176.48 1j37 n ARG 51 N -5.49 0.15 -0.00 1.82 1.74 -0.75 -0.23 116.66 113.90 1j37 n ARG 51 Ca -0.15 0.08 0.04 0.00 -0.77 0.00 0.00 57.85 57.06 1j37 n ARG 51 Cb 0.49 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.38 1j37 n ARG 51 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1j37 n SER 52 N -1.10 0.75 -3.13 0.55 7.64 -0.97 -2.07 113.62 115.30 1j37 n SER 52 Ca 0.04 -0.62 0.04 0.00 1.01 0.00 0.00 58.87 59.34 1j37 n SER 52 Cb 0.03 1.05 -0.00 0.00 -1.01 0.00 0.00 64.21 64.28 1j37 n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1j37 s ALA 53 N -1.94 -2.98 -0.89 -0.43 0.00 0.68 -4.71 121.76 111.48 1j37 s ALA 53 Ca 0.02 0.98 -0.25 0.00 0.00 0.00 0.00 51.96 52.72 1j37 s ALA 53 Cb 0.07 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.49 1j37 s ALA 53 CO 0.37 -2.04 1.64 0.42 0.00 0.00 0.00 175.76 176.15 1j37 s ILE 54 N 2.58 3.66 0.16 0.00 1.01 0.21 -4.33 121.20 124.48 1j37 s ILE 54 Ca 0.16 -0.33 0.09 0.00 0.00 0.00 0.00 60.65 60.57 1j37 s ILE 54 Cb -0.06 -4.55 -0.04 0.00 0.01 0.00 0.00 42.46 37.82 1j37 s ILE 54 CO -0.20 -1.47 -0.21 0.42 0.00 0.00 0.00 174.94 173.48 1j37 s THR 55 N 7.29 1.98 0.21 2.92 -4.23 -1.26 -4.72 115.64 117.83 1j37 s THR 55 Ca 0.55 -1.88 -0.10 0.00 -1.18 0.00 0.00 61.69 59.08 1j37 s THR 55 Cb -0.05 -1.88 0.15 0.00 1.34 0.00 0.00 72.50 72.06 1j37 s THR 55 CO 0.01 -0.19 1.87 0.44 -0.54 0.00 0.00 174.62 176.20 1j37 h ASP 56 N 3.42 0.80 0.17 3.99 3.32 -1.98 -0.31 116.42 125.83 1j37 h ASP 56 Ca -0.45 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.60 1j37 h ASP 56 Cb 1.20 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 1j37 h ASP 56 CO 0.47 0.57 -0.28 -0.08 -1.72 0.00 0.00 179.24 178.20 1j37 h GLU 57 N 0.95 -0.51 -0.48 3.56 4.81 -1.98 0.27 114.58 121.21 1j37 h GLU 57 Ca 0.28 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.63 1j37 h GLU 57 Cb -0.06 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1j37 h GLU 57 CO -0.08 -0.34 0.33 -0.91 -0.73 0.00 0.00 179.01 177.28 1j37 h ASN 58 N -0.53 0.27 -0.17 1.04 4.21 -1.80 0.02 115.58 118.62 1j37 h ASN 58 Ca 0.02 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.37 1j37 h ASN 58 Cb 0.53 -0.05 -0.00 0.00 -1.12 0.00 0.00 38.32 37.67 1j37 h ASN 58 CO -0.13 0.17 -0.50 -0.08 -1.29 0.00 0.00 177.43 175.60 1j37 h GLU 59 N 0.30 0.74 -0.39 0.81 4.81 0.42 -2.29 114.58 118.99 1j37 h GLU 59 Ca 0.22 -0.44 -0.14 0.00 -0.13 0.00 0.00 59.36 58.87 1j37 h GLU 59 Cb 0.47 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 1j37 h GLU 59 CO -0.05 1.06 -0.30 -0.22 -0.73 0.00 0.00 179.01 178.77 1j37 h LYS 60 N 0.58 0.89 -0.17 1.92 3.64 0.12 -2.04 116.57 121.51 1j37 h LYS 60 Ca 0.03 -0.44 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 1j37 h LYS 60 Cb 1.07 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1j37 h LYS 60 CO 0.10 1.09 0.01 -0.22 -2.27 0.00 0.00 179.45 178.16 1j37 h LYS 61 N 0.71 0.29 -0.04 1.90 3.64 -1.08 -1.00 116.57 120.99 1j37 h LYS 61 Ca 0.07 -0.09 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 1j37 h LYS 61 Cb 0.88 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.62 1j37 h LYS 61 CO 0.08 0.50 -0.37 -0.22 -2.27 0.00 0.00 179.45 177.17 1j37 h LYS 62 N 0.04 -0.48 -0.17 1.90 3.64 -1.39 -0.98 116.57 119.13 1j37 h LYS 62 Ca 0.05 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1j37 h LYS 62 Cb 0.36 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1j37 h LYS 62 CO 0.01 -0.32 -0.12 -0.91 -2.27 0.00 0.00 179.45 175.84 1j37 h ASN 63 N -0.50 0.26 0.35 4.20 2.35 -1.34 -2.86 115.58 118.03 1j37 h ASN 63 Ca 0.06 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1j37 h ASN 63 Cb 0.60 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 1j37 h ASN 63 CO -0.32 0.41 -0.20 -0.08 -1.65 0.00 0.00 177.43 175.59 1j37 h GLU 64 N 0.26 -0.50 -0.38 0.81 4.57 -0.23 -1.80 114.58 117.31 1j37 h GLU 64 Ca 0.05 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.33 1j37 h GLU 64 Cb 0.38 0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 29.02 1j37 h GLU 64 CO 0.02 -0.34 0.03 0.82 -1.18 0.00 0.00 179.01 178.37 1j37 h ILE 65 N -0.52 0.75 -0.92 2.32 1.08 -1.08 -1.32 117.51 117.82 1j37 h ILE 65 Ca -0.04 -0.05 0.02 0.00 -0.39 0.00 0.00 64.86 64.40 1j37 h ILE 65 Cb 0.43 0.60 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 1j37 h ILE 65 CO 0.05 0.03 0.61 0.28 -0.69 0.00 0.00 178.15 178.42 1j37 h SER 66 N 0.14 1.03 -0.48 1.72 0.02 -1.37 0.21 113.55 114.83 1j37 h SER 66 Ca 0.19 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1j37 h SER 66 Cb 0.24 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1j37 h SER 66 CO -0.28 0.73 0.23 0.00 -1.14 0.00 0.00 176.83 176.37 1j37 h ALA 67 N 1.44 0.61 0.39 3.77 0.00 -0.60 0.21 119.26 125.09 1j37 h ALA 67 Ca 0.35 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1j37 h ALA 67 Cb -0.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1j37 h ALA 67 CO -0.09 0.17 -0.19 1.49 0.00 0.00 0.00 179.25 180.63 1j37 h GLU 68 N 0.62 -0.51 -0.80 0.00 4.22 -0.39 -2.54 114.58 115.19 1j37 h GLU 68 Ca 0.16 0.03 0.10 0.00 0.08 0.00 0.00 59.36 59.74 1j37 h GLU 68 Cb 0.11 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 1j37 h GLU 68 CO -0.02 -0.32 0.44 1.25 -2.18 0.00 0.00 179.01 178.18 1j37 h LEU 69 N -0.55 0.61 -1.01 1.64 5.85 -0.38 -1.71 115.31 119.76 1j37 h LEU 69 Ca -0.05 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.83 1j37 h LEU 69 Cb 0.42 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.30 1j37 h LEU 69 CO 0.09 0.35 0.64 0.00 -0.34 0.00 0.00 178.44 179.17 1j37 h ALA 70 N 1.45 1.51 -0.27 1.25 0.00 -0.26 -1.23 119.26 121.71 1j37 h ALA 70 Ca 0.39 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.13 1j37 h ALA 70 Cb 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1j37 h ALA 70 CO -0.26 0.25 -0.57 0.87 0.00 0.00 0.00 179.25 179.55 1j37 h LYS 71 N 1.02 0.84 -0.52 0.00 1.57 -0.92 -2.22 116.57 116.34 1j37 h LYS 71 Ca 0.49 -0.54 0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1j37 h LYS 71 Cb 0.45 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.80 1j37 h LYS 71 CO -0.25 1.17 0.30 0.35 -0.57 0.00 0.00 179.45 180.45 1j37 h PHE 72 N 0.64 0.56 -0.32 -1.35 3.57 -0.93 -1.75 116.94 117.36 1j37 h PHE 72 Ca 0.01 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.56 1j37 h PHE 72 Cb 1.17 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.70 1j37 h PHE 72 CO 0.07 0.31 0.13 0.52 -2.23 0.00 0.00 178.31 177.11 1j37 h MET 73 N 0.59 0.27 -0.69 1.11 2.86 -1.12 0.46 114.93 118.41 1j37 h MET 73 Ca 0.22 -0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.94 1j37 h MET 73 Cb 0.05 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.58 1j37 h MET 73 CO -0.11 0.18 0.32 0.87 1.06 0.00 0.00 176.91 179.23 1j37 h LYS 74 N 0.28 0.53 -0.09 1.72 1.57 -0.95 0.71 116.57 120.34 1j37 h LYS 74 Ca 0.14 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.69 1j37 h LYS 74 Cb 0.09 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1j37 h LYS 74 CO -0.13 0.35 -0.75 1.49 -0.57 0.00 0.00 179.45 179.84 1j37 h GLU 75 N 0.55 0.49 -0.28 3.15 4.57 -0.75 -2.40 114.58 119.92 1j37 h GLU 75 Ca 0.34 -0.41 -0.08 0.00 -1.18 0.00 0.00 59.36 58.04 1j37 h GLU 75 Cb 0.39 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 1j37 h GLU 75 CO -0.28 1.04 -0.17 0.28 -1.18 0.00 0.00 179.01 178.70 1j37 h VAL 76 N 0.33 1.24 -0.35 0.32 2.07 0.83 -2.53 116.25 118.16 1j37 h VAL 76 Ca -0.04 -1.10 -0.11 0.00 0.82 0.00 0.00 66.70 66.27 1j37 h VAL 76 Cb 1.34 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1j37 h VAL 76 CO 0.14 0.36 -0.22 0.00 0.02 0.00 0.00 177.57 177.86 1j37 h ALA 77 N 1.38 0.94 0.00 1.67 0.00 0.61 -3.01 119.26 120.85 1j37 h ALA 77 Ca 0.08 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1j37 h ALA 77 Cb 0.55 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1j37 h ALA 77 CO 0.04 0.61 -0.16 0.66 0.00 0.00 0.00 179.25 180.40 1j37 h SER 78 N 0.61 0.00 0.29 0.00 4.64 -1.23 -3.24 113.55 114.62 1j37 h SER 78 Ca 0.09 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.25 1j37 h SER 78 Cb 0.71 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 1j37 h SER 78 CO 0.05 0.16 -0.61 0.44 -0.87 0.00 0.00 176.83 176.00 1j37 h ASP 79 N 0.00 0.35 0.30 4.97 3.45 -1.33 -2.86 116.42 121.30 1j37 h ASP 79 Ca -0.00 -0.20 0.00 0.00 0.43 0.00 0.00 57.03 57.26 1j37 h ASP 79 Cb 1.10 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.76 1j37 h ASP 79 CO 0.02 0.88 0.00 0.35 -1.57 0.00 0.00 179.24 178.92 1j37 n THR 80 N -3.88 1.37 0.24 0.35 -2.24 -1.17 -1.26 114.28 107.69 1j37 n THR 80 Ca -0.03 0.34 0.10 0.00 -2.27 0.00 0.00 64.05 62.19 1j37 n THR 80 Cb 0.63 -1.19 0.61 0.00 -2.10 0.00 0.00 70.33 68.27 1j37 n THR 80 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1j37 h THR 81 N 0.00 0.75 0.14 4.28 2.02 -1.66 -2.42 112.91 116.02 1j37 h THR 81 Ca 0.00 -0.74 0.02 0.00 0.77 0.00 0.00 66.41 66.46 1j37 h THR 81 Cb 0.15 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 1j37 h THR 81 CO 0.00 0.18 -0.27 0.50 0.37 0.00 0.00 175.52 176.30 1j37 h LYS 82 N 0.00 -0.47 -6.19 6.66 3.64 -1.38 -3.39 116.57 115.44 1j37 h LYS 82 Ca -0.00 0.03 -0.58 0.00 -1.27 0.00 0.00 60.65 58.83 1j37 h LYS 82 Cb 0.43 0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 32.29 1j37 h LYS 82 CO 0.02 -0.31 0.73 -0.06 -2.27 0.00 0.00 179.45 177.56 1j37 s PHE 83 N -6.06 3.14 -1.24 1.91 0.08 -0.91 -4.97 117.98 109.93 1j37 s PHE 83 Ca -0.16 1.04 -0.15 0.00 0.12 0.00 0.00 56.93 57.79 1j37 s PHE 83 Cb 0.08 -3.62 0.15 0.00 -0.57 0.00 0.00 43.02 39.05 1j37 s PHE 83 CO 0.65 -0.76 1.53 0.94 -0.10 0.00 0.00 175.22 177.48 1j37 n GLN 84 N 6.77 3.33 0.22 0.44 -0.06 -1.26 -4.78 117.38 122.04 1j37 n GLN 84 Ca 0.10 -3.70 0.15 0.00 -2.00 0.00 0.00 57.00 51.55 1j37 n GLN 84 Cb 0.47 -3.16 0.52 0.00 -4.06 0.00 0.00 30.24 24.02 1j37 n GLN 84 CO 0.00 0.00 0.00 0.11 -0.20 0.00 0.00 177.06 176.97 1j37 h TRP 85 N 7.21 0.00 0.00 3.69 5.08 -1.93 -2.98 115.95 127.01 1j37 h TRP 85 Ca 0.35 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.32 1j37 h TRP 85 Cb 0.87 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.03 1j37 h TRP 85 CO 1.19 0.00 0.00 0.54 -1.28 0.00 0.00 178.44 178.89 1j37 n ARG 86 N -2.86 0.00 0.00 0.12 5.12 -1.26 -1.60 116.66 116.18 1j37 n ARG 86 Ca 0.02 0.45 0.00 0.00 -1.93 0.00 0.00 57.85 56.39 1j37 n ARG 86 Cb 0.35 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.15 1j37 n ARG 86 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1j37 n SER 87 N -1.50 0.27 -3.59 0.55 2.88 -1.13 -5.09 113.62 106.02 1j37 n SER 87 Ca 0.01 -0.61 -0.17 0.00 -1.33 0.00 0.00 58.87 56.76 1j37 n SER 87 Cb 0.03 0.64 0.14 0.00 -0.75 0.00 0.00 64.21 64.27 1j37 n SER 87 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1j37 n TYR 88 N -0.64 -2.35 0.00 0.66 4.02 -0.63 -5.04 117.16 113.18 1j37 n TYR 88 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1j37 n TYR 88 Cb 0.01 -1.38 0.00 0.00 -0.02 0.00 0.00 39.34 37.95 1j37 n TYR 88 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1j37 n GLN 89 N -1.64 0.00 -2.85 -0.72 -0.00 -1.26 -4.99 117.38 105.92 1j37 n GLN 89 Ca 0.06 0.07 -0.40 0.00 -0.00 0.00 0.00 57.00 56.73 1j37 n GLN 89 Cb 0.33 -0.37 -0.06 0.00 -0.00 0.00 0.00 30.24 30.15 1j37 n GLN 89 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1j37 s SER 90 N -1.95 7.50 0.00 2.61 1.04 -1.26 -5.02 113.70 116.62 1j37 s SER 90 Ca 0.00 1.77 0.00 0.00 0.48 0.00 0.00 55.95 58.20 1j37 s SER 90 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1j37 s SER 90 CO 0.00 0.13 0.00 -0.62 0.98 0.00 0.00 173.24 173.73 1j37 n GLU 91 N 1.85 2.06 0.00 4.02 4.71 -1.26 -2.74 120.64 129.28 1j37 n GLU 91 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.12 1j37 n GLU 91 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.91 1j37 n GLU 91 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1j37 n ASP 92 N 0.00 0.00 0.20 1.62 2.03 -1.26 -3.26 116.55 115.87 1j37 n ASP 92 Ca 0.00 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.17 1j37 n ASP 92 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1j37 n ASP 92 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1j37 h LEU 93 N 0.00 -0.42 -0.21 -2.67 5.85 -2.00 0.75 115.31 116.61 1j37 h LEU 93 Ca 0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1j37 h LEU 93 Cb 0.00 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1j37 h LEU 93 CO 0.00 -0.11 0.00 1.17 -0.34 0.00 0.00 178.44 179.16 1j37 n LYS 94 N -5.20 0.03 -0.02 1.25 4.81 -1.11 -1.67 118.16 116.25 1j37 n LYS 94 Ca -0.10 0.41 -0.18 0.00 -0.87 0.00 0.00 58.31 57.57 1j37 n LYS 94 Cb 0.27 -1.58 -0.14 0.00 0.02 0.00 0.00 35.03 33.60 1j37 n LYS 94 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1j37 n ARG 95 N -1.64 0.72 0.20 1.64 0.63 -0.39 -3.92 116.66 113.90 1j37 n ARG 95 Ca 0.01 0.24 0.04 0.00 -0.92 0.00 0.00 57.85 57.23 1j37 n ARG 95 Cb 0.09 -1.69 0.42 0.00 0.45 0.00 0.00 32.46 31.73 1j37 n ARG 95 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1j37 h GLN 96 N 0.05 0.00 -0.02 -0.14 4.20 0.14 -2.93 115.11 116.41 1j37 h GLN 96 Ca -0.42 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.21 1j37 h GLN 96 Cb 2.02 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.81 1j37 h GLN 96 CO 0.06 0.30 -0.27 0.74 -0.67 0.00 0.00 178.83 178.99 1j37 h PHE 97 N 0.00 0.30 -0.69 2.96 0.04 -1.69 -0.15 116.94 117.71 1j37 h PHE 97 Ca -0.00 -0.15 0.12 0.00 2.80 0.00 0.00 57.97 60.73 1j37 h PHE 97 Cb 0.55 -0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.62 1j37 h PHE 97 CO 0.00 0.93 0.46 -0.22 -0.60 0.00 0.00 178.31 178.88 1j37 h LYS 98 N -0.41 0.45 0.17 1.51 3.64 -1.66 0.12 116.57 120.39 1j37 h LYS 98 Ca -0.03 -0.03 -0.33 0.00 -1.27 0.00 0.00 60.65 58.99 1j37 h LYS 98 Cb 0.99 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 32.72 1j37 h LYS 98 CO 0.05 0.30 -1.64 0.00 -2.27 0.00 0.00 179.45 175.90 1j37 h ALA 99 N 1.66 0.15 0.00 5.00 0.00 -1.52 -3.05 119.26 121.50 1j37 h ALA 99 Ca 0.32 -1.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.11 1j37 h ALA 99 Cb 0.64 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1j37 h ALA 99 CO -0.10 1.01 -0.19 -0.07 0.00 0.00 0.00 179.25 179.91 1j37 h LEU 100 N 0.10 0.00 0.00 0.00 4.07 -0.56 -3.09 115.31 115.83 1j37 h LEU 100 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.66 1j37 h LEU 100 Cb 2.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.82 1j37 h LEU 100 CO 0.19 0.19 -0.77 0.35 -1.08 0.00 0.00 178.44 177.32 1j37 n THR 101 N -3.21 0.23 -2.42 0.22 -2.24 0.37 -4.65 114.28 102.58 1j37 n THR 101 Ca 0.02 -0.22 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 1j37 n THR 101 Cb 0.52 0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 1j37 n THR 101 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1j37 s LYS 102 N -3.15 3.06 -0.16 -0.78 1.02 -1.15 -4.95 119.74 113.64 1j37 s LYS 102 Ca 0.06 -0.09 -0.19 0.00 0.02 0.00 0.00 55.97 55.78 1j37 s LYS 102 Cb 0.14 -4.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.11 1j37 s LYS 102 CO 0.75 -2.32 0.51 -1.17 -0.92 0.00 0.00 175.35 172.21 1j37 s LEU 103 N 6.58 4.21 0.00 3.17 2.96 -1.26 -4.98 118.68 129.37 1j37 s LEU 103 Ca 0.44 0.77 0.00 0.00 -0.22 0.00 0.00 54.13 55.12 1j37 s LEU 103 Cb -0.09 -2.73 0.00 0.00 0.50 0.00 0.00 46.19 43.87 1j37 s LEU 103 CO 0.15 -0.10 0.00 0.61 -1.32 0.00 0.00 176.35 175.69 1j37 n GLY 104 N 3.57 0.57 0.33 7.98 0.00 -1.26 -4.41 105.19 111.98 1j37 n GLY 104 Ca -0.05 -0.03 0.18 0.00 0.00 0.00 0.00 46.02 46.12 1j37 n GLY 104 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1j37 h TYR 105 N 0.00 0.00 0.00 1.61 0.05 -1.97 -1.09 116.97 115.57 1j37 h TYR 105 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1j37 h TYR 105 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1j37 h TYR 105 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.11 1j37 n ALA 106 N -2.20 1.25 0.18 3.88 0.00 -1.26 -1.02 120.51 121.35 1j37 n ALA 106 Ca -0.01 0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.55 1j37 n ALA 106 Cb 0.24 -1.20 0.27 0.00 0.00 0.00 0.00 19.45 18.75 1j37 n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j37 h ALA 107 N 2.14 0.89 -2.90 0.00 0.00 -1.40 -3.44 119.26 114.55 1j37 h ALA 107 Ca 0.00 -0.33 -0.56 0.00 0.00 0.00 0.00 54.91 54.02 1j37 h ALA 107 Cb 0.11 -0.06 0.14 0.00 0.00 0.00 0.00 17.79 17.98 1j37 h ALA 107 CO 0.00 0.46 0.50 1.28 0.00 0.00 0.00 179.25 181.49 1j37 n LEU 108 N -3.38 4.81 -4.66 0.00 4.32 -0.19 -4.97 117.00 112.94 1j37 n LEU 108 Ca 0.01 0.99 -0.30 0.00 -0.02 0.00 0.00 56.01 56.70 1j37 n LEU 108 Cb 0.56 -1.53 0.17 0.00 -1.62 0.00 0.00 43.42 41.00 1j37 n LEU 108 CO 0.37 -0.78 0.64 -2.16 -1.22 0.00 0.00 177.39 174.24 1j37 s PRO 109 N -2.66 0.72 0.20 3.23 0.04 -1.26 -4.60 135.00 130.67 1j37 s PRO 109 Ca 0.69 0.94 -0.19 0.00 0.04 0.00 0.00 61.00 62.48 1j37 s PRO 109 Cb -0.44 -1.74 0.16 0.00 0.04 0.00 0.00 34.50 32.52 1j37 s PRO 109 CO 0.52 -2.64 1.59 1.49 0.04 0.00 0.00 177.00 178.00 1j37 h GLU 110 N -1.85 -0.12 -0.02 4.56 4.81 -1.95 -1.67 114.58 118.34 1j37 h GLU 110 Ca -0.51 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.76 1j37 h GLU 110 Cb 1.29 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.65 1j37 h GLU 110 CO 0.51 -0.08 -0.30 0.38 -0.73 0.00 0.00 179.01 178.80 1j37 h ASP 111 N -0.12 -0.90 -0.46 1.04 2.03 -2.00 -2.64 116.42 113.37 1j37 h ASP 111 Ca 0.26 0.12 -0.07 0.00 -0.73 0.00 0.00 57.03 56.61 1j37 h ASP 111 Cb 0.54 0.37 -0.02 0.00 -0.83 0.00 0.00 39.33 39.39 1j37 h ASP 111 CO -0.68 -0.36 0.03 0.44 -1.03 0.00 0.00 179.24 177.64 1j37 h ASP 112 N -0.43 0.77 -0.74 4.15 3.32 -1.82 -1.69 116.42 119.96 1j37 h ASP 112 Ca 0.07 -0.29 0.08 0.00 0.02 0.00 0.00 57.03 56.91 1j37 h ASP 112 Cb 0.53 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.81 1j37 h ASP 112 CO -0.27 0.87 0.41 0.22 -1.72 0.00 0.00 179.24 178.75 1j37 h TYR 113 N 0.65 0.74 -0.34 4.55 3.20 -1.25 0.47 116.97 124.99 1j37 h TYR 113 Ca 0.13 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 1j37 h TYR 113 Cb 0.45 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 1j37 h TYR 113 CO 0.03 0.31 -0.03 0.00 -1.64 0.00 0.00 178.16 176.84 1j37 h ALA 114 N 1.41 0.46 -0.27 1.82 0.00 -1.32 -0.95 119.26 120.42 1j37 h ALA 114 Ca 0.35 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1j37 h ALA 114 Cb 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1j37 h ALA 114 CO -0.23 0.25 0.01 1.49 0.00 0.00 0.00 179.25 180.76 1j37 h GLU 115 N 0.42 0.40 -0.54 0.00 4.81 -0.29 -1.40 114.58 117.98 1j37 h GLU 115 Ca 0.09 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 1j37 h GLU 115 Cb 0.49 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1j37 h GLU 115 CO 0.02 0.43 -0.04 1.25 -0.73 0.00 0.00 179.01 179.94 1j37 h LEU 116 N 0.39 0.98 -0.76 1.64 5.85 0.32 -1.47 115.31 122.26 1j37 h LEU 116 Ca 0.09 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 1j37 h LEU 116 Cb 0.25 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1j37 h LEU 116 CO 0.01 1.06 0.43 -0.07 -0.34 0.00 0.00 178.44 179.53 1j37 h LEU 117 N 0.86 0.94 0.51 2.25 3.38 -0.46 0.54 115.31 123.34 1j37 h LEU 117 Ca 0.15 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1j37 h LEU 117 Cb 0.59 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.10 1j37 h LEU 117 CO 0.04 0.76 -0.25 0.44 0.09 0.00 0.00 178.44 179.52 1j37 h ASP 118 N 1.05 -0.58 -0.71 -0.43 3.32 -1.06 0.45 116.42 118.47 1j37 h ASP 118 Ca 0.27 -0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.35 1j37 h ASP 118 Cb 0.01 0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 1j37 h ASP 118 CO -0.05 -0.29 0.38 0.00 -1.72 0.00 0.00 179.24 177.56 1j37 h THR 119 N -0.87 0.91 -0.74 0.35 1.03 -1.14 0.13 112.91 112.57 1j37 h THR 119 Ca -0.07 -0.23 0.02 0.00 -0.01 0.00 0.00 66.41 66.12 1j37 h THR 119 Cb 0.60 0.19 -0.04 0.00 -1.07 0.00 0.00 68.15 67.83 1j37 h THR 119 CO 0.12 0.12 0.49 0.25 -0.01 0.00 0.00 175.52 176.49 1j37 h LEU 120 N 0.66 0.82 -0.33 0.00 5.85 0.34 -2.01 115.31 120.65 1j37 h LEU 120 Ca 0.33 -0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.89 1j37 h LEU 120 Cb 0.28 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1j37 h LEU 120 CO -0.23 0.59 -0.35 0.28 -0.34 0.00 0.00 178.44 178.38 1j37 h SER 121 N 0.97 0.89 -0.22 1.25 0.02 0.21 -3.09 113.55 113.58 1j37 h SER 121 Ca 0.28 -0.47 0.06 0.00 -0.84 0.00 0.00 61.79 60.81 1j37 h SER 121 Cb -0.05 -0.25 -0.07 0.00 0.14 0.00 0.00 62.40 62.17 1j37 h SER 121 CO -0.07 1.18 -0.24 0.00 -1.14 0.00 0.00 176.83 176.56 1j37 h ALA 122 N 0.73 -0.15 -0.41 3.77 0.00 -0.10 -2.12 119.26 120.98 1j37 h ALA 122 Ca 0.05 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1j37 h ALA 122 Cb 0.94 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1j37 h ALA 122 CO 0.09 -0.68 0.00 0.52 0.00 0.00 0.00 179.25 179.18 1j37 h MET 123 N -0.26 0.72 -0.00 0.00 2.07 -1.58 -0.84 114.93 115.03 1j37 h MET 123 Ca 0.13 -0.23 0.02 0.00 -2.07 0.00 0.00 59.70 57.56 1j37 h MET 123 Cb 0.46 -0.07 -0.03 0.00 -1.87 0.00 0.00 31.60 30.09 1j37 h MET 123 CO -0.37 0.80 -0.15 1.49 1.07 0.00 0.00 176.91 179.75 1j37 h GLU 124 N 0.55 -0.24 -0.02 1.72 4.81 -1.42 -1.36 114.58 118.61 1j37 h GLU 124 Ca 0.12 0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.21 1j37 h GLU 124 Cb 0.47 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1j37 h GLU 124 CO 0.02 -0.16 -0.69 0.66 -0.73 0.00 0.00 179.01 178.11 1j37 h SER 125 N -0.25 0.15 -0.52 1.04 4.64 -1.42 -2.74 113.55 114.45 1j37 h SER 125 Ca 0.05 -0.10 0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1j37 h SER 125 Cb 0.32 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 1j37 h SER 125 CO -0.15 0.79 0.34 -1.13 -0.87 0.00 0.00 176.83 175.80 1j37 h ASN 126 N 0.08 0.57 0.71 4.97 -0.73 -0.71 0.11 115.58 120.57 1j37 h ASN 126 Ca -0.01 -0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.12 1j37 h ASN 126 Cb 1.22 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 39.67 1j37 h ASN 126 CO 0.10 0.41 -0.48 0.15 -0.37 0.00 0.00 177.43 177.24 1j37 h PHE 127 N 0.68 -1.28 -0.13 0.67 3.57 -1.17 -2.73 116.94 116.54 1j37 h PHE 127 Ca 0.20 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.73 1j37 h PHE 127 Cb -0.05 0.47 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1j37 h PHE 127 CO -0.05 -0.70 0.15 0.00 -2.23 0.00 0.00 178.31 175.49 1j37 h ALA 128 N -1.16 1.71 -0.51 2.41 0.00 -1.34 -2.28 119.26 118.09 1j37 h ALA 128 Ca -0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1j37 h ALA 128 Cb 0.91 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1j37 h ALA 128 CO 0.07 -0.21 0.00 1.63 0.00 0.00 0.00 179.25 180.73 1j37 n LYS 129 N -3.78 2.93 -2.22 0.00 5.02 0.36 -4.84 118.16 115.61 1j37 n LYS 129 Ca 0.00 -2.15 -0.40 0.00 -2.02 0.00 0.00 58.31 53.75 1j37 n LYS 129 Cb 0.26 -1.68 -0.02 0.00 -0.02 0.00 0.00 35.03 33.56 1j37 n LYS 129 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1j37 s VAL 130 N -1.66 2.96 -0.11 -0.18 1.01 -0.86 -5.03 120.40 116.53 1j37 s VAL 130 Ca 0.39 0.92 -0.09 0.00 0.00 0.00 0.00 61.98 63.20 1j37 s VAL 130 Cb 0.24 -3.57 0.04 0.00 0.00 0.00 0.00 36.38 33.09 1j37 s VAL 130 CO 0.20 0.18 0.29 -0.54 0.00 0.00 0.00 175.10 175.23 1j37 s LYS 131 N -1.89 0.31 0.28 2.72 -0.14 -1.26 -4.50 119.74 115.26 1j37 s LYS 131 Ca 0.51 0.47 0.07 0.00 -1.36 0.00 0.00 55.97 55.66 1j37 s LYS 131 Cb -0.36 0.07 -0.06 0.00 -1.68 0.00 0.00 37.83 35.80 1j37 s LYS 131 CO 0.47 -0.08 -0.08 0.14 -0.76 0.00 0.00 175.35 175.03 1j37 s VAL 132 N 0.57 1.79 -0.05 3.17 -7.23 -0.69 -4.95 120.40 113.02 1j37 s VAL 132 Ca -0.03 -2.16 -0.19 0.00 -1.81 0.00 0.00 61.98 57.78 1j37 s VAL 132 Cb -0.05 -2.43 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 1j37 s VAL 132 CO -0.03 -0.32 0.54 0.00 -0.31 0.00 0.00 175.10 174.98 1j37 n ASP 134 N 3.02 2.92 -0.29 0.00 2.03 -1.25 -4.83 116.55 118.15 1j37 n ASP 134 Ca -0.07 1.10 0.32 0.00 0.52 0.00 0.00 54.79 56.66 1j37 n ASP 134 Cb 0.51 -1.41 0.71 0.00 -0.72 0.00 0.00 41.12 40.22 1j37 n ASP 134 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 1j37 h TYR 135 N 5.48 0.09 -0.25 -0.67 3.20 -1.97 -0.31 116.97 122.54 1j37 h TYR 135 Ca -0.45 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.42 1j37 h TYR 135 Cb 1.26 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.51 1j37 h TYR 135 CO 0.61 0.01 0.00 1.63 -1.64 0.00 0.00 178.16 178.77 1j37 n LYS 136 N -4.26 2.80 -2.73 1.82 5.02 -1.26 -4.80 118.16 114.75 1j37 n LYS 136 Ca 0.24 -2.59 -0.04 0.00 -2.02 0.00 0.00 58.31 53.90 1j37 n LYS 136 Cb 1.14 -1.65 0.02 0.00 -0.02 0.00 0.00 35.03 34.52 1j37 n LYS 136 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1j37 n ASP 137 N -0.33 -2.85 0.00 4.39 -0.08 -0.13 -5.01 116.55 112.54 1j37 n ASP 137 Ca 0.18 -2.48 0.00 0.00 -1.51 0.00 0.00 54.79 50.98 1j37 n ASP 137 Cb 0.74 1.49 0.00 0.00 2.34 0.00 0.00 41.12 45.69 1j37 n ASP 137 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1j37 n SER 138 N 2.63 0.00 0.07 1.67 3.41 -1.22 -2.05 113.62 118.12 1j37 n SER 138 Ca 0.15 0.05 -0.21 0.00 -0.26 0.00 0.00 58.87 58.60 1j37 n SER 138 Cb 0.60 -0.05 -0.15 0.00 -0.26 0.00 0.00 64.21 64.35 1j37 n SER 138 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1j37 h THR 139 N 0.00 1.00 0.00 6.66 2.02 -1.95 -3.42 112.91 117.22 1j37 h THR 139 Ca 0.00 -2.60 0.00 0.00 0.77 0.00 0.00 66.41 64.58 1j37 h THR 139 Cb 0.02 2.75 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1j37 h THR 139 CO 0.00 0.84 0.00 0.29 0.37 0.00 0.00 175.52 177.02 1j37 n LYS 140 N -3.53 0.00 -2.01 6.66 5.02 -0.87 -4.89 118.16 118.53 1j37 n LYS 140 Ca -0.22 0.35 -0.21 0.00 -2.02 0.00 0.00 58.31 56.21 1j37 n LYS 140 Cb 1.07 -1.29 -0.05 0.00 -0.02 0.00 0.00 35.03 34.73 1j37 n LYS 140 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j37 n ASP 142 N -1.70 2.14 -4.72 0.00 5.75 -1.21 -4.38 116.55 112.42 1j37 n ASP 142 Ca -0.23 -2.64 -0.42 0.00 -0.01 0.00 0.00 54.79 51.49 1j37 n ASP 142 Cb 0.69 -0.26 -0.03 0.00 -1.03 0.00 0.00 41.12 40.48 1j37 n ASP 142 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1j37 s LEU 143 N -2.09 4.40 0.31 -2.12 1.43 -1.07 -4.89 118.68 114.65 1j37 s LEU 143 Ca 0.19 2.05 0.09 0.00 -1.03 0.00 0.00 54.13 55.43 1j37 s LEU 143 Cb 0.17 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.76 1j37 s LEU 143 CO 0.02 -0.41 0.07 0.00 0.23 0.00 0.00 176.35 176.26 1j37 s ALA 144 N 0.66 3.34 0.08 4.21 0.00 -1.26 -1.70 121.76 127.09 1j37 s ALA 144 Ca 0.56 -1.79 -0.33 0.00 0.00 0.00 0.00 51.96 50.40 1j37 s ALA 144 Cb -0.30 -0.69 -0.16 0.00 0.00 0.00 0.00 23.12 21.97 1j37 s ALA 144 CO 0.31 0.12 1.61 1.25 0.00 0.00 0.00 175.76 179.05 1j37 h LEU 145 N 1.70 -0.97 0.00 0.00 5.85 -1.95 -1.28 115.31 118.66 1j37 h LEU 145 Ca -0.44 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1j37 h LEU 145 Cb 1.25 0.30 0.00 0.00 0.37 0.00 0.00 40.66 42.58 1j37 h LEU 145 CO 0.63 -0.57 0.00 -0.67 -0.34 0.00 0.00 178.44 177.49 1j37 n ASP 146 N -5.50 0.00 0.00 1.25 -0.08 -1.26 -1.07 116.55 109.89 1j37 n ASP 146 Ca -0.12 0.53 0.00 0.00 -1.51 0.00 0.00 54.79 53.69 1j37 n ASP 146 Cb 0.40 -0.03 0.00 0.00 2.34 0.00 0.00 41.12 43.82 1j37 n ASP 146 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1j37 n PRO 147 N -0.83 0.00 0.00 -0.67 -0.04 -1.26 -3.73 135.00 128.48 1j37 n PRO 147 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1j37 n PRO 147 Cb 0.00 -0.35 0.00 0.00 -0.04 0.00 0.00 33.50 33.11 1j37 n PRO 147 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1j37 n GLU 148 N 0.00 0.00 -0.15 0.54 4.71 -1.18 -2.37 120.64 122.19 1j37 n GLU 148 Ca 0.00 0.87 -0.03 0.00 -0.01 0.00 0.00 57.16 57.98 1j37 n GLU 148 Cb 0.00 -1.31 0.06 0.00 -1.01 0.00 0.00 31.44 29.18 1j37 n GLU 148 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1j37 h ILE 149 N 0.00 0.84 0.00 -3.67 2.04 -1.27 -0.62 117.51 114.82 1j37 h ILE 149 Ca 0.00 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1j37 h ILE 149 Cb 0.00 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1j37 h ILE 149 CO 0.00 0.06 -0.02 -0.33 0.00 0.00 0.00 178.15 177.86 1j37 h GLU 150 N 0.35 0.00 0.07 2.37 5.08 -0.97 -1.48 114.58 120.01 1j37 h GLU 150 Ca 0.23 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.31 1j37 h GLU 150 Cb 0.23 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.50 1j37 h GLU 150 CO -0.23 0.02 -1.14 0.93 -1.00 0.00 0.00 179.01 177.59 1j37 h GLU 151 N 0.00 0.58 0.56 2.33 5.08 -0.76 -2.92 114.58 119.46 1j37 h GLU 151 Ca -0.00 -0.71 -0.03 0.00 -1.00 0.00 0.00 59.36 57.62 1j37 h GLU 151 Cb 0.06 0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1j37 h GLU 151 CO 0.00 1.30 -0.27 0.28 -1.00 0.00 0.00 179.01 179.33 1j37 h VAL 152 N 0.28 0.28 -0.97 3.13 2.07 -0.50 -0.36 116.25 120.18 1j37 h VAL 152 Ca -0.15 -0.37 0.25 0.00 0.82 0.00 0.00 66.70 67.25 1j37 h VAL 152 Cb 1.80 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.89 1j37 h VAL 152 CO 0.21 0.04 0.66 0.40 0.02 0.00 0.00 177.57 178.90 1j37 h ILE 153 N -1.04 0.57 0.00 4.57 1.08 -1.43 0.39 117.51 121.65 1j37 h ILE 153 Ca -0.08 -0.09 -0.21 0.00 -0.39 0.00 0.00 64.86 64.10 1j37 h ILE 153 Cb 0.64 0.30 -0.03 0.00 -3.07 0.00 0.00 36.82 34.66 1j37 h ILE 153 CO 0.13 0.05 -1.07 -1.28 -0.69 0.00 0.00 178.15 175.28 1j37 h SER 154 N 0.25 0.00 0.00 1.72 0.87 -1.36 -3.38 113.55 111.65 1j37 h SER 154 Ca 0.50 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.92 1j37 h SER 154 Cb 1.53 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.47 1j37 h SER 154 CO -0.14 0.91 -1.54 0.29 -0.53 0.00 0.00 176.83 175.81 1j37 n LYS 155 N -3.25 1.14 -1.66 2.24 5.02 -0.16 -4.76 118.16 116.72 1j37 n LYS 155 Ca -0.03 0.03 -0.38 0.00 -2.02 0.00 0.00 58.31 55.91 1j37 n LYS 155 Cb 0.92 -1.19 0.05 0.00 -0.02 0.00 0.00 35.03 34.79 1j37 n LYS 155 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1j37 n SER 156 N -2.60 1.45 -1.80 4.39 2.88 0.02 -4.95 113.62 113.01 1j37 n SER 156 Ca -0.15 0.86 -0.01 0.00 -1.33 0.00 0.00 58.87 58.23 1j37 n SER 156 Cb 0.71 -1.46 0.07 0.00 -0.75 0.00 0.00 64.21 62.77 1j37 n SER 156 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1j37 n ARG 157 N -1.12 1.37 -4.00 -1.46 5.12 -1.26 -4.95 116.66 110.36 1j37 n ARG 157 Ca 0.13 -3.03 -0.32 0.00 -1.93 0.00 0.00 57.85 52.71 1j37 n ARG 157 Cb 0.46 -1.13 -0.15 0.00 -1.16 0.00 0.00 32.46 30.49 1j37 n ARG 157 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1j37 s ASP 158 N -3.01 4.79 0.35 0.55 -1.08 -1.26 -4.98 116.67 112.02 1j37 s ASP 158 Ca 0.35 -2.03 0.11 0.00 -0.52 0.00 0.00 52.55 50.46 1j37 s ASP 158 Cb 0.37 -1.65 0.89 0.00 -1.46 0.00 0.00 42.92 41.07 1j37 s ASP 158 CO -0.08 -0.37 1.79 1.12 0.52 0.00 0.00 175.17 178.14 1j37 h HIS 159 N 7.69 0.88 -0.36 -5.34 2.07 -1.96 0.10 115.15 118.23 1j37 h HIS 159 Ca -0.07 0.03 -0.08 0.00 -2.85 0.00 0.00 60.37 57.40 1j37 h HIS 159 Cb 1.03 -0.26 -0.02 0.00 2.57 0.00 0.00 27.41 30.73 1j37 h HIS 159 CO 0.50 0.17 -0.10 0.93 -3.07 0.00 0.00 177.93 176.36 1j37 h GLU 160 N 0.61 0.62 -0.20 5.12 5.08 -1.99 -1.00 114.58 122.83 1j37 h GLU 160 Ca 0.57 -0.18 -0.17 0.00 -1.00 0.00 0.00 59.36 58.57 1j37 h GLU 160 Cb 1.10 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 1j37 h GLU 160 CO -0.33 0.71 -0.59 1.49 -1.00 0.00 0.00 179.01 179.30 1j37 h GLU 161 N 0.58 0.64 0.00 2.33 4.81 -1.25 -1.70 114.58 119.97 1j37 h GLU 161 Ca 0.11 -0.42 -0.08 0.00 -0.13 0.00 0.00 59.36 58.84 1j37 h GLU 161 Cb 0.51 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1j37 h GLU 161 CO 0.03 1.04 -0.37 -0.07 -0.73 0.00 0.00 179.01 178.90 1j37 h LEU 162 N 0.48 0.00 -0.11 1.64 3.38 -1.11 -2.42 115.31 117.16 1j37 h LEU 162 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1j37 h LEU 162 Cb 1.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1j37 h LEU 162 CO 0.11 0.37 -0.06 0.00 0.09 0.00 0.00 178.44 178.95 1j37 h ALA 163 N 1.63 0.16 0.12 1.53 0.00 -0.96 -0.25 119.26 121.49 1j37 h ALA 163 Ca -0.00 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.66 1j37 h ALA 163 Cb 0.77 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1j37 h ALA 163 CO 0.05 -0.05 -0.46 -0.92 0.00 0.00 0.00 179.25 177.86 1j37 h TYR 164 N -0.13 -1.32 0.00 0.00 3.20 -0.98 -0.21 116.97 117.53 1j37 h TYR 164 Ca 0.02 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1j37 h TYR 164 Cb 0.54 0.56 -0.00 0.00 1.54 0.00 0.00 36.73 39.37 1j37 h TYR 164 CO 0.07 -0.55 -0.12 1.88 -1.64 0.00 0.00 178.16 177.79 1j37 h TYR 165 N -0.70 0.00 0.49 -3.82 0.05 -1.46 0.51 116.97 112.06 1j37 h TYR 165 Ca 0.01 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1j37 h TYR 165 Cb 0.72 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.46 1j37 h TYR 165 CO -0.40 0.12 -0.24 2.35 -1.05 0.00 0.00 178.16 178.94 1j37 h TRP 166 N 0.00 -0.62 -0.58 4.88 7.01 -0.29 -2.71 115.95 123.64 1j37 h TRP 166 Ca -0.00 -0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.09 1j37 h TRP 166 Cb 0.30 0.20 -0.08 0.00 -2.10 0.00 0.00 29.16 27.48 1j37 h TRP 166 CO 0.00 -0.38 0.12 -0.09 -2.79 0.00 0.00 178.44 175.29 1j37 h ARG 167 N -1.16 0.24 -0.40 2.65 2.43 -0.92 -1.10 114.38 116.12 1j37 h ARG 167 Ca -0.07 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 1j37 h ARG 167 Cb 0.51 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1j37 h ARG 167 CO 0.11 0.16 0.14 0.93 -1.51 0.00 0.00 179.97 179.80 1j37 h GLU 168 N 0.25 0.58 0.12 0.20 4.39 -0.98 -2.71 114.58 116.43 1j37 h GLU 168 Ca 0.30 -0.08 -0.29 0.00 0.34 0.00 0.00 59.36 59.63 1j37 h GLU 168 Cb 0.44 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1j37 h GLU 168 CO -0.39 0.50 -1.35 0.35 -1.16 0.00 0.00 179.01 176.95 1j37 h PHE 169 N 0.57 0.47 0.00 4.33 3.57 -1.00 -3.31 116.94 121.58 1j37 h PHE 169 Ca 0.14 -0.35 -0.08 0.00 3.53 0.00 0.00 57.97 61.21 1j37 h PHE 169 Cb 0.15 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1j37 h PHE 169 CO 0.01 1.31 -0.40 1.88 -2.23 0.00 0.00 178.31 178.88 1j37 h TYR 170 N 0.07 0.00 -0.02 0.41 -1.99 -1.16 -1.85 116.97 112.43 1j37 h TYR 170 Ca -0.17 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.37 1j37 h TYR 170 Cb 1.99 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.71 1j37 h TYR 170 CO 0.06 0.40 -0.81 -0.44 -0.00 0.00 0.00 178.16 177.37 1j37 h ASP 171 N 0.00 0.29 0.00 3.88 3.32 -1.61 -2.41 116.42 119.90 1j37 h ASP 171 Ca -0.00 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 1j37 h ASP 171 Cb 1.09 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 1j37 h ASP 171 CO 0.05 0.98 -0.40 0.11 -1.72 0.00 0.00 179.24 178.27 1j37 h LYS 172 N 0.14 0.00 -0.00 3.56 1.57 -1.64 -3.01 116.57 117.18 1j37 h LYS 172 Ca -0.04 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 1j37 h LYS 172 Cb 1.41 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.70 1j37 h LYS 172 CO 0.13 0.88 -0.55 0.00 -0.57 0.00 0.00 179.45 179.34 1j37 h ALA 173 N -0.27 1.09 -1.02 3.86 0.00 -1.46 -3.35 119.26 118.10 1j37 h ALA 173 Ca -0.10 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1j37 h ALA 173 Cb 0.99 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1j37 h ALA 173 CO -0.06 0.68 0.00 0.41 0.00 0.00 0.00 179.25 180.28 1j37 n GLY 174 N 0.05 -0.24 0.36 0.00 0.00 -0.91 -3.86 105.19 100.59 1j37 n GLY 174 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1j37 n GLY 174 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j37 n THR 175 N -2.10 -0.59 0.26 2.61 -1.04 0.12 -1.21 114.28 112.34 1j37 n THR 175 Ca 0.00 2.23 0.09 0.00 -2.04 0.00 0.00 64.05 64.33 1j37 n THR 175 Cb 0.00 -2.77 0.37 0.00 -1.82 0.00 0.00 70.33 66.11 1j37 n THR 175 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j37 h ALA 176 N 0.34 1.88 -0.07 2.41 0.00 -1.66 -0.81 119.26 121.35 1j37 h ALA 176 Ca 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1j37 h ALA 176 Cb 0.36 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1j37 h ALA 176 CO -0.81 -0.83 -0.34 1.55 0.00 0.00 0.00 179.25 178.82 1j37 n VAL 177 N -2.78 2.22 -0.11 0.00 3.14 -0.35 -4.78 118.33 115.68 1j37 n VAL 177 Ca 0.02 -2.98 -0.09 0.00 -2.96 0.00 0.00 64.34 58.33 1j37 n VAL 177 Cb 0.82 -0.25 -0.01 0.00 -1.06 0.00 0.00 33.84 33.33 1j37 n VAL 177 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1j37 h ARG 178 N 0.87 0.48 0.21 1.45 2.43 -1.19 -2.29 114.38 116.34 1j37 h ARG 178 Ca 0.04 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1j37 h ARG 178 Cb 1.12 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 1j37 h ARG 178 CO 0.07 0.42 -0.20 0.66 -1.51 0.00 0.00 179.97 179.41 1j37 h SER 179 N 0.42 -0.53 -0.56 -3.80 4.64 -1.86 -0.82 113.55 111.04 1j37 h SER 179 Ca 0.12 0.05 0.06 0.00 -0.47 0.00 0.00 61.79 61.55 1j37 h SER 179 Cb 0.09 0.18 -0.05 0.00 -0.31 0.00 0.00 62.40 62.31 1j37 h SER 179 CO -0.02 -0.30 0.26 1.56 -0.87 0.00 0.00 176.83 177.46 1j37 h GLN 180 N -0.44 0.47 -0.52 4.77 7.50 -1.92 0.72 115.11 125.70 1j37 h GLN 180 Ca -0.00 -0.03 0.07 0.00 0.50 0.00 0.00 58.65 59.19 1j37 h GLN 180 Cb 0.41 -0.11 -0.03 0.00 0.05 0.00 0.00 27.48 27.80 1j37 h GLN 180 CO -0.04 0.31 0.35 0.35 -1.50 0.00 0.00 178.83 178.30 1j37 h PHE 181 N 0.49 0.40 -0.34 2.96 3.57 -0.88 0.21 116.94 123.34 1j37 h PHE 181 Ca 0.26 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.60 1j37 h PHE 181 Cb 0.22 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 1j37 h PHE 181 CO -0.12 0.21 -0.45 1.49 -2.23 0.00 0.00 178.31 177.21 1j37 h GLU 182 N 0.39 0.90 0.00 1.11 4.81 0.57 -2.35 114.58 120.01 1j37 h GLU 182 Ca 0.23 -0.51 -0.05 0.00 -0.13 0.00 0.00 59.36 58.90 1j37 h GLU 182 Cb 0.40 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1j37 h GLU 182 CO -0.06 1.15 -0.23 -0.09 -0.73 0.00 0.00 179.01 179.05 1j37 h ARG 183 N 0.72 0.00 -0.34 1.92 2.43 -0.70 -2.51 114.38 115.90 1j37 h ARG 183 Ca 0.04 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 1j37 h ARG 183 Cb 1.05 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 1j37 h ARG 183 CO 0.10 0.23 -0.02 -0.92 -1.51 0.00 0.00 179.97 177.86 1j37 h TYR 184 N 0.00 0.67 -0.63 2.20 3.20 -0.68 -0.93 116.97 120.80 1j37 h TYR 184 Ca -0.00 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 61.68 1j37 h TYR 184 Cb 0.80 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.87 1j37 h TYR 184 CO 0.00 0.74 0.14 0.28 -1.64 0.00 0.00 178.16 177.68 1j37 h VAL 185 N 0.41 1.26 0.12 1.81 2.07 -1.28 0.10 116.25 120.74 1j37 h VAL 185 Ca 0.09 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.67 1j37 h VAL 185 Cb 0.49 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1j37 h VAL 185 CO 0.02 0.36 -0.14 -0.33 0.02 0.00 0.00 177.57 177.50 1j37 h GLU 186 N 0.93 -0.28 0.00 1.57 5.08 -1.15 0.70 114.58 121.43 1j37 h GLU 186 Ca 0.20 0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.48 1j37 h GLU 186 Cb 0.38 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1j37 h GLU 186 CO 0.01 -0.19 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.31 1j37 h LEU 187 N -0.29 0.00 0.03 1.33 3.38 -1.11 -0.75 115.31 117.90 1j37 h LEU 187 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1j37 h LEU 187 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1j37 h LEU 187 CO -0.05 0.45 -0.01 -1.13 0.09 0.00 0.00 178.44 177.78 1j37 h ASN 188 N 0.00 -0.03 -0.27 -0.43 -0.73 -0.23 -0.01 115.58 113.88 1j37 h ASN 188 Ca -0.00 -0.10 0.00 0.00 1.87 0.00 0.00 56.30 58.07 1j37 h ASN 188 Cb 0.81 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.39 1j37 h ASN 188 CO 0.06 0.08 0.18 0.74 -0.37 0.00 0.00 177.43 178.12 1j37 h THR 189 N -0.14 1.07 -0.35 -3.57 2.02 -0.64 -1.99 112.91 109.31 1j37 h THR 189 Ca -0.00 -0.13 0.06 0.00 0.77 0.00 0.00 66.41 67.10 1j37 h THR 189 Cb 0.13 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.17 1j37 h THR 189 CO 0.01 0.07 0.04 0.50 0.37 0.00 0.00 175.52 176.50 1j37 h LYS 190 N 0.36 0.14 -0.45 6.66 3.64 -0.91 -1.62 116.57 124.40 1j37 h LYS 190 Ca 0.10 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1j37 h LYS 190 Cb -0.04 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1j37 h LYS 190 CO -0.02 0.09 0.27 0.00 -2.27 0.00 0.00 179.45 177.52 1j37 h ALA 191 N 1.29 1.62 -0.06 5.00 0.00 -0.69 -2.27 119.26 124.15 1j37 h ALA 191 Ca 0.17 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1j37 h ALA 191 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1j37 h ALA 191 CO -0.25 0.33 -0.64 0.00 0.00 0.00 0.00 179.25 178.69 1j37 h ALA 192 N 1.68 0.81 0.00 0.00 0.00 -0.56 -2.75 119.26 118.44 1j37 h ALA 192 Ca 0.16 -0.56 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1j37 h ALA 192 Cb -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1j37 h ALA 192 CO -0.03 0.75 -0.37 0.87 0.00 0.00 0.00 179.25 180.47 1j37 h LYS 193 N 0.17 0.00 0.00 0.00 1.57 -1.14 0.11 116.57 117.28 1j37 h LYS 193 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1j37 h LYS 193 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1j37 h LYS 193 CO 0.10 0.37 0.00 -0.11 -0.57 0.00 0.00 179.45 179.24 1j37 n LEU 194 N -3.27 0.00 -0.02 2.94 7.94 -0.88 -2.34 117.00 121.37 1j37 n LEU 194 Ca 0.02 0.20 0.01 0.00 -1.11 0.00 0.00 56.01 55.12 1j37 n LEU 194 Cb 0.63 -0.20 0.01 0.00 0.53 0.00 0.00 43.42 44.39 1j37 n LEU 194 CO 0.38 -0.08 0.44 0.59 -1.11 0.00 0.00 177.39 177.61 1j37 n ASN 195 N -1.20 1.52 -0.22 1.96 3.02 -1.07 -4.99 115.26 114.28 1j37 n ASN 195 Ca 0.10 -1.86 -0.03 0.00 -0.03 0.00 0.00 54.58 52.76 1j37 n ASN 195 Cb 0.12 -0.04 -0.01 0.00 -0.61 0.00 0.00 39.78 39.24 1j37 n ASN 195 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1j37 n ASN 196 N -0.45 -3.04 -4.94 6.41 3.02 -0.99 -5.03 115.26 110.24 1j37 n ASN 196 Ca 0.01 0.05 -0.27 0.00 -0.03 0.00 0.00 54.58 54.34 1j37 n ASN 196 Cb 0.35 -1.06 -0.03 0.00 -0.61 0.00 0.00 39.78 38.43 1j37 n ASN 196 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1j37 s PHE 197 N -2.11 3.49 0.25 3.10 0.08 0.35 -5.01 117.98 118.14 1j37 s PHE 197 Ca 0.00 0.15 -0.04 0.00 0.12 0.00 0.00 56.93 57.16 1j37 s PHE 197 Cb 0.00 -1.69 0.28 0.00 -0.57 0.00 0.00 43.02 41.04 1j37 s PHE 197 CO 0.00 0.54 1.77 1.15 -0.10 0.00 0.00 175.22 178.58 1j37 h THR 198 N 1.75 1.24 -1.93 0.64 2.02 -1.93 -3.27 112.91 111.44 1j37 h THR 198 Ca -0.48 -0.91 0.10 0.00 0.77 0.00 0.00 66.41 65.90 1j37 h THR 198 Cb 1.19 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 1j37 h THR 198 CO 0.71 0.34 0.33 -1.54 0.37 0.00 0.00 175.52 175.73 1j37 n SER 199 N -4.25 -0.77 0.22 4.18 3.41 -1.26 -4.78 113.62 110.38 1j37 n SER 199 Ca 0.04 -1.35 0.07 0.00 -0.26 0.00 0.00 58.87 57.37 1j37 n SER 199 Cb 0.25 1.24 0.52 0.00 -0.26 0.00 0.00 64.21 65.96 1j37 n SER 199 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1j37 h GLY 200 N 0.96 0.00 0.79 5.00 0.00 -1.81 -2.79 103.07 105.22 1j37 h GLY 200 Ca -0.12 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 1j37 h GLY 200 CO 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 176.54 176.33 1j37 h ALA 201 N 1.76 -1.26 -0.00 3.60 0.00 -1.87 -2.44 119.26 119.06 1j37 h ALA 201 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1j37 h ALA 201 Cb 0.48 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1j37 h ALA 201 CO 0.03 -1.18 0.00 0.93 0.00 0.00 0.00 179.25 179.03 1j37 h GLU 202 N -1.09 0.00 -0.00 0.00 4.39 -1.93 -1.93 114.58 114.02 1j37 h GLU 202 Ca -0.11 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.38 1j37 h GLU 202 Cb 0.81 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1j37 h GLU 202 CO 0.18 0.00 -0.91 0.00 -1.16 0.00 0.00 179.01 177.12 1j37 h ALA 203 N 1.99 0.42 0.03 3.43 0.00 -1.27 -2.39 119.26 121.47 1j37 h ALA 203 Ca 0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 1j37 h ALA 203 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1j37 h ALA 203 CO -0.00 0.84 -0.02 -1.49 0.00 0.00 0.00 179.25 178.58 1j37 h TRP 204 N 0.20 -0.04 -0.97 0.00 6.55 -0.87 -3.18 115.95 117.64 1j37 h TRP 204 Ca -0.07 -0.00 0.21 0.00 0.95 0.00 0.00 58.89 59.98 1j37 h TRP 204 Cb 1.54 0.01 -0.09 0.00 -0.86 0.00 0.00 29.16 29.77 1j37 h TRP 204 CO 0.05 0.45 0.62 -0.07 -1.05 0.00 0.00 178.44 178.44 1j37 h LEU 205 N -0.55 0.56 -1.87 -4.49 3.38 -1.54 0.11 115.31 110.92 1j37 h LEU 205 Ca -0.00 0.07 0.25 0.00 0.09 0.00 0.00 57.88 58.29 1j37 h LEU 205 Cb 0.51 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1j37 h LEU 205 CO 0.01 0.20 0.65 -0.78 0.09 0.00 0.00 178.44 178.60 1j37 h ASP 206 N 0.54 0.10 0.03 -0.43 3.58 -1.40 0.90 116.42 119.76 1j37 h ASP 206 Ca 0.53 0.01 0.00 0.00 0.42 0.00 0.00 57.03 58.00 1j37 h ASP 206 Cb 1.13 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.17 1j37 h ASP 206 CO -0.27 0.04 0.00 -0.33 -2.88 0.00 0.00 179.24 175.79 1j37 h GLU 207 N 0.10 0.00 -0.19 0.28 4.39 -0.89 -0.02 114.58 118.25 1j37 h GLU 207 Ca 0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.15 1j37 h GLU 207 Cb 1.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.27 1j37 h GLU 207 CO -0.06 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.45 1j37 n TYR 208 N -2.51 0.22 -4.04 4.33 4.01 0.31 -4.43 117.16 115.05 1j37 n TYR 208 Ca -0.02 -0.11 -0.36 0.00 -0.16 0.00 0.00 57.90 57.24 1j37 n TYR 208 Cb 0.05 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.07 1j37 n TYR 208 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1j37 n GLU 209 N 1.37 -0.51 -3.15 -0.72 1.02 -0.02 -4.91 120.64 113.71 1j37 n GLU 209 Ca 0.16 -0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.34 1j37 n GLU 209 Cb 0.59 -2.25 -0.01 0.00 -0.02 0.00 0.00 31.44 29.74 1j37 n GLU 209 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1j37 s ASP 210 N -3.88 -1.43 0.35 1.62 3.68 -1.26 -5.03 116.67 110.72 1j37 s ASP 210 Ca 0.30 0.75 0.20 0.00 2.13 0.00 0.00 52.55 55.93 1j37 s ASP 210 Cb -0.17 2.14 1.07 0.00 -1.45 0.00 0.00 42.92 44.51 1j37 s ASP 210 CO 0.84 -0.27 1.56 0.44 0.13 0.00 0.00 175.17 177.88 1j37 h ASP 211 N 8.00 0.00 -0.17 -0.34 3.32 -1.96 -1.10 116.42 124.18 1j37 h ASP 211 Ca -0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1j37 h ASP 211 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1j37 h ASP 211 CO 0.24 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 178.11 1j37 n THR 212 N -2.23 1.85 0.25 0.35 -2.24 -1.26 -4.82 114.28 106.17 1j37 n THR 212 Ca -0.01 -1.77 -0.16 0.00 -2.27 0.00 0.00 64.05 59.84 1j37 n THR 212 Cb 0.15 -0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.23 1j37 n THR 212 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1j37 h PHE 213 N 1.12 -1.21 -0.92 4.78 3.57 -1.60 -1.44 116.94 121.25 1j37 h PHE 213 Ca 0.00 0.01 0.24 0.00 3.53 0.00 0.00 57.97 61.75 1j37 h PHE 213 Cb 1.11 0.47 -0.13 0.00 2.79 0.00 0.00 35.95 40.19 1j37 h PHE 213 CO 0.26 -0.58 0.40 1.49 -2.23 0.00 0.00 178.31 177.65 1j37 h GLU 214 N -0.87 0.34 -0.34 1.11 4.81 -1.88 0.16 114.58 117.91 1j37 h GLU 214 Ca -0.06 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.04 1j37 h GLU 214 Cb 0.76 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1j37 h GLU 214 CO -0.05 0.23 -0.27 0.37 -0.73 0.00 0.00 179.01 178.56 1j37 h GLN 215 N 0.35 0.70 -0.88 1.92 5.75 -1.85 0.16 115.11 121.26 1j37 h GLN 215 Ca 0.60 -0.29 0.02 0.00 -0.15 0.00 0.00 58.65 58.82 1j37 h GLN 215 Cb 1.19 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.67 1j37 h GLN 215 CO -0.57 0.89 0.58 1.96 -2.65 0.00 0.00 178.83 179.04 1j37 h GLN 216 N 0.60 1.14 -0.25 1.69 4.20 0.36 0.31 115.11 123.16 1j37 h GLN 216 Ca 0.08 -0.07 -0.18 0.00 0.06 0.00 0.00 58.65 58.54 1j37 h GLN 216 Cb 0.77 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1j37 h GLN 216 CO 0.06 0.75 -0.55 -0.07 -0.67 0.00 0.00 178.83 178.36 1j37 h LEU 217 N 1.17 0.84 -1.34 1.46 3.38 -0.81 -1.69 115.31 118.32 1j37 h LEU 217 Ca 0.33 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 1j37 h LEU 217 Cb -0.10 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1j37 h LEU 217 CO -0.08 1.22 -0.04 -0.08 0.09 0.00 0.00 178.44 179.54 1j37 h GLU 218 N 0.58 0.39 0.52 1.13 4.57 -0.05 -1.77 114.58 119.94 1j37 h GLU 218 Ca 0.01 -0.08 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 1j37 h GLU 218 Cb 1.13 -0.06 0.01 0.00 -0.16 0.00 0.00 28.75 29.67 1j37 h GLU 218 CO 0.12 0.45 -0.25 -0.44 -1.18 0.00 0.00 179.01 177.71 1j37 h ASP 219 N 0.37 -0.59 -1.00 1.04 5.19 -0.68 -2.86 116.42 117.90 1j37 h ASP 219 Ca 0.08 -0.05 0.10 0.00 -0.62 0.00 0.00 57.03 56.54 1j37 h ASP 219 Cb 0.32 0.15 -0.08 0.00 0.18 0.00 0.00 39.33 39.90 1j37 h ASP 219 CO 0.01 -0.21 0.63 0.40 -3.12 0.00 0.00 179.24 176.95 1j37 h ILE 220 N -1.05 0.97 -0.48 0.35 2.04 -1.24 0.72 117.51 118.81 1j37 h ILE 220 Ca -0.07 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 1j37 h ILE 220 Cb 0.61 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1j37 h ILE 220 CO 0.12 0.19 0.22 0.15 0.00 0.00 0.00 178.15 178.83 1j37 h PHE 221 N 1.04 0.67 -0.48 1.37 3.57 -1.35 -1.89 116.94 119.87 1j37 h PHE 221 Ca 0.48 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.92 1j37 h PHE 221 Cb 0.39 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1j37 h PHE 221 CO -0.01 0.50 0.14 0.00 -2.23 0.00 0.00 178.31 176.71 1j37 h ALA 222 N 1.57 1.34 -0.09 2.41 0.00 -0.62 0.19 119.26 124.06 1j37 h ALA 222 Ca 0.17 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1j37 h ALA 222 Cb 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1j37 h ALA 222 CO -0.02 0.47 -0.67 -0.44 0.00 0.00 0.00 179.25 178.59 1j37 h ASP 223 N 0.69 0.43 0.82 0.00 3.32 -0.92 -3.23 116.42 117.54 1j37 h ASP 223 Ca 0.16 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1j37 h ASP 223 Cb 0.23 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1j37 h ASP 223 CO -0.01 0.97 -1.04 -0.38 -1.72 0.00 0.00 179.24 177.07 1j37 n ILE 224 N -3.86 0.47 -0.11 0.35 -0.00 -0.98 -4.34 119.36 110.90 1j37 n ILE 224 Ca -0.03 -0.47 -0.07 0.00 -0.00 0.00 0.00 62.75 62.18 1j37 n ILE 224 Cb 0.67 -0.21 -0.00 0.00 -0.00 0.00 0.00 39.64 40.09 1j37 n ILE 224 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.55 176.46 1j37 h ARG 225 N 0.00 -0.20 -0.79 0.38 2.43 -0.64 0.11 114.38 115.67 1j37 h ARG 225 Ca 0.00 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.37 1j37 h ARG 225 Cb 0.93 0.04 -0.14 0.00 -0.42 0.00 0.00 29.97 30.38 1j37 h ARG 225 CO 0.00 -0.13 -0.01 -1.35 -1.51 0.00 0.00 179.97 176.97 1j37 h PRO 226 N -0.21 0.08 -0.36 0.20 0.11 -1.76 1.65 132.00 131.73 1j37 h PRO 226 Ca 0.18 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.30 1j37 h PRO 226 Cb 0.49 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 1j37 h PRO 226 CO -0.50 0.06 0.20 1.25 -0.21 0.00 0.00 178.00 178.80 1j37 h LEU 227 N 0.09 0.32 -2.15 2.35 6.46 -1.27 -1.15 115.31 119.95 1j37 h LEU 227 Ca 0.44 0.01 0.03 0.00 -0.12 0.00 0.00 57.88 58.23 1j37 h LEU 227 Cb 0.78 -0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.64 1j37 h LEU 227 CO -0.71 0.24 0.07 0.22 -0.62 0.00 0.00 178.44 177.64 1j37 h TYR 228 N 0.42 0.00 -2.06 1.25 3.20 0.46 -2.96 116.97 117.27 1j37 h TYR 228 Ca 0.14 0.00 -0.79 0.00 3.14 0.00 0.00 58.73 61.23 1j37 h TYR 228 Cb 0.02 0.00 -0.25 0.00 1.54 0.00 0.00 36.73 38.03 1j37 h TYR 228 CO -0.08 0.00 1.16 1.04 -1.64 0.00 0.00 178.16 178.64 1j37 n GLN 229 N -4.24 4.76 0.00 1.82 6.02 0.14 -2.60 117.38 123.28 1j37 n GLN 229 Ca -0.01 -4.26 0.00 0.00 -0.01 0.00 0.00 57.00 52.72 1j37 n GLN 229 Cb 0.18 -2.44 0.00 0.00 1.02 0.00 0.00 30.24 29.01 1j37 n GLN 229 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1j37 n GLN 230 N 0.04 0.00 0.07 -1.09 1.13 -1.12 -4.79 117.38 111.62 1j37 n GLN 230 Ca 0.50 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 55.35 1j37 n GLN 230 Cb 0.26 -0.08 -0.15 0.00 0.11 0.00 0.00 30.24 30.39 1j37 n GLN 230 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1j37 h ILE 231 N 0.00 1.42 0.53 5.09 2.04 -1.59 -3.01 117.51 121.98 1j37 h ILE 231 Ca 0.00 -2.56 -0.02 0.00 1.00 0.00 0.00 64.86 63.28 1j37 h ILE 231 Cb 0.00 3.13 -0.02 0.00 -0.74 0.00 0.00 36.82 39.19 1j37 h ILE 231 CO 0.00 0.74 -0.48 -0.74 0.00 0.00 0.00 178.15 177.67 1j37 h HIS 232 N -0.25 -1.32 -0.21 1.37 2.76 -1.79 0.28 115.15 115.99 1j37 h HIS 232 Ca -0.18 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 57.99 1j37 h HIS 232 Cb 1.77 0.51 -0.01 0.00 1.55 0.00 0.00 27.41 31.23 1j37 h HIS 232 CO 0.18 -0.66 0.13 0.78 -1.30 0.00 0.00 177.93 177.05 1j37 h GLY 233 N -1.00 0.30 0.50 5.26 0.00 -1.77 -1.29 103.07 105.06 1j37 h GLY 233 Ca -0.06 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1j37 h GLY 233 CO -0.04 0.11 -0.02 -1.82 0.00 0.00 0.00 176.54 174.78 1j37 h TYR 234 N 0.29 -0.06 -0.76 5.60 5.03 -1.32 -0.83 116.97 124.92 1j37 h TYR 234 Ca 0.08 -0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.44 1j37 h TYR 234 Cb -0.01 0.02 -0.06 0.00 1.55 0.00 0.00 36.73 38.23 1j37 h TYR 234 CO 0.00 0.42 0.46 0.28 -1.32 0.00 0.00 178.16 178.00 1j37 h VAL 235 N -0.56 1.03 -0.29 1.81 2.07 -0.76 0.06 116.25 119.62 1j37 h VAL 235 Ca -0.01 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1j37 h VAL 235 Cb 0.50 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1j37 h VAL 235 CO 0.01 0.16 0.07 -0.09 0.02 0.00 0.00 177.57 177.74 1j37 h ARG 236 N 0.85 0.41 -0.03 1.57 2.43 -1.21 -0.29 114.38 118.11 1j37 h ARG 236 Ca 0.33 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1j37 h ARG 236 Cb 0.14 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1j37 h ARG 236 CO -0.16 0.38 0.01 0.35 -1.51 0.00 0.00 179.97 179.03 1j37 h PHE 237 N 0.41 0.05 -0.07 2.20 3.57 0.51 -1.81 116.94 121.80 1j37 h PHE 237 Ca 0.10 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 1j37 h PHE 237 Cb 0.16 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 1j37 h PHE 237 CO 0.00 0.27 -0.05 0.00 -2.23 0.00 0.00 178.31 176.30 1j37 h ARG 238 N -0.19 0.16 -0.52 1.11 2.47 -1.13 -1.11 114.38 115.17 1j37 h ARG 238 Ca 0.01 -0.08 0.09 0.00 -1.26 0.00 0.00 59.98 58.75 1j37 h ARG 238 Cb 0.24 -0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.49 1j37 h ARG 238 CO 0.00 0.56 0.09 -0.07 0.56 0.00 0.00 179.97 181.12 1j37 h LEU 239 N -0.25 -0.03 -1.22 3.04 3.38 -1.11 0.71 115.31 119.84 1j37 h LEU 239 Ca 0.01 0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1j37 h LEU 239 Cb 0.53 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1j37 h LEU 239 CO 0.01 0.01 -0.31 -0.09 0.09 0.00 0.00 178.44 178.16 1j37 h ARG 240 N 0.23 0.14 -0.11 1.13 2.43 -1.32 0.83 114.38 117.71 1j37 h ARG 240 Ca 0.26 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 59.19 1j37 h ARG 240 Cb 0.37 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1j37 h ARG 240 CO -0.35 0.44 -0.73 -0.22 -1.51 0.00 0.00 179.97 177.59 1j37 h LYS 241 N 0.13 0.52 0.00 0.20 3.64 0.44 -0.55 116.57 120.95 1j37 h LYS 241 Ca 0.02 -0.42 -0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1j37 h LYS 241 Cb 0.61 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1j37 h LYS 241 CO 0.04 1.05 -0.01 1.25 -2.27 0.00 0.00 179.45 179.51 1j37 h HIS 242 N 0.36 0.00 0.00 1.91 2.76 0.77 -3.37 115.15 117.58 1j37 h HIS 242 Ca -0.03 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.08 1j37 h HIS 242 Cb 1.32 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.27 1j37 h HIS 242 CO 0.06 0.84 -0.59 1.88 -1.30 0.00 0.00 177.93 178.81 1j37 h TYR 243 N -1.00 0.00 0.00 5.26 0.05 0.54 -3.50 116.97 118.31 1j37 h TYR 243 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1j37 h TYR 243 Cb 0.84 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.58 1j37 h TYR 243 CO 0.23 0.21 0.00 0.41 -1.05 0.00 0.00 178.16 177.96 1j37 n GLY 244 N 1.20 2.35 0.12 3.88 0.00 -0.21 -4.47 105.19 108.05 1j37 n GLY 244 Ca 0.00 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.01 1j37 n GLY 244 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1j37 h ASP 245 N 0.00 -0.23 -0.36 1.61 5.19 -1.69 0.43 116.42 121.37 1j37 h ASP 245 Ca 0.00 0.05 0.08 0.00 -0.62 0.00 0.00 57.03 56.54 1j37 h ASP 245 Cb 0.00 0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1j37 h ASP 245 CO 0.00 -0.10 0.25 0.00 -3.12 0.00 0.00 179.24 176.27 1j37 h ALA 246 N 0.98 2.20 0.08 3.45 0.00 -1.94 -3.08 119.26 120.96 1j37 h ALA 246 Ca 0.06 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.60 1j37 h ALA 246 Cb 0.18 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1j37 h ALA 246 CO -0.14 -0.29 -2.07 0.28 0.00 0.00 0.00 179.25 177.03 1j37 n VAL 247 N -4.46 1.68 -4.28 0.00 0.31 -0.98 -4.86 118.33 105.74 1j37 n VAL 247 Ca 0.05 -0.57 -0.29 0.00 -0.01 0.00 0.00 64.34 63.52 1j37 n VAL 247 Cb 0.36 -1.70 -0.17 0.00 -0.91 0.00 0.00 33.84 31.43 1j37 n VAL 247 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1j37 s VAL 248 N -2.53 1.48 0.11 2.52 1.01 0.11 -4.92 120.40 118.18 1j37 s VAL 248 Ca -0.27 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1j37 s VAL 248 Cb 0.07 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1j37 s VAL 248 CO 0.70 0.44 0.22 -0.94 0.00 0.00 0.00 175.10 175.52 1j37 s SER 249 N 1.19 6.15 0.64 3.32 1.04 -1.25 -4.01 113.70 120.80 1j37 s SER 249 Ca -0.02 0.15 -0.13 0.00 0.48 0.00 0.00 55.95 56.42 1j37 s SER 249 Cb -0.14 -1.82 -0.01 0.00 0.10 0.00 0.00 66.02 64.14 1j37 s SER 249 CO -0.05 0.11 1.06 -0.70 0.98 0.00 0.00 173.24 174.64 1j37 s GLU 250 N -2.87 3.14 0.00 4.02 2.56 -1.26 -3.59 118.70 120.69 1j37 s GLU 250 Ca 0.34 1.07 0.00 0.00 0.00 0.00 0.00 54.97 56.37 1j37 s GLU 250 Cb -0.12 -2.01 0.00 0.00 2.00 0.00 0.00 34.13 34.00 1j37 s GLU 250 CO 0.27 -0.95 0.00 0.25 -0.56 0.00 0.00 175.26 174.27 1j37 n THR 251 N -2.59 0.00 -2.87 -1.70 -2.24 -1.26 -4.94 114.28 98.68 1j37 n THR 251 Ca 0.08 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.63 1j37 n THR 251 Cb 0.53 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.78 1j37 n THR 251 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1j37 s GLY 252 N -1.58 1.59 0.66 3.38 0.00 -1.24 -1.76 107.32 108.37 1j37 s GLY 252 Ca 0.00 -1.02 -0.15 0.00 0.00 0.00 0.00 44.72 43.55 1j37 s GLY 252 CO 0.00 -0.83 1.12 -4.14 0.00 0.00 0.00 173.10 169.25 1j37 s PRO 253 N -4.63 2.79 -0.05 2.90 0.02 -1.26 -4.84 135.00 129.93 1j37 s PRO 253 Ca 0.50 1.42 -0.30 0.00 0.02 0.00 0.00 61.00 62.64 1j37 s PRO 253 Cb -0.10 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 1j37 s PRO 253 CO 0.39 -1.26 1.31 0.42 -0.33 0.00 0.00 177.00 177.54 1j37 s ILE 254 N -2.30 4.01 0.04 2.83 1.01 0.12 -4.71 121.20 122.20 1j37 s ILE 254 Ca 0.68 1.34 -0.30 0.00 0.00 0.00 0.00 60.65 62.36 1j37 s ILE 254 Cb -0.21 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.32 1j37 s ILE 254 CO 0.41 -0.03 1.68 -2.84 0.00 0.00 0.00 174.94 174.16 1j37 s PRO 255 N 2.61 4.19 0.00 2.79 0.02 -1.26 -1.60 135.00 141.75 1j37 s PRO 255 Ca 0.60 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.94 1j37 s PRO 255 Cb -0.27 -3.73 0.00 0.00 0.02 0.00 0.00 34.50 30.52 1j37 s PRO 255 CO 0.23 -0.78 0.00 -1.33 -0.33 0.00 0.00 177.00 174.79 1j37 n MET 256 N 6.10 2.89 0.00 5.54 2.81 -0.25 -3.64 117.12 130.57 1j37 n MET 256 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 1j37 n MET 256 Cb 0.41 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.92 1j37 n MET 256 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 1j37 n HIS 257 N 0.00 0.00 0.40 2.03 1.44 -1.26 -3.88 115.22 113.94 1j37 n HIS 257 Ca 0.00 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.77 1j37 n HIS 257 Cb 0.00 -0.33 -0.08 0.00 0.12 0.00 0.00 29.99 29.71 1j37 n HIS 257 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1j37 n LEU 258 N 0.00 0.40 -0.26 2.39 4.77 -1.24 -4.46 117.00 118.60 1j37 n LEU 258 Ca 0.00 -0.35 0.09 0.00 -0.03 0.00 0.00 56.01 55.72 1j37 n LEU 258 Cb 0.00 0.00 0.41 0.00 -2.33 0.00 0.00 43.42 41.50 1j37 n LEU 258 CO 0.00 0.10 0.78 0.18 -1.33 0.00 0.00 177.39 177.12 1j37 n LEU 259 N -1.48 0.77 -0.04 2.23 4.77 -1.25 -4.92 117.00 117.08 1j37 n LEU 259 Ca 0.01 -0.33 -0.01 0.00 -0.03 0.00 0.00 56.01 55.65 1j37 n LEU 259 Cb 0.23 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1j37 n LEU 259 CO 0.25 0.17 -0.01 0.61 -1.33 0.00 0.00 177.39 177.08 1j37 n GLY 260 N 0.92 0.48 3.16 -0.72 0.00 -1.26 -4.32 105.19 103.44 1j37 n GLY 260 Ca 0.13 -0.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1j37 n GLY 260 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1j37 s ASN 261 N -2.31 -0.36 0.45 1.61 3.84 -1.26 -4.16 114.94 112.75 1j37 s ASN 261 Ca 0.00 0.67 0.28 0.00 0.21 0.00 0.00 52.86 54.02 1j37 s ASN 261 Cb 0.00 0.59 1.33 0.00 -0.55 0.00 0.00 41.25 42.62 1j37 s ASN 261 CO 0.00 -0.16 1.72 -0.03 -2.79 0.00 0.00 177.10 175.84 1j37 h MET 262 N 6.77 0.19 -0.02 0.43 1.85 -1.94 0.11 114.93 122.32 1j37 h MET 262 Ca -0.36 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 58.72 1j37 h MET 262 Cb 1.17 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 33.16 1j37 h MET 262 CO 0.33 0.12 0.00 0.91 -0.40 0.00 0.00 176.91 177.88 1j37 n TRP 263 N -4.51 0.01 -1.66 1.39 8.01 -1.26 -4.86 117.44 114.56 1j37 n TRP 263 Ca 0.30 -0.02 -0.20 0.00 -1.31 0.00 0.00 57.50 56.27 1j37 n TRP 263 Cb 1.19 -0.00 -0.08 0.00 -2.01 0.00 0.00 31.31 30.41 1j37 n TRP 263 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1j37 n ALA 264 N 0.32 -0.33 0.25 6.99 0.00 0.38 -4.87 120.51 123.25 1j37 n ALA 264 Ca 0.04 0.30 0.12 0.00 0.00 0.00 0.00 53.44 53.89 1j37 n ALA 264 Cb 0.16 -1.98 0.62 0.00 0.00 0.00 0.00 19.45 18.25 1j37 n ALA 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1j37 h GLN 265 N 0.00 0.00 -3.75 0.00 3.07 -1.93 -3.44 115.11 109.06 1j37 h GLN 265 Ca -0.41 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.14 1j37 h GLN 265 Cb 1.29 0.00 -0.25 0.00 0.08 0.00 0.00 27.48 28.60 1j37 h GLN 265 CO 0.58 0.16 -0.67 -0.65 0.09 0.00 0.00 178.83 178.35 1j37 s GLN 266 N -3.94 0.18 0.00 0.06 -0.21 -1.26 -3.55 119.66 110.94 1j37 s GLN 266 Ca -0.01 -0.23 0.05 0.00 0.02 0.00 0.00 55.36 55.19 1j37 s GLN 266 Cb 0.12 0.07 0.03 0.00 1.00 0.00 0.00 33.01 34.23 1j37 s GLN 266 CO 0.60 -0.03 0.63 0.91 -2.12 0.00 0.00 175.29 175.28 1j37 n TRP 267 N 2.39 0.00 -0.25 0.91 8.01 0.05 -4.37 117.44 124.17 1j37 n TRP 267 Ca -0.17 0.00 0.31 0.00 -1.31 0.00 0.00 57.50 56.33 1j37 n TRP 267 Cb 0.58 0.00 0.72 0.00 -2.01 0.00 0.00 31.31 30.60 1j37 n TRP 267 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1j37 h SER 268 N 0.98 0.03 0.00 -0.99 4.64 -1.84 -1.11 113.55 115.25 1j37 h SER 268 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1j37 h SER 268 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1j37 h SER 268 CO 0.00 0.01 0.02 -0.33 -0.87 0.00 0.00 176.83 175.66 1j37 h GLU 269 N 0.03 0.00 -0.81 4.77 4.39 -1.85 -1.53 114.58 119.57 1j37 h GLU 269 Ca 0.50 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.62 1j37 h GLU 269 Cb 1.95 0.00 -0.37 0.00 -0.10 0.00 0.00 28.75 30.23 1j37 h GLU 269 CO -0.02 0.00 -0.27 0.44 -1.16 0.00 0.00 179.01 178.00 1j37 n ILE 270 N -2.34 2.87 0.23 3.13 -5.35 -0.42 -4.57 119.36 112.91 1j37 n ILE 270 Ca -0.02 -3.77 0.13 0.00 -0.27 0.00 0.00 62.75 58.83 1j37 n ILE 270 Cb 0.06 -1.11 0.25 0.00 -1.74 0.00 0.00 39.64 37.10 1j37 n ILE 270 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1j37 h ALA 271 N 2.08 1.00 0.00 -1.28 0.00 -1.45 -2.56 119.26 117.04 1j37 h ALA 271 Ca 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1j37 h ALA 271 Cb 1.32 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1j37 h ALA 271 CO 1.00 0.00 0.00 0.38 0.00 0.00 0.00 179.25 180.63 1j37 h ASP 272 N 0.00 0.00 0.00 0.00 2.03 -1.83 -1.84 116.42 114.78 1j37 h ASP 272 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1j37 h ASP 272 Cb 0.92 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.42 1j37 h ASP 272 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 179.24 180.51 1j37 n ILE 273 N -2.64 0.00 -0.24 4.15 -5.35 -1.15 -4.80 119.36 109.33 1j37 n ILE 273 Ca 0.01 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 1j37 n ILE 273 Cb 0.25 1.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.15 1j37 n ILE 273 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34 1j37 n VAL 274 N -0.82 0.00 -2.33 7.28 3.14 -0.98 -4.77 118.33 119.86 1j37 n VAL 274 Ca 0.00 -0.33 -0.41 0.00 -2.96 0.00 0.00 64.34 60.64 1j37 n VAL 274 Cb 0.00 1.24 -0.03 0.00 -1.06 0.00 0.00 33.84 33.98 1j37 n VAL 274 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1j37 s SER 275 N -0.19 7.06 0.59 6.55 1.04 -0.69 -4.90 113.70 123.14 1j37 s SER 275 Ca 0.00 2.41 0.33 0.00 0.48 0.00 0.00 55.95 59.17 1j37 s SER 275 Cb 0.00 -2.63 1.83 0.00 0.10 0.00 0.00 66.02 65.32 1j37 s SER 275 CO 0.00 -0.33 2.21 1.55 0.98 0.00 0.00 173.24 177.65 1j37 h PRO 276 N 4.02 0.00 -2.24 4.02 0.13 -1.96 -3.32 132.00 132.65 1j37 h PRO 276 Ca -0.47 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.08 1j37 h PRO 276 Cb 1.22 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.95 1j37 h PRO 276 CO 0.68 0.04 -0.95 1.19 -0.23 0.00 0.00 178.00 178.73 1j37 n PHE 277 N -3.51 0.30 0.23 1.56 3.72 -1.26 -4.86 117.46 113.64 1j37 n PHE 277 Ca -0.02 -3.62 0.12 0.00 -0.05 0.00 0.00 57.45 53.87 1j37 n PHE 277 Cb 0.15 -0.20 0.36 0.00 -0.94 0.00 0.00 39.48 38.85 1j37 n PHE 277 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1j37 h PRO 278 N 4.67 0.00 0.06 -1.08 0.13 -1.91 -3.02 132.00 130.85 1j37 h PRO 278 Ca 0.16 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1j37 h PRO 278 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1j37 h PRO 278 CO 0.50 0.11 -0.03 0.93 -0.23 0.00 0.00 178.00 179.29 1j37 h GLU 279 N 0.00 -0.08 -7.10 0.86 5.08 -1.92 -3.43 114.58 107.99 1j37 h GLU 279 Ca -0.00 0.01 -0.52 0.00 -1.00 0.00 0.00 59.36 57.85 1j37 h GLU 279 Cb 0.86 0.02 0.10 0.00 0.50 0.00 0.00 28.75 30.22 1j37 h GLU 279 CO 0.01 0.39 0.45 0.15 -1.00 0.00 0.00 179.01 179.01 1j37 s LYS 280 N -4.16 3.10 0.06 2.33 -0.14 -1.14 -4.85 119.74 114.93 1j37 s LYS 280 Ca -0.15 1.73 -0.37 0.00 -1.36 0.00 0.00 55.97 55.82 1j37 s LYS 280 Cb 0.01 -1.96 -0.18 0.00 -1.68 0.00 0.00 37.83 34.02 1j37 s LYS 280 CO 0.63 -1.08 1.07 -0.35 -0.76 0.00 0.00 175.35 174.86 1j37 n PRO 281 N -1.52 0.37 -3.93 -1.68 -0.04 -1.26 -4.90 135.00 122.03 1j37 n PRO 281 Ca 0.13 0.13 -0.35 0.00 -0.04 0.00 0.00 63.50 63.37 1j37 n PRO 281 Cb 0.50 -1.61 -0.09 0.00 -0.04 0.00 0.00 33.50 32.27 1j37 n PRO 281 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1j37 s LEU 282 N 0.51 3.98 -1.32 1.53 1.43 -1.26 -4.95 118.68 118.60 1j37 s LEU 282 Ca 0.85 0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 53.94 1j37 s LEU 282 Cb -1.12 -2.00 0.04 0.00 0.03 0.00 0.00 46.19 43.14 1j37 s LEU 282 CO 0.54 0.21 1.92 0.52 0.23 0.00 0.00 176.35 179.77 1j37 n VAL 283 N 3.31 3.56 -3.17 -1.59 0.31 -1.26 -4.71 118.33 114.79 1j37 n VAL 283 Ca -0.17 -3.51 -0.26 0.00 -0.01 0.00 0.00 64.34 60.39 1j37 n VAL 283 Cb 0.52 -2.42 -0.06 0.00 -0.91 0.00 0.00 33.84 30.98 1j37 n VAL 283 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1j37 n ASP 284 N 8.02 3.74 0.34 4.52 9.92 -1.26 -4.90 116.55 136.92 1j37 n ASP 284 Ca 0.50 -3.49 0.17 0.00 -0.53 0.00 0.00 54.79 51.44 1j37 n ASP 284 Cb 0.44 -0.61 0.92 0.00 -0.64 0.00 0.00 41.12 41.22 1j37 n ASP 284 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1j37 h VAL 285 N 2.88 0.00 -0.97 2.53 2.07 -1.84 -3.18 116.25 117.74 1j37 h VAL 285 Ca 0.15 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.96 1j37 h VAL 285 Cb 0.62 0.75 -0.18 0.00 -1.52 0.00 0.00 31.29 30.96 1j37 h VAL 285 CO 0.79 0.00 0.13 -1.28 0.02 0.00 0.00 177.57 177.23 1j37 h SER 286 N 0.00 -0.30 1.37 0.57 0.87 -1.92 0.09 113.55 114.23 1j37 h SER 286 Ca 0.00 0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.73 1j37 h SER 286 Cb 0.50 0.42 -0.01 0.00 -0.44 0.00 0.00 62.40 62.86 1j37 h SER 286 CO 0.00 -0.33 -0.65 0.00 -0.53 0.00 0.00 176.83 175.31 1j37 h ALA 287 N 1.95 0.70 0.00 6.23 0.00 -1.93 -3.12 119.26 123.09 1j37 h ALA 287 Ca 0.62 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1j37 h ALA 287 Cb 1.34 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1j37 h ALA 287 CO -0.86 0.55 0.00 0.93 0.00 0.00 0.00 179.25 179.87 1j37 h GLU 288 N 0.00 0.00 0.11 0.00 4.39 -1.27 -2.54 114.58 115.27 1j37 h GLU 288 Ca -0.03 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1j37 h GLU 288 Cb 1.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.99 1j37 h GLU 288 CO 0.05 0.00 -0.05 0.52 -1.16 0.00 0.00 179.01 178.37 1j37 h MET 289 N 0.00 -0.14 -0.87 2.33 2.86 -1.10 -2.77 114.93 115.25 1j37 h MET 289 Ca 0.00 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1j37 h MET 289 Cb 0.83 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.47 1j37 h MET 289 CO 0.00 0.37 0.57 1.49 1.06 0.00 0.00 176.91 180.40 1j37 h GLU 290 N -0.79 1.05 -0.02 1.72 4.81 -1.50 -1.79 114.58 118.06 1j37 h GLU 290 Ca -0.01 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 1j37 h GLU 290 Cb 0.57 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1j37 h GLU 290 CO 0.02 0.69 -0.44 0.87 -0.73 0.00 0.00 179.01 179.43 1j37 h LYS 291 N 1.08 0.05 -0.14 1.92 1.57 -1.52 -2.74 116.57 116.79 1j37 h LYS 291 Ca 0.35 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1j37 h LYS 291 Cb 0.03 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1j37 h LYS 291 CO -0.10 0.49 0.00 1.04 -0.57 0.00 0.00 179.45 180.30 1j37 n GLN 292 N -4.01 1.44 -2.50 3.15 6.02 -0.72 -4.89 117.38 115.86 1j37 n GLN 292 Ca -0.02 -0.67 -0.14 0.00 -0.01 0.00 0.00 57.00 56.16 1j37 n GLN 292 Cb 0.47 -1.26 0.01 0.00 1.02 0.00 0.00 30.24 30.49 1j37 n GLN 292 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1j37 n ALA 293 N -0.04 -0.52 -1.77 -1.58 0.00 -1.03 -4.97 120.51 110.60 1j37 n ALA 293 Ca 0.11 0.15 -0.40 0.00 0.00 0.00 0.00 53.44 53.30 1j37 n ALA 293 Cb 0.19 -2.16 0.02 0.00 0.00 0.00 0.00 19.45 17.50 1j37 n ALA 293 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1j37 s TYR 294 N -2.82 2.43 0.15 0.00 4.12 -0.91 -5.02 117.35 115.30 1j37 s TYR 294 Ca 0.09 1.24 0.06 0.00 0.02 0.00 0.00 57.07 58.48 1j37 s TYR 294 Cb -0.04 -3.96 -0.04 0.00 -1.52 0.00 0.00 41.96 36.40 1j37 s TYR 294 CO 0.12 -3.04 -0.13 0.95 0.02 0.00 0.00 175.55 173.47 1j37 s THR 295 N -1.19 1.40 0.18 -0.71 -4.23 -1.26 -4.87 115.64 104.96 1j37 s THR 295 Ca 0.61 -1.93 -0.19 0.00 -1.18 0.00 0.00 61.69 58.99 1j37 s THR 295 Cb -0.45 -1.75 0.12 0.00 1.34 0.00 0.00 72.50 71.77 1j37 s THR 295 CO 0.58 -0.54 1.62 -0.65 -0.54 0.00 0.00 174.62 175.08 1j37 h PRO 296 N 3.09 -0.13 -0.36 3.99 0.11 -1.93 -0.13 132.00 136.64 1j37 h PRO 296 Ca -0.39 0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.80 1j37 h PRO 296 Cb 1.20 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.28 1j37 h PRO 296 CO 0.57 -0.09 -0.03 1.25 -0.21 0.00 0.00 178.00 179.49 1j37 h LEU 297 N -0.13 -0.22 -1.24 2.35 5.85 -1.97 -0.93 115.31 119.02 1j37 h LEU 297 Ca 0.22 0.09 0.03 0.00 0.84 0.00 0.00 57.88 59.06 1j37 h LEU 297 Cb 0.48 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 1j37 h LEU 297 CO -0.55 -0.07 0.53 0.50 -0.34 0.00 0.00 178.44 178.51 1j37 h LYS 298 N 0.06 0.96 -0.64 1.25 1.63 -1.62 -1.41 116.57 116.80 1j37 h LYS 298 Ca 0.18 -0.06 -0.09 0.00 -0.85 0.00 0.00 60.65 59.83 1j37 h LYS 298 Cb 0.25 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1j37 h LYS 298 CO -0.32 0.63 0.04 0.52 -3.45 0.00 0.00 179.45 176.87 1j37 h MET 299 N 0.99 1.10 -0.42 1.90 2.86 0.21 -0.57 114.93 121.00 1j37 h MET 299 Ca 0.32 -0.33 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 1j37 h MET 299 Cb 0.04 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1j37 h MET 299 CO -0.09 1.04 -0.02 0.74 1.06 0.00 0.00 176.91 179.64 1j37 h PHE 300 N 1.01 0.82 -0.75 -0.22 0.04 -0.63 -0.58 116.94 116.63 1j37 h PHE 300 Ca 0.19 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1j37 h PHE 300 Cb 0.52 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 38.42 1j37 h PHE 300 CO 0.04 0.83 0.47 1.96 -0.60 0.00 0.00 178.31 181.00 1j37 h GLN 301 N 0.58 1.00 -0.45 1.51 4.20 -1.08 0.68 115.11 121.55 1j37 h GLN 301 Ca 0.12 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 1j37 h GLN 301 Cb 0.51 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1j37 h GLN 301 CO 0.03 0.68 -0.08 0.52 -0.67 0.00 0.00 178.83 179.31 1j37 h MET 302 N 1.02 0.78 -0.02 1.46 2.86 -0.75 -1.56 114.93 118.72 1j37 h MET 302 Ca 0.27 -0.25 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 1j37 h MET 302 Cb -0.07 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 1j37 h MET 302 CO -0.05 0.84 -0.57 0.78 1.06 0.00 0.00 176.91 178.97 1j37 h GLY 303 N 0.97 0.07 0.92 8.32 0.00 0.72 -2.88 103.07 111.19 1j37 h GLY 303 Ca 0.13 -0.08 -0.06 0.00 0.00 0.00 0.00 47.33 47.32 1j37 h GLY 303 CO 0.03 0.07 0.01 -1.80 0.00 0.00 0.00 176.54 174.85 1j37 h ASP 304 N 0.05 0.62 -0.60 0.19 3.58 0.76 -3.22 116.42 117.80 1j37 h ASP 304 Ca -0.00 -0.30 0.10 0.00 0.42 0.00 0.00 57.03 57.25 1j37 h ASP 304 Cb 1.02 -0.17 -0.08 0.00 1.72 0.00 0.00 39.33 41.82 1j37 h ASP 304 CO 0.08 0.78 0.17 0.44 -2.88 0.00 0.00 179.24 177.83 1j37 h ASP 305 N 0.46 0.11 -0.22 2.28 5.19 -1.10 -2.50 116.42 120.63 1j37 h ASP 305 Ca 0.10 0.10 0.04 0.00 -0.62 0.00 0.00 57.03 56.65 1j37 h ASP 305 Cb 0.45 0.11 -0.04 0.00 0.18 0.00 0.00 39.33 40.03 1j37 h ASP 305 CO 0.02 0.06 -0.02 0.15 -3.12 0.00 0.00 179.24 176.33 1j37 h PHE 306 N 0.32 -0.04 0.02 4.55 3.57 -1.53 0.29 116.94 124.12 1j37 h PHE 306 Ca 0.31 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.83 1j37 h PHE 306 Cb 0.43 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.22 1j37 h PHE 306 CO -0.21 -0.05 -0.01 0.74 -2.23 0.00 0.00 178.31 176.55 1j37 h PHE 307 N 0.05 -0.02 -0.32 0.41 0.04 -1.55 -2.18 116.94 113.36 1j37 h PHE 307 Ca 0.10 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.84 1j37 h PHE 307 Cb 0.14 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 1j37 h PHE 307 CO -0.20 0.01 0.06 1.79 -0.60 0.00 0.00 178.31 179.37 1j37 h THR 308 N -0.04 1.16 -0.57 -1.55 1.35 -1.25 0.70 112.91 112.72 1j37 h THR 308 Ca -0.00 -0.59 0.12 0.00 -0.55 0.00 0.00 66.41 65.39 1j37 h THR 308 Cb 0.04 0.86 -0.03 0.00 -1.73 0.00 0.00 68.15 67.29 1j37 h THR 308 CO 0.00 0.21 0.39 0.28 -0.25 0.00 0.00 175.52 176.15 1j37 h SER 309 N 0.46 0.21 -0.53 5.36 0.02 0.20 0.72 113.55 119.98 1j37 h SER 309 Ca 0.11 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1j37 h SER 309 Cb 0.22 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1j37 h SER 309 CO -0.00 0.12 0.00 0.23 -1.14 0.00 0.00 176.83 176.04 1j37 n MET 310 N -4.44 2.95 -1.28 3.45 2.00 -0.41 -3.81 117.12 115.58 1j37 n MET 310 Ca 0.10 -2.22 -0.10 0.00 0.00 0.00 0.00 57.70 55.49 1j37 n MET 310 Cb 0.48 -1.68 -0.04 0.00 0.00 0.00 0.00 33.22 31.97 1j37 n MET 310 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1j37 n ASN 311 N 0.94 -4.47 -4.92 7.83 4.05 0.25 -3.67 115.26 115.27 1j37 n ASN 311 Ca 0.20 0.24 -0.27 0.00 0.45 0.00 0.00 54.58 55.20 1j37 n ASN 311 Cb 0.67 -2.83 0.07 0.00 1.23 0.00 0.00 39.78 38.92 1j37 n ASN 311 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1j37 s LEU 312 N -2.22 2.72 0.31 1.20 1.43 0.11 -4.97 118.68 117.26 1j37 s LEU 312 Ca 0.00 0.57 -0.29 0.00 -1.03 0.00 0.00 54.13 53.39 1j37 s LEU 312 Cb 0.00 -3.18 -0.10 0.00 0.03 0.00 0.00 46.19 42.95 1j37 s LEU 312 CO 0.00 -1.68 1.13 -0.89 0.23 0.00 0.00 176.35 175.13 1j37 s THR 313 N -3.35 3.37 0.42 5.49 2.01 -1.26 -4.00 115.64 118.32 1j37 s THR 313 Ca 0.61 1.33 -0.14 0.00 0.31 0.00 0.00 61.69 63.80 1j37 s THR 313 Cb -0.11 -3.83 -0.08 0.00 0.01 0.00 0.00 72.50 68.50 1j37 s THR 313 CO 0.46 0.28 0.83 -1.59 -0.69 0.00 0.00 174.62 173.92 1j37 s LYS 314 N -1.65 3.91 0.16 4.92 0.00 -1.26 -4.62 119.74 121.19 1j37 s LYS 314 Ca 0.47 0.69 -0.32 0.00 0.00 0.00 0.00 55.97 56.82 1j37 s LYS 314 Cb -0.32 -2.31 -0.10 0.00 0.00 0.00 0.00 37.83 35.09 1j37 s LYS 314 CO 0.41 -0.06 1.63 -0.51 0.00 0.00 0.00 175.35 176.83 1j37 s LEU 315 N -3.67 4.37 0.91 2.77 1.02 -1.26 -5.00 118.68 117.82 1j37 s LEU 315 Ca 0.55 2.66 -0.12 0.00 0.02 0.00 0.00 54.13 57.24 1j37 s LEU 315 Cb -0.10 -3.59 0.14 0.00 0.02 0.00 0.00 46.19 42.66 1j37 s LEU 315 CO 0.27 -0.88 1.10 -2.16 0.02 0.00 0.00 176.35 174.71 1j37 s PRO 316 N 1.44 1.13 0.43 1.29 0.04 -1.26 -4.96 135.00 133.11 1j37 s PRO 316 Ca 0.72 0.56 0.12 0.00 0.04 0.00 0.00 61.00 62.44 1j37 s PRO 316 Cb -0.45 -1.82 0.93 0.00 0.04 0.00 0.00 34.50 33.21 1j37 s PRO 316 CO 0.32 -2.26 1.98 0.37 0.04 0.00 0.00 177.00 177.45 1j37 h GLN 317 N -1.55 0.13 0.00 4.56 5.75 -1.95 -2.56 115.11 119.50 1j37 h GLN 317 Ca -0.51 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 57.89 1j37 h GLN 317 Cb 1.31 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.82 1j37 h GLN 317 CO 0.58 0.25 -0.39 -0.44 -2.65 0.00 0.00 178.83 176.19 1j37 h ASP 318 N 0.13 0.00 0.44 -0.69 3.45 -1.90 -2.79 116.42 115.06 1j37 h ASP 318 Ca 0.03 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.47 1j37 h ASP 318 Cb 0.28 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.06 1j37 h ASP 318 CO 0.02 0.39 -0.21 0.15 -1.57 0.00 0.00 179.24 178.01 1j37 h PHE 319 N 0.00 -0.55 0.00 4.55 3.57 -1.49 0.34 116.94 123.36 1j37 h PHE 319 Ca -0.00 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 1j37 h PHE 319 Cb 0.71 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1j37 h PHE 319 CO 0.00 -0.33 -0.23 -1.49 -2.23 0.00 0.00 178.31 174.03 1j37 h TRP 320 N -0.62 0.00 0.22 0.41 4.06 -1.63 0.15 115.95 118.54 1j37 h TRP 320 Ca -0.06 0.00 -0.29 0.00 2.06 0.00 0.00 58.89 60.59 1j37 h TRP 320 Cb 0.47 0.00 0.03 0.00 -1.00 0.00 0.00 29.16 28.66 1j37 h TRP 320 CO -0.04 0.23 -1.30 -0.44 -3.56 0.00 0.00 178.44 173.33 1j37 h ASP 321 N 0.00 0.73 0.28 -3.49 3.32 -1.21 -3.39 116.42 112.67 1j37 h ASP 321 Ca -0.00 -0.93 -0.13 0.00 0.02 0.00 0.00 57.03 55.98 1j37 h ASP 321 Cb 0.51 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 1j37 h ASP 321 CO 0.03 1.62 -1.84 0.29 -1.72 0.00 0.00 179.24 177.62 1j37 n LYS 322 N -3.84 0.65 -1.94 3.56 5.02 0.12 -4.97 118.16 116.76 1j37 n LYS 322 Ca -0.16 -0.01 -0.40 0.00 -2.02 0.00 0.00 58.31 55.72 1j37 n LYS 322 Cb 1.02 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 1j37 n LYS 322 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1j37 s SER 323 N -5.17 6.14 -0.31 4.39 0.01 0.51 -4.89 113.70 114.37 1j37 s SER 323 Ca -0.06 2.77 -0.08 0.00 1.31 0.00 0.00 55.95 59.89 1j37 s SER 323 Cb 0.10 -2.65 0.01 0.00 0.21 0.00 0.00 66.02 63.70 1j37 s SER 323 CO 0.85 -0.98 0.12 -0.63 0.41 0.00 0.00 173.24 173.01 1j37 s ILE 324 N -1.23 4.22 -0.21 1.44 1.01 -0.41 -4.96 121.20 121.06 1j37 s ILE 324 Ca 0.58 -0.67 0.14 0.00 0.00 0.00 0.00 60.65 60.71 1j37 s ILE 324 Cb -0.41 -3.21 0.32 0.00 0.01 0.00 0.00 42.46 39.17 1j37 s ILE 324 CO 0.52 0.01 1.22 2.30 0.00 0.00 0.00 174.94 178.99 1j37 n ILE 325 N 4.91 1.78 -3.65 2.92 -5.35 -1.26 -0.51 119.36 118.21 1j37 n ILE 325 Ca -0.14 -1.81 -0.10 0.00 -0.27 0.00 0.00 62.75 60.43 1j37 n ILE 325 Cb 0.48 -0.05 -0.08 0.00 -1.74 0.00 0.00 39.64 38.25 1j37 n ILE 325 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1j37 s GLU 326 N -2.37 0.70 -0.27 6.28 2.12 -0.75 -3.85 118.70 120.56 1j37 s GLU 326 Ca 0.29 1.06 -0.38 0.00 0.36 0.00 0.00 54.97 56.30 1j37 s GLU 326 Cb 0.24 0.22 -0.14 0.00 0.26 0.00 0.00 34.13 34.70 1j37 s GLU 326 CO 0.06 -0.13 1.89 1.17 -0.54 0.00 0.00 175.26 177.70 1j37 n LYS 327 N 3.67 1.27 -1.42 4.30 4.81 -1.26 -4.86 118.16 124.66 1j37 n LYS 327 Ca -0.18 0.44 -0.42 0.00 -0.87 0.00 0.00 58.31 57.29 1j37 n LYS 327 Cb 0.57 -2.26 0.01 0.00 0.02 0.00 0.00 35.03 33.37 1j37 n LYS 327 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1j37 n PRO 328 N 6.33 0.46 0.00 1.64 -0.02 -1.26 -4.89 135.00 137.25 1j37 n PRO 328 Ca 0.30 0.17 0.12 0.00 -2.02 0.00 0.00 63.50 62.07 1j37 n PRO 328 Cb 0.17 -1.42 0.23 0.00 -0.02 0.00 0.00 33.50 32.47 1j37 n PRO 328 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1j37 n THR 329 N -0.93 0.00 -2.16 3.45 -2.24 -1.26 -4.95 114.28 106.19 1j37 n THR 329 Ca 0.11 -0.30 -0.27 0.00 -2.27 0.00 0.00 64.05 61.33 1j37 n THR 329 Cb 0.40 0.96 0.11 0.00 -2.10 0.00 0.00 70.33 69.71 1j37 n THR 329 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1j37 s ASP 330 N -2.23 4.16 -0.13 3.42 1.47 -1.26 -4.94 116.67 117.17 1j37 s ASP 330 Ca 0.27 0.28 0.01 0.00 1.18 0.00 0.00 52.55 54.29 1j37 s ASP 330 Cb 0.20 -0.67 0.17 0.00 -0.34 0.00 0.00 42.92 42.28 1j37 s ASP 330 CO 0.43 -2.04 1.34 0.61 0.68 0.00 0.00 175.17 176.19 1j37 n GLY 331 N -3.21 2.76 3.90 2.12 0.00 -1.26 -4.89 105.19 104.60 1j37 n GLY 331 Ca 0.12 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1j37 n GLY 331 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1j37 s ARG 332 N -0.89 3.66 0.18 1.61 1.70 -1.26 -5.07 118.95 118.87 1j37 s ARG 332 Ca 0.15 0.21 -0.06 0.00 -0.47 0.00 0.00 55.73 55.57 1j37 s ARG 332 Cb 0.13 -2.48 -0.06 0.00 -0.57 0.00 0.00 34.95 31.97 1j37 s ARG 332 CO 0.03 0.01 0.43 -0.51 -1.08 0.00 0.00 175.30 174.18 1j37 s ASP 333 N -3.45 6.51 0.20 -2.89 -0.00 -1.26 -5.01 116.67 110.77 1j37 s ASP 333 Ca 0.47 0.67 -0.24 0.00 -0.00 0.00 0.00 52.55 53.45 1j37 s ASP 333 Cb -0.10 -2.12 0.05 0.00 -0.00 0.00 0.00 42.92 40.74 1j37 s ASP 333 CO 0.34 0.00 0.86 -1.48 -0.00 0.00 0.00 175.17 174.89 1j37 s LEU 334 N -2.79 -0.22 -0.21 1.23 -0.00 -1.26 -0.62 118.68 114.80 1j37 s LEU 334 Ca 0.43 -0.46 -0.13 0.00 -0.00 0.00 0.00 54.13 53.97 1j37 s LEU 334 Cb -0.12 2.38 -0.05 0.00 -0.00 0.00 0.00 46.19 48.41 1j37 s LEU 334 CO 0.24 -1.06 0.25 -0.69 -0.00 0.00 0.00 176.35 175.09 1j37 s VAL 335 N -3.53 5.31 -0.17 1.48 1.01 -0.88 -4.89 120.40 118.73 1j37 s VAL 335 Ca 0.11 0.40 0.16 0.00 0.00 0.00 0.00 61.98 62.65 1j37 s VAL 335 Cb -0.03 -3.59 0.40 0.00 0.00 0.00 0.00 36.38 33.16 1j37 s VAL 335 CO 0.03 0.33 1.27 0.00 0.00 0.00 0.00 175.10 176.73 1j37 s HIS 337 N -2.97 2.55 0.11 0.00 2.46 -1.26 -4.34 115.29 111.85 1j37 s HIS 337 Ca 0.37 0.22 -0.14 0.00 0.47 0.00 0.00 55.06 55.98 1j37 s HIS 337 Cb 0.32 -4.48 -0.08 0.00 -0.13 0.00 0.00 32.58 28.21 1j37 s HIS 337 CO 0.03 -1.68 0.23 0.00 -2.47 0.00 0.00 174.74 170.85 1j37 n ALA 338 N 8.53 -1.97 -3.44 1.58 0.00 -1.26 -4.99 120.51 118.95 1j37 n ALA 338 Ca 0.06 0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.59 1j37 n ALA 338 Cb 0.49 -0.80 -0.02 0.00 0.00 0.00 0.00 19.45 19.12 1j37 n ALA 338 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1j37 s SER 339 N -0.50 -0.52 -0.01 0.00 1.04 -1.10 -5.04 113.70 107.57 1j37 s SER 339 Ca 0.32 0.01 0.08 0.00 0.48 0.00 0.00 55.95 56.84 1j37 s SER 339 Cb -0.45 0.54 -0.02 0.00 0.10 0.00 0.00 66.02 66.20 1j37 s SER 339 CO 0.28 -0.87 -0.26 0.00 0.98 0.00 0.00 173.24 173.37 1j37 s ALA 340 N -3.54 2.14 -0.08 5.32 0.00 -1.26 -1.69 121.76 122.64 1j37 s ALA 340 Ca 0.02 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 50.89 1j37 s ALA 340 Cb -0.01 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 1j37 s ALA 340 CO -0.12 0.52 -0.21 -1.58 0.00 0.00 0.00 175.76 174.38 1j37 s TRP 341 N -0.63 2.58 -0.39 0.00 0.52 0.23 -4.99 118.94 116.26 1j37 s TRP 341 Ca 0.10 -0.69 -0.08 0.00 0.02 0.00 0.00 56.10 55.45 1j37 s TRP 341 Cb -0.10 -1.68 0.06 0.00 -1.15 0.00 0.00 33.47 30.60 1j37 s TRP 341 CO -0.00 -0.20 0.20 0.34 0.02 0.00 0.00 176.95 177.31 1j37 s ASP 342 N -0.03 5.54 0.00 2.95 3.68 -1.26 -2.30 116.67 125.24 1j37 s ASP 342 Ca -0.06 -1.34 0.06 0.00 2.13 0.00 0.00 52.55 53.34 1j37 s ASP 342 Cb -0.15 -1.95 0.22 0.00 -1.45 0.00 0.00 42.92 39.59 1j37 s ASP 342 CO 0.05 -0.45 1.17 0.49 0.13 0.00 0.00 175.17 176.56 1j37 n PHE 343 N 4.88 0.20 -3.87 -5.34 3.72 -1.09 -4.94 117.46 111.02 1j37 n PHE 343 Ca -0.11 -0.10 -0.28 0.00 -0.05 0.00 0.00 57.45 56.91 1j37 n PHE 343 Cb 0.44 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 1j37 n PHE 343 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1j37 n TYR 344 N -0.07 -1.71 -0.05 1.38 4.02 -1.26 -4.53 117.16 114.93 1j37 n TYR 344 Ca 0.06 0.62 0.00 0.00 -0.01 0.00 0.00 57.90 58.58 1j37 n TYR 344 Cb 0.14 -3.62 0.00 0.00 -0.02 0.00 0.00 39.34 35.84 1j37 n TYR 344 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1j37 n LEU 345 N -4.37 0.00 -3.93 7.72 4.77 -1.26 -4.75 117.00 115.18 1j37 n LEU 345 Ca -0.24 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.44 1j37 n LEU 345 Cb 0.65 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.58 1j37 n LEU 345 CO 0.73 0.00 -0.42 -0.63 -1.33 0.00 0.00 177.39 175.73 1j37 s ILE 346 N 2.16 1.45 -0.27 -0.08 1.01 -1.26 -4.74 121.20 119.47 1j37 s ILE 346 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 59.53 1j37 s ILE 346 Cb 0.00 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.76 1j37 s ILE 346 CO 0.00 -0.07 0.00 0.47 0.00 0.00 0.00 174.94 175.34 1j37 n ASP 347 N 4.71 -3.47 -4.20 3.58 10.43 -1.26 -5.00 116.55 121.34 1j37 n ASP 347 Ca -0.12 0.06 -0.41 0.00 2.57 0.00 0.00 54.79 56.89 1j37 n ASP 347 Cb 0.45 -1.20 -0.06 0.00 1.84 0.00 0.00 41.12 42.15 1j37 n ASP 347 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1j37 s ASP 348 N -2.67 6.02 -0.01 -2.24 2.15 -1.26 -4.27 116.67 114.40 1j37 s ASP 348 Ca 0.00 -2.91 0.05 0.00 0.43 0.00 0.00 52.55 50.11 1j37 s ASP 348 Cb 0.00 -2.02 -0.01 0.00 -0.30 0.00 0.00 42.92 40.59 1j37 s ASP 348 CO 0.00 -0.43 -0.15 0.68 -0.17 0.00 0.00 175.17 175.10 1j37 s VAL 349 N -0.16 1.16 0.01 1.11 -7.23 -1.26 -2.68 120.40 111.35 1j37 s VAL 349 Ca 0.19 -0.67 -0.09 0.00 -1.81 0.00 0.00 61.98 59.61 1j37 s VAL 349 Cb -0.14 -0.98 0.00 0.00 0.56 0.00 0.00 36.38 35.82 1j37 s VAL 349 CO -0.07 0.30 0.17 -0.13 -0.31 0.00 0.00 175.10 175.07 1j37 s ARG 350 N -0.42 0.56 0.13 4.82 0.52 -0.97 -3.51 118.95 120.08 1j37 s ARG 350 Ca 0.05 -0.44 0.10 0.00 -0.52 0.00 0.00 55.73 54.92 1j37 s ARG 350 Cb -0.06 0.23 -0.04 0.00 0.52 0.00 0.00 34.95 35.61 1j37 s ARG 350 CO -0.00 -0.14 -0.21 0.42 0.02 0.00 0.00 175.30 175.38 1j37 s ILE 351 N -1.69 2.64 -0.20 1.52 1.01 -1.26 0.78 121.20 124.00 1j37 s ILE 351 Ca -0.12 -1.65 -0.01 0.00 0.00 0.00 0.00 60.65 58.87 1j37 s ILE 351 Cb -0.06 -2.21 0.06 0.00 0.01 0.00 0.00 42.46 40.26 1j37 s ILE 351 CO 0.01 0.06 -0.01 -0.75 0.00 0.00 0.00 174.94 174.24 1j37 s LYS 352 N -2.22 1.12 -0.02 2.79 2.20 -0.68 -1.29 119.74 121.64 1j37 s LYS 352 Ca 0.18 -0.61 -0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1j37 s LYS 352 Cb -0.10 -2.22 0.00 0.00 -1.51 0.00 0.00 37.83 34.01 1j37 s LYS 352 CO 0.09 -0.58 0.05 -1.14 -0.36 0.00 0.00 175.35 173.41 1j37 s GLN 353 N 1.66 0.08 -0.42 4.03 0.74 0.34 -2.71 119.66 123.38 1j37 s GLN 353 Ca -0.02 0.02 -0.02 0.00 0.05 0.00 0.00 55.36 55.39 1j37 s GLN 353 Cb -0.17 0.03 0.18 0.00 1.10 0.00 0.00 33.01 34.15 1j37 s GLN 353 CO -0.07 -0.01 2.32 0.00 -0.55 0.00 0.00 175.29 176.98 1j37 n THR 355 N 0.41 0.88 -3.97 0.00 -2.24 -1.25 -4.53 114.28 103.58 1j37 n THR 355 Ca 0.41 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.60 1j37 n THR 355 Cb 0.56 -0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.53 1j37 n THR 355 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1j37 s ARG 356 N -1.20 0.45 -0.67 -0.78 0.52 -1.26 -4.63 118.95 111.37 1j37 s ARG 356 Ca 0.60 -0.72 -0.25 0.00 -0.52 0.00 0.00 55.73 54.84 1j37 s ARG 356 Cb -0.59 0.17 0.04 0.00 0.52 0.00 0.00 34.95 35.09 1j37 s ARG 356 CO 0.62 -0.09 1.12 0.14 0.02 0.00 0.00 175.30 177.11 1j37 s VAL 357 N -2.13 4.04 0.07 3.52 -7.23 -1.26 -4.66 120.40 112.74 1j37 s VAL 357 Ca -0.09 0.20 -0.26 0.00 -1.81 0.00 0.00 61.98 60.01 1j37 s VAL 357 Cb -0.05 -4.77 0.08 0.00 0.56 0.00 0.00 36.38 32.20 1j37 s VAL 357 CO -0.03 -1.57 0.67 0.42 -0.31 0.00 0.00 175.10 174.28 1j37 s THR 358 N 4.86 0.00 0.43 5.32 -4.23 -1.26 -4.77 115.64 115.99 1j37 s THR 358 Ca 0.31 0.00 0.11 0.00 -1.18 0.00 0.00 61.69 60.93 1j37 s THR 358 Cb -0.11 -1.00 0.21 0.00 1.34 0.00 0.00 72.50 72.94 1j37 s THR 358 CO 0.15 0.00 2.01 -0.61 -0.54 0.00 0.00 174.62 175.63 1j37 h GLN 359 N 2.31 0.24 -0.22 3.99 4.15 -1.89 -2.46 115.11 121.25 1j37 h GLN 359 Ca -0.30 -0.03 -0.17 0.00 0.77 0.00 0.00 58.65 58.91 1j37 h GLN 359 Cb 1.25 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.89 1j37 h GLN 359 CO 0.37 0.27 -0.57 0.22 -1.93 0.00 0.00 178.83 177.20 1j37 h ASP 360 N 0.24 0.76 0.13 -0.69 3.58 -1.97 -2.88 116.42 115.59 1j37 h ASP 360 Ca 0.06 -0.42 -0.07 0.00 0.42 0.00 0.00 57.03 57.02 1j37 h ASP 360 Cb 0.18 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 1j37 h ASP 360 CO 0.00 1.17 -0.24 1.56 -2.88 0.00 0.00 179.24 178.85 1j37 h GLN 361 N 0.52 0.20 -0.62 0.28 1.08 -1.76 -2.23 115.11 112.59 1j37 h GLN 361 Ca 0.01 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.12 1j37 h GLN 361 Cb 1.14 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.52 1j37 h GLN 361 CO 0.11 0.44 0.31 1.25 -0.95 0.00 0.00 178.83 179.99 1j37 h LEU 362 N 0.19 0.80 -0.42 1.46 6.46 -1.24 -0.38 115.31 122.17 1j37 h LEU 362 Ca 0.03 -0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 57.60 1j37 h LEU 362 Cb 0.54 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.25 1j37 h LEU 362 CO 0.04 0.70 0.00 -0.26 -0.62 0.00 0.00 178.44 178.30 1j37 h PHE 363 N 0.84 0.80 -0.32 1.25 0.04 -1.35 -3.03 116.94 115.18 1j37 h PHE 363 Ca 0.21 -0.14 0.06 0.00 2.80 0.00 0.00 57.97 60.91 1j37 h PHE 363 Cb 0.10 -0.21 -0.06 0.00 2.20 0.00 0.00 35.95 37.98 1j37 h PHE 363 CO -0.00 0.80 -0.08 1.15 -0.60 0.00 0.00 178.31 179.58 1j37 h THR 364 N 0.57 0.67 -0.41 -1.55 2.02 -0.86 0.39 112.91 113.75 1j37 h THR 364 Ca 0.12 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.38 1j37 h THR 364 Cb 0.48 0.67 -0.09 0.00 -1.74 0.00 0.00 68.15 67.47 1j37 h THR 364 CO 0.02 0.00 -0.35 0.58 0.37 0.00 0.00 175.52 176.14 1j37 h VAL 365 N -0.01 0.19 -0.93 3.16 2.07 -1.02 0.48 116.25 120.20 1j37 h VAL 365 Ca 0.15 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.72 1j37 h VAL 365 Cb 0.24 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.14 1j37 h VAL 365 CO -0.33 0.00 0.60 0.45 0.02 0.00 0.00 177.57 178.31 1j37 h HIS 366 N -0.27 1.12 -0.21 1.57 -0.00 -1.20 0.19 115.15 116.35 1j37 h HIS 366 Ca 0.17 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.60 1j37 h HIS 366 Cb 0.55 -0.37 -0.03 0.00 -0.00 0.00 0.00 27.41 27.57 1j37 h HIS 366 CO -0.56 0.61 0.03 1.25 -0.00 0.00 0.00 177.93 179.25 1j37 h HIS 367 N 1.12 0.05 -0.44 2.45 6.17 0.30 0.73 115.15 125.53 1j37 h HIS 367 Ca 0.39 0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.45 1j37 h HIS 367 Cb 0.09 0.01 -0.02 0.00 2.52 0.00 0.00 27.41 30.02 1j37 h HIS 367 CO -0.01 0.01 0.14 0.93 0.71 0.00 0.00 177.93 179.70 1j37 h GLU 368 N 0.11 0.68 0.00 5.26 4.39 0.61 -2.04 114.58 123.59 1j37 h GLU 368 Ca 0.10 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 1j37 h GLU 368 Cb 0.10 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1j37 h GLU 368 CO -0.14 0.66 -0.02 -0.07 -1.16 0.00 0.00 179.01 178.28 1j37 h LEU 369 N 0.57 0.00 -1.15 1.33 -0.00 -0.09 0.19 115.31 116.16 1j37 h LEU 369 Ca 0.14 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.96 1j37 h LEU 369 Cb 0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.91 1j37 h LEU 369 CO -0.00 0.02 -0.10 1.23 -0.00 0.00 0.00 178.44 179.59 1j37 h GLY 370 N 0.26 0.51 0.47 0.83 0.00 -0.11 0.28 103.07 105.31 1j37 h GLY 370 Ca -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1j37 h GLY 370 CO 0.00 0.31 -0.11 0.45 0.00 0.00 0.00 176.54 177.20 1j37 h HIS 371 N 0.44 -0.28 -0.77 5.60 3.86 -0.58 -2.82 115.15 120.61 1j37 h HIS 371 Ca 0.09 -0.01 0.17 0.00 -1.16 0.00 0.00 60.37 59.46 1j37 h HIS 371 Cb 0.45 0.09 -0.11 0.00 1.06 0.00 0.00 27.41 28.90 1j37 h HIS 371 CO 0.01 0.11 0.23 0.82 0.86 0.00 0.00 177.93 179.97 1j37 h ILE 372 N -0.84 0.52 0.53 2.45 1.08 -0.99 -0.42 117.51 119.83 1j37 h ILE 372 Ca -0.03 -0.11 -0.02 0.00 -0.39 0.00 0.00 64.86 64.32 1j37 h ILE 372 Cb 0.51 0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 34.42 1j37 h ILE 372 CO 0.05 0.06 -0.50 -0.61 -0.69 0.00 0.00 178.15 176.46 1j37 h GLN 373 N 0.31 -0.98 -0.81 2.37 5.75 -0.46 -1.06 115.11 120.22 1j37 h GLN 373 Ca 0.44 0.07 0.18 0.00 -0.15 0.00 0.00 58.65 59.19 1j37 h GLN 373 Cb 0.77 0.22 -0.15 0.00 1.07 0.00 0.00 27.48 29.39 1j37 h GLN 373 CO -0.51 -0.66 -0.09 -0.92 -2.65 0.00 0.00 178.83 174.01 1j37 h TYR 374 N -1.02 -0.23 0.01 3.99 -0.00 -0.97 0.25 116.97 119.00 1j37 h TYR 374 Ca -0.06 0.07 0.03 0.00 -0.00 0.00 0.00 58.73 58.76 1j37 h TYR 374 Cb 0.88 0.23 -0.05 0.00 -0.00 0.00 0.00 36.73 37.79 1j37 h TYR 374 CO -0.24 -0.32 -0.36 0.74 -0.00 0.00 0.00 178.16 177.98 1j37 h PHE 375 N 0.04 -1.01 -0.94 -3.82 0.04 -0.18 -1.36 116.94 109.71 1j37 h PHE 375 Ca 0.43 0.03 0.03 0.00 2.80 0.00 0.00 57.97 61.26 1j37 h PHE 375 Cb 0.73 0.44 -0.05 0.00 2.20 0.00 0.00 35.95 39.27 1j37 h PHE 375 CO -0.54 -0.45 0.61 -0.07 -0.60 0.00 0.00 178.31 177.27 1j37 h LEU 376 N -0.53 1.03 -2.11 1.54 3.38 0.29 -2.56 115.31 116.35 1j37 h LEU 376 Ca 0.05 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1j37 h LEU 376 Cb 0.60 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1j37 h LEU 376 CO -0.28 0.71 0.05 1.56 0.09 0.00 0.00 178.44 180.56 1j37 h GLN 377 N 1.19 0.00 0.00 1.13 1.08 0.47 -3.15 115.11 115.84 1j37 h GLN 377 Ca 0.37 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.57 1j37 h GLN 377 Cb -0.01 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.42 1j37 h GLN 377 CO -0.12 0.00 -0.21 2.48 -0.95 0.00 0.00 178.83 180.03 1j37 n TYR 378 N -4.34 0.00 -0.17 2.96 0.18 -0.83 -4.00 117.16 110.96 1j37 n TYR 378 Ca -0.02 -1.16 -0.01 0.00 1.88 0.00 0.00 57.90 58.59 1j37 n TYR 378 Cb 0.15 -0.19 0.07 0.00 -0.38 0.00 0.00 39.34 38.99 1j37 n TYR 378 CO 0.00 0.00 0.00 1.96 -2.08 0.00 0.00 176.86 176.74 1j37 h GLN 379 N 0.39 0.15 -0.19 -3.48 4.20 -1.46 -1.68 115.11 113.04 1j37 h GLN 379 Ca -0.00 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.75 1j37 h GLN 379 Cb 1.02 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 1j37 h GLN 379 CO 0.00 0.10 0.23 1.12 -0.67 0.00 0.00 178.83 179.62 1j37 h HIS 380 N 0.16 0.00 -4.12 2.96 2.07 -1.86 -3.44 115.15 110.92 1j37 h HIS 380 Ca 0.27 0.00 -0.54 0.00 -2.85 0.00 0.00 60.37 57.25 1j37 h HIS 380 Cb 0.40 0.00 0.13 0.00 2.57 0.00 0.00 27.41 30.51 1j37 h HIS 380 CO -0.29 0.00 0.46 -0.65 -3.07 0.00 0.00 177.93 174.38 1j37 s GLN 381 N -4.58 2.68 0.06 5.12 -1.52 -0.63 -4.93 119.66 115.86 1j37 s GLN 381 Ca -0.05 1.85 -0.31 0.00 -1.95 0.00 0.00 55.36 54.91 1j37 s GLN 381 Cb 0.15 -1.89 -0.08 0.00 -0.22 0.00 0.00 33.01 30.97 1j37 s GLN 381 CO 0.52 -1.44 1.58 -2.14 -0.25 0.00 0.00 175.29 173.57 1j37 s PRO 382 N -3.50 4.22 0.00 2.91 0.02 -1.26 -4.66 135.00 132.73 1j37 s PRO 382 Ca 0.78 2.24 0.00 0.00 0.02 0.00 0.00 61.00 64.04 1j37 s PRO 382 Cb -0.31 -3.55 0.00 0.00 0.02 0.00 0.00 34.50 30.65 1j37 s PRO 382 CO 0.38 -0.68 0.00 0.34 -0.33 0.00 0.00 177.00 176.71 1j37 n PHE 383 N 5.39 0.00 -0.33 6.54 7.35 -1.26 0.18 117.46 135.33 1j37 n PHE 383 Ca 0.15 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.94 1j37 n PHE 383 Cb 0.41 -0.46 0.31 0.00 0.35 0.00 0.00 39.48 40.10 1j37 n PHE 383 CO 0.00 0.00 0.00 -0.24 -0.76 0.00 0.00 176.76 175.76 1j37 h VAL 384 N 0.00 0.84 -0.01 -2.13 3.04 -1.90 0.49 116.25 116.59 1j37 h VAL 384 Ca 0.00 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 1j37 h VAL 384 Cb 0.00 -0.06 0.00 0.00 -2.01 0.00 0.00 31.29 29.22 1j37 h VAL 384 CO 0.00 0.15 -0.07 -1.22 -1.01 0.00 0.00 177.57 175.42 1j37 n TYR 385 N -4.62 0.00 -2.43 3.17 4.01 0.49 -4.61 117.16 113.17 1j37 n TYR 385 Ca 0.19 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.50 1j37 n TYR 385 Cb 0.45 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 1j37 n TYR 385 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1j37 n ARG 386 N -0.55 3.21 -1.28 -0.72 1.74 0.16 -3.68 116.66 115.54 1j37 n ARG 386 Ca 0.18 -3.28 -0.01 0.00 -0.77 0.00 0.00 57.85 53.97 1j37 n ARG 386 Cb 0.28 -3.27 0.00 0.00 -1.02 0.00 0.00 32.46 28.45 1j37 n ARG 386 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1j37 n THR 387 N 5.27 0.00 -3.67 0.55 5.66 -1.26 -5.03 114.28 115.80 1j37 n THR 387 Ca 0.46 -0.09 -0.32 0.00 -3.05 0.00 0.00 64.05 61.05 1j37 n THR 387 Cb 0.42 0.09 -0.05 0.00 -1.55 0.00 0.00 70.33 69.25 1j37 n THR 387 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1j37 s GLY 388 N -1.25 2.24 -0.37 1.09 0.00 -1.26 -3.70 107.32 104.07 1j37 s GLY 388 Ca 0.02 -0.56 -0.29 0.00 0.00 0.00 0.00 44.72 43.89 1j37 s GLY 388 CO 0.01 -0.47 1.60 0.00 0.00 0.00 0.00 173.10 174.24 1j37 s ALA 389 N -1.64 2.98 0.24 3.20 0.00 -1.26 -4.35 121.76 120.92 1j37 s ALA 389 Ca 0.40 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.42 1j37 s ALA 389 Cb -0.12 -3.97 0.00 0.00 0.00 0.00 0.00 23.12 19.03 1j37 s ALA 389 CO 0.24 -2.48 0.00 -1.71 0.00 0.00 0.00 175.76 171.81 1j37 n ASN 390 N 9.47 -7.94 0.09 0.00 2.85 -1.26 -3.95 115.26 114.52 1j37 n ASN 390 Ca 0.20 1.12 0.20 0.00 -0.11 0.00 0.00 54.58 55.99 1j37 n ASN 390 Cb 0.47 -4.18 0.73 0.00 1.24 0.00 0.00 39.78 38.04 1j37 n ASN 390 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1j37 h PRO 391 N 3.05 0.00 -0.66 1.20 0.11 -1.80 -1.49 132.00 132.41 1j37 h PRO 391 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1j37 h PRO 391 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1j37 h PRO 391 CO 0.00 0.00 0.33 0.78 -0.21 0.00 0.00 178.00 178.90 1j37 h GLY 392 N 0.00 1.01 1.85 -0.55 0.00 -1.81 -2.75 103.07 100.83 1j37 h GLY 392 Ca 0.20 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1j37 h GLY 392 CO -0.00 0.47 0.08 0.74 0.00 0.00 0.00 176.54 177.82 1j37 h PHE 393 N 0.91 0.19 -0.36 5.60 0.05 -1.39 -2.76 116.94 119.18 1j37 h PHE 393 Ca 0.23 0.00 -0.09 0.00 3.82 0.00 0.00 57.97 61.93 1j37 h PHE 393 Cb 0.10 -0.06 -0.01 0.00 2.00 0.00 0.00 35.95 37.98 1j37 h PHE 393 CO 0.00 0.14 -0.14 1.25 -0.18 0.00 0.00 178.31 179.38 1j37 h HIS 394 N 0.20 0.83 0.00 -0.55 2.76 -1.60 -2.91 115.15 113.88 1j37 h HIS 394 Ca 0.05 -0.20 0.00 0.00 -2.20 0.00 0.00 60.37 58.03 1j37 h HIS 394 Cb 0.01 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.78 1j37 h HIS 394 CO 0.00 0.91 0.00 0.39 -1.30 0.00 0.00 177.93 177.93 1j37 n GLU 395 N -4.34 0.60 -0.12 5.26 -0.58 -1.06 -4.04 120.64 116.36 1j37 n GLU 395 Ca -0.02 0.02 -0.16 0.00 -0.42 0.00 0.00 57.16 56.58 1j37 n GLU 395 Cb 0.38 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.62 1j37 n GLU 395 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1j37 n ALA 396 N -1.17 1.46 -0.18 0.62 0.00 -1.10 -4.48 120.51 115.65 1j37 n ALA 396 Ca 0.16 -1.17 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1j37 n ALA 396 Cb 0.17 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1j37 n ALA 396 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1j37 n VAL 397 N -3.11 0.00 0.27 0.00 0.31 -1.20 -0.01 118.33 114.58 1j37 n VAL 397 Ca -0.42 1.12 0.16 0.00 -0.01 0.00 0.00 64.34 65.19 1j37 n VAL 397 Cb 1.04 -1.53 0.86 0.00 -0.91 0.00 0.00 33.84 33.30 1j37 n VAL 397 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1j37 h GLY 398 N 0.00 0.00 1.96 2.92 0.00 -1.76 -1.60 103.07 104.59 1j37 h GLY 398 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1j37 h GLY 398 CO 0.00 0.00 -0.93 -0.55 0.00 0.00 0.00 176.54 175.06 1j37 h ASP 399 N 0.00 0.00 -0.60 0.19 3.32 -0.66 -2.70 116.42 115.98 1j37 h ASP 399 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1j37 h ASP 399 Cb 0.22 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1j37 h ASP 399 CO 0.00 0.90 0.09 0.58 -1.72 0.00 0.00 179.24 179.09 1j37 h VAL 400 N 0.00 1.26 -0.33 -1.35 2.07 -0.61 -1.07 116.25 116.21 1j37 h VAL 400 Ca -0.02 -1.00 -0.15 0.00 0.82 0.00 0.00 66.70 66.35 1j37 h VAL 400 Cb 1.70 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1j37 h VAL 400 CO 0.11 0.37 -0.36 -0.07 0.02 0.00 0.00 177.57 177.64 1j37 h LEU 401 N 0.96 0.90 -1.47 2.57 3.38 -1.59 -2.94 115.31 117.11 1j37 h LEU 401 Ca 0.19 -0.48 0.12 0.00 0.09 0.00 0.00 57.88 57.80 1j37 h LEU 401 Cb 0.42 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 1j37 h LEU 401 CO 0.01 1.19 0.49 0.28 0.09 0.00 0.00 178.44 180.51 1j37 h SER 402 N 0.62 0.52 -0.66 -0.43 0.02 -1.08 -0.21 113.55 112.33 1j37 h SER 402 Ca 0.05 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1j37 h SER 402 Cb 0.95 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1j37 h SER 402 CO 0.09 0.30 0.36 -0.07 -1.14 0.00 0.00 176.83 176.37 1j37 h LEU 403 N 0.57 0.83 -0.35 5.07 3.38 -1.03 -1.29 115.31 122.48 1j37 h LEU 403 Ca 0.36 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 1j37 h LEU 403 Cb 0.60 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1j37 h LEU 403 CO -0.13 0.68 0.19 0.28 0.09 0.00 0.00 178.44 179.56 1j37 h SER 404 N 0.90 0.44 0.09 -0.43 0.02 -1.04 -2.58 113.55 110.96 1j37 h SER 404 Ca 0.23 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1j37 h SER 404 Cb 0.04 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 1j37 h SER 404 CO -0.04 0.40 -0.07 0.58 -1.14 0.00 0.00 176.83 176.57 1j37 h VAL 405 N 0.44 0.92 0.00 2.27 2.07 -1.07 -2.54 116.25 118.34 1j37 h VAL 405 Ca 0.12 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1j37 h VAL 405 Cb 0.06 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1j37 h VAL 405 CO -0.02 0.07 0.00 -1.54 0.02 0.00 0.00 177.57 176.10 1j37 n SER 406 N -4.26 0.50 -4.75 0.57 3.41 -0.51 -4.27 113.62 104.30 1j37 n SER 406 Ca -0.03 0.56 -0.40 0.00 -0.26 0.00 0.00 58.87 58.75 1j37 n SER 406 Cb 0.15 -0.69 -0.05 0.00 -0.26 0.00 0.00 64.21 63.36 1j37 n SER 406 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1j37 s THR 407 N -3.10 4.60 0.29 6.66 -4.23 -0.96 -4.93 115.64 113.98 1j37 s THR 407 Ca 0.10 1.73 0.09 0.00 -1.18 0.00 0.00 61.69 62.43 1j37 s THR 407 Cb 0.14 -4.16 0.33 0.00 1.34 0.00 0.00 72.50 70.15 1j37 s THR 407 CO 0.52 0.39 1.35 -2.65 -0.54 0.00 0.00 174.62 173.69 1j37 n PRO 408 N 2.52 -0.06 0.08 3.99 -0.02 -1.26 -0.70 135.00 139.55 1j37 n PRO 408 Ca -0.02 1.24 -0.09 0.00 -2.02 0.00 0.00 63.50 62.60 1j37 n PRO 408 Cb 0.50 -2.07 -0.05 0.00 -0.02 0.00 0.00 33.50 31.85 1j37 n PRO 408 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1j37 h LYS 409 N 0.00 -0.41 0.00 -0.52 3.64 -1.91 -1.02 116.57 116.34 1j37 h LYS 409 Ca 0.61 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.97 1j37 h LYS 409 Cb 1.44 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.35 1j37 h LYS 409 CO -0.74 -0.28 -0.22 1.25 -2.27 0.00 0.00 179.45 177.20 1j37 h HIS 410 N -0.43 0.00 0.00 1.91 2.76 -1.13 -1.74 115.15 116.52 1j37 h HIS 410 Ca -0.01 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 58.01 1j37 h HIS 410 Cb 0.42 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.36 1j37 h HIS 410 CO -0.34 0.22 -0.72 -0.07 -1.30 0.00 0.00 177.93 175.72 1j37 h LEU 411 N 0.00 0.00 0.04 0.26 3.38 -1.28 -2.94 115.31 114.78 1j37 h LEU 411 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1j37 h LEU 411 Cb 0.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1j37 h LEU 411 CO 0.03 0.72 -0.48 -0.08 0.09 0.00 0.00 178.44 178.72 1j37 h GLU 412 N 0.00 0.26 -0.99 1.13 4.81 -0.86 0.38 114.58 119.32 1j37 h GLU 412 Ca -0.01 -0.33 0.29 0.00 -0.13 0.00 0.00 59.36 59.18 1j37 h GLU 412 Cb 1.48 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.92 1j37 h GLU 412 CO 0.09 1.07 0.71 0.87 -0.73 0.00 0.00 179.01 181.02 1j37 h LYS 413 N -0.40 0.00 -0.55 1.92 1.57 -1.35 0.61 116.57 118.38 1j37 h LYS 413 Ca -0.07 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1j37 h LYS 413 Cb 1.27 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1j37 h LYS 413 CO 0.09 0.00 0.00 0.44 -0.57 0.00 0.00 179.45 179.42 1j37 n ILE 414 N -4.24 0.82 -1.75 1.86 -5.35 -1.11 -4.97 119.36 104.61 1j37 n ILE 414 Ca 0.21 -0.91 -0.10 0.00 -0.27 0.00 0.00 62.75 61.68 1j37 n ILE 414 Cb 1.05 0.67 -0.02 0.00 -1.74 0.00 0.00 39.64 39.60 1j37 n ILE 414 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j37 n GLY 415 N 1.41 0.54 1.41 3.28 0.00 0.21 -4.90 105.19 107.14 1j37 n GLY 415 Ca 0.21 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.82 1j37 n GLY 415 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j37 n LEU 416 N -1.31 4.10 -3.31 0.99 4.77 0.11 -4.55 117.00 117.80 1j37 n LEU 416 Ca -0.11 -2.06 -0.11 0.00 -0.03 0.00 0.00 56.01 53.70 1j37 n LEU 416 Cb 0.47 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 1j37 n LEU 416 CO 0.15 0.93 -0.08 -0.22 -1.33 0.00 0.00 177.39 176.83 1j37 s LEU 417 N -1.21 -0.50 0.00 2.23 2.96 -1.12 -4.69 118.68 116.35 1j37 s LEU 417 Ca 0.49 -1.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.03 1j37 s LEU 417 Cb 0.27 0.99 0.00 0.00 0.50 0.00 0.00 46.19 47.95 1j37 s LEU 417 CO 0.31 -0.23 0.20 2.29 -1.32 0.00 0.00 176.35 177.60 1j37 n LYS 418 N 4.25 0.00 -3.75 1.98 0.00 -1.26 -4.42 118.16 114.96 1j37 n LYS 418 Ca 0.12 0.02 -0.36 0.00 -0.00 0.00 0.00 58.31 58.08 1j37 n LYS 418 Cb 0.49 -0.70 -0.11 0.00 -0.00 0.00 0.00 35.03 34.71 1j37 n LYS 418 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1j37 s ASP 419 N -2.12 5.68 -0.02 -5.58 1.47 -1.26 -5.03 116.67 109.82 1j37 s ASP 419 Ca 0.00 -0.03 0.00 0.00 1.18 0.00 0.00 52.55 53.71 1j37 s ASP 419 Cb 0.00 -2.02 0.02 0.00 -0.34 0.00 0.00 42.92 40.58 1j37 s ASP 419 CO 0.00 0.03 0.01 -0.47 0.68 0.00 0.00 175.17 175.41 1j37 s TYR 420 N 1.26 0.14 -0.13 2.11 5.04 -1.26 -5.10 117.35 119.41 1j37 s TYR 420 Ca 0.06 0.04 0.02 0.00 -2.44 0.00 0.00 57.07 54.74 1j37 s TYR 420 Cb -0.14 -0.22 -0.00 0.00 0.35 0.00 0.00 41.96 41.94 1j37 s TYR 420 CO 0.05 -0.07 -0.19 0.14 -1.34 0.00 0.00 175.55 174.14 1j37 s VAL 421 N 0.63 2.40 0.00 3.14 -7.23 -1.26 -5.01 120.40 113.08 1j37 s VAL 421 Ca -0.06 -0.88 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 1j37 s VAL 421 Cb -0.08 -1.98 -0.09 0.00 0.56 0.00 0.00 36.38 34.79 1j37 s VAL 421 CO -0.02 0.54 2.21 -2.11 -0.31 0.00 0.00 175.10 175.42 1j37 n ARG 422 N 3.83 1.15 0.00 4.82 -4.01 -1.26 -4.79 116.66 116.40 1j37 n ARG 422 Ca -0.19 -0.33 0.00 0.00 -1.04 0.00 0.00 57.85 56.29 1j37 n ARG 422 Cb 0.52 -1.42 0.00 0.00 -3.04 0.00 0.00 32.46 28.52 1j37 n ARG 422 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 1j37 n ASP 423 N 1.99 0.00 0.00 2.89 8.00 -1.26 -4.70 116.55 123.48 1j37 n ASP 423 Ca 0.14 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1j37 n ASP 423 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 1j37 n ASP 423 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1j37 n ASP 424 N -0.40 0.00 -0.23 -2.24 4.64 -1.26 -4.83 116.55 112.23 1j37 n ASP 424 Ca 0.00 0.00 0.15 0.00 -1.38 0.00 0.00 54.79 53.56 1j37 n ASP 424 Cb 0.00 0.00 0.73 0.00 -1.04 0.00 0.00 41.12 40.81 1j37 n ASP 424 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1j37 n GLU 425 N 0.00 1.32 0.00 -0.67 -0.58 -1.26 -2.02 120.64 117.42 1j37 n GLU 425 Ca 0.00 -0.46 -0.02 0.00 -0.42 0.00 0.00 57.16 56.26 1j37 n GLU 425 Cb 0.00 -1.48 -0.11 0.00 -0.57 0.00 0.00 31.44 29.28 1j37 n GLU 425 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1j37 n ALA 426 N -0.43 1.86 -0.03 0.62 0.00 -1.26 -3.65 120.51 117.61 1j37 n ALA 426 Ca 0.21 -0.69 -0.14 0.00 0.00 0.00 0.00 53.44 52.82 1j37 n ALA 426 Cb 0.22 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 1j37 n ALA 426 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1j37 h ARG 427 N 0.00 0.76 -0.83 0.00 2.43 -1.68 -2.68 114.38 112.37 1j37 h ARG 427 Ca -0.23 -0.54 0.08 0.00 -0.81 0.00 0.00 59.98 58.48 1j37 h ARG 427 Cb 1.71 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 31.29 1j37 h ARG 427 CO 0.05 1.16 0.54 0.82 -1.51 0.00 0.00 179.97 181.03 1j37 h ILE 428 N 0.56 1.01 -0.32 1.20 1.08 -1.58 -1.25 117.51 118.21 1j37 h ILE 428 Ca -0.01 -0.30 -0.09 0.00 -0.39 0.00 0.00 64.86 64.06 1j37 h ILE 428 Cb 1.25 0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 35.05 1j37 h ILE 428 CO 0.13 0.16 -0.16 0.78 -0.69 0.00 0.00 178.15 178.37 1j37 h ASN 429 N 0.87 0.70 0.04 1.72 -0.26 -1.59 0.29 115.58 117.35 1j37 h ASN 429 Ca 0.37 -0.41 -0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1j37 h ASN 429 Cb 0.30 -0.19 -0.00 0.00 -1.06 0.00 0.00 38.32 37.37 1j37 h ASN 429 CO -0.14 0.96 -0.01 -0.61 -1.06 0.00 0.00 177.43 176.57 1j37 h GLN 430 N 0.45 0.00 0.01 0.81 -0.00 -0.91 0.34 115.11 115.81 1j37 h GLN 430 Ca 0.07 0.00 -0.37 0.00 -0.00 0.00 0.00 58.65 58.35 1j37 h GLN 430 Cb 0.70 0.00 -0.06 0.00 0.00 0.00 0.00 27.48 28.11 1j37 h GLN 430 CO 0.05 0.01 -2.34 1.28 0.00 0.00 0.00 178.83 177.83 1j37 n LEU 431 N -3.49 1.34 -0.13 -2.39 4.77 -0.89 -4.05 117.00 112.17 1j37 n LEU 431 Ca -0.03 -0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 1j37 n LEU 431 Cb 0.09 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.01 1j37 n LEU 431 CO 0.24 0.67 0.62 0.15 -1.33 0.00 0.00 177.39 177.75 1j37 h PHE 432 N 0.00 1.02 0.00 -1.77 3.04 -0.25 0.43 116.94 119.42 1j37 h PHE 432 Ca -0.53 -0.27 -0.04 0.00 3.98 0.00 0.00 57.97 61.11 1j37 h PHE 432 Cb 2.09 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 40.36 1j37 h PHE 432 CO 0.02 1.06 -0.17 1.25 -2.02 0.00 0.00 178.31 178.45 1j37 h LEU 433 N 0.69 0.00 0.02 0.59 6.46 -0.56 -2.21 115.31 120.30 1j37 h LEU 433 Ca 0.08 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.58 1j37 h LEU 433 Cb 0.83 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.73 1j37 h LEU 433 CO 0.07 0.17 -1.35 0.74 -0.62 0.00 0.00 178.44 177.45 1j37 h THR 434 N 0.00 1.31 -0.03 1.05 2.02 -1.62 -3.32 112.91 112.31 1j37 h THR 434 Ca -0.00 -3.05 -0.07 0.00 0.77 0.00 0.00 66.41 64.06 1j37 h THR 434 Cb 0.45 2.68 -0.01 0.00 -1.74 0.00 0.00 68.15 69.53 1j37 h THR 434 CO 0.02 0.78 -0.30 0.00 0.37 0.00 0.00 175.52 176.39 1j37 h ALA 435 N 0.90 1.45 0.00 6.16 0.00 -0.29 -0.81 119.26 126.67 1j37 h ALA 435 Ca -0.15 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1j37 h ALA 435 Cb 1.90 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1j37 h ALA 435 CO 0.12 0.41 0.00 -0.07 0.00 0.00 0.00 179.25 179.70 1j37 h LEU 436 N 0.05 0.00 0.00 0.00 3.38 -1.61 -2.12 115.31 115.01 1j37 h LEU 436 Ca 0.01 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.72 1j37 h LEU 436 Cb 0.55 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 1j37 h LEU 436 CO 0.04 0.00 -1.97 0.47 0.09 0.00 0.00 178.44 177.07 1j37 n ASP 437 N -3.09 2.20 -0.09 -0.43 8.00 -1.01 -0.77 116.55 121.36 1j37 n ASP 437 Ca 0.01 -0.05 -0.23 0.00 0.71 0.00 0.00 54.79 55.22 1j37 n ASP 437 Cb 0.30 0.21 -0.12 0.00 -0.02 0.00 0.00 41.12 41.49 1j37 n ASP 437 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1j37 n LYS 438 N -2.79 0.63 -0.01 -1.24 4.76 -0.34 -3.88 118.16 115.29 1j37 n LYS 438 Ca -0.27 0.38 -0.09 0.00 -2.87 0.00 0.00 58.31 55.46 1j37 n LYS 438 Cb 0.88 -1.66 -0.08 0.00 -1.84 0.00 0.00 35.03 32.33 1j37 n LYS 438 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1j37 h ILE 439 N -0.61 0.96 -1.08 -0.18 2.04 -1.59 -3.30 117.51 113.75 1j37 h ILE 439 Ca -0.47 -1.48 0.29 0.00 1.00 0.00 0.00 64.86 64.21 1j37 h ILE 439 Cb 1.63 1.72 -0.09 0.00 -0.74 0.00 0.00 36.82 39.34 1j37 h ILE 439 CO -0.16 0.29 0.71 0.58 0.00 0.00 0.00 178.15 179.57 1j37 h VAL 440 N -0.93 0.48 -0.13 1.67 2.07 -1.64 -1.71 116.25 116.06 1j37 h VAL 440 Ca -0.01 -0.10 -0.16 0.00 0.82 0.00 0.00 66.70 67.25 1j37 h VAL 440 Cb 0.55 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1j37 h VAL 440 CO 0.02 0.05 -0.60 0.15 0.02 0.00 0.00 177.57 177.21 1j37 h PHE 441 N 0.29 0.55 -0.69 1.57 3.57 -1.67 -3.36 116.94 117.21 1j37 h PHE 441 Ca 0.60 -0.21 0.11 0.00 3.53 0.00 0.00 57.97 62.00 1j37 h PHE 441 Cb 1.72 -0.10 -0.12 0.00 2.79 0.00 0.00 35.95 40.24 1j37 h PHE 441 CO -0.00 0.92 -0.38 -0.07 -2.23 0.00 0.00 178.31 176.54 1j37 h LEU 442 N 0.32 -1.35 -0.90 0.59 3.38 -1.38 -0.91 115.31 115.06 1j37 h LEU 442 Ca -0.00 0.25 -0.06 0.00 0.09 0.00 0.00 57.88 58.16 1j37 h LEU 442 Cb 1.14 0.66 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 1j37 h LEU 442 CO 0.10 -0.31 -0.27 1.55 0.09 0.00 0.00 178.44 179.61 1j37 h PRO 443 N -0.14 0.00 0.11 1.13 0.13 -1.74 -2.86 132.00 128.62 1j37 h PRO 443 Ca 0.24 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.36 1j37 h PRO 443 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 1j37 h PRO 443 CO -0.76 0.27 -0.05 0.35 -0.23 0.00 0.00 178.00 177.58 1j37 h PHE 444 N 0.00 -0.13 -0.02 1.56 3.57 -1.35 -2.42 116.94 118.15 1j37 h PHE 444 Ca -0.00 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 1j37 h PHE 444 Cb 0.86 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 1j37 h PHE 444 CO 0.00 0.25 -0.29 0.00 -2.23 0.00 0.00 178.31 176.04 1j37 h ALA 445 N 0.28 1.48 -0.19 2.41 0.00 -1.36 -1.76 119.26 120.12 1j37 h ALA 445 Ca -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1j37 h ALA 445 Cb 0.44 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1j37 h ALA 445 CO 0.02 0.39 -0.05 0.35 0.00 0.00 0.00 179.25 179.96 1j37 h PHE 446 N 0.03 0.42 -0.19 0.00 3.04 -1.51 -3.11 116.94 115.62 1j37 h PHE 446 Ca 0.00 -0.09 -0.05 0.00 3.98 0.00 0.00 57.97 61.81 1j37 h PHE 446 Cb 0.53 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.93 1j37 h PHE 446 CO 0.00 0.63 -0.12 1.79 -2.02 0.00 0.00 178.31 178.59 1j37 h THR 447 N 0.09 1.19 -0.36 4.41 1.35 -0.89 -1.37 112.91 117.34 1j37 h THR 447 Ca 0.05 -0.84 0.07 0.00 -0.55 0.00 0.00 66.41 65.14 1j37 h THR 447 Cb 0.49 1.18 -0.07 0.00 -1.73 0.00 0.00 68.15 68.02 1j37 h THR 447 CO 0.02 0.27 -0.09 0.24 -0.25 0.00 0.00 175.52 175.70 1j37 h MET 448 N 0.30 -0.00 0.00 4.72 2.86 -1.27 -0.72 114.93 120.81 1j37 h MET 448 Ca 0.06 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.53 1j37 h MET 448 Cb 0.40 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.03 1j37 h MET 448 CO 0.02 -0.00 -1.29 -0.44 1.06 0.00 0.00 176.91 176.26 1j37 h ASP 449 N -0.00 0.00 -0.81 1.22 3.45 -1.56 -3.01 116.42 115.70 1j37 h ASP 449 Ca 0.17 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.63 1j37 h ASP 449 Cb 0.27 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.00 1j37 h ASP 449 CO -0.37 0.59 0.49 0.11 -1.57 0.00 0.00 179.24 178.49 1j37 h LYS 450 N 0.00 1.11 -0.29 3.56 1.57 -1.01 0.58 116.57 122.09 1j37 h LYS 450 Ca -0.14 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1j37 h LYS 450 Cb 1.58 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.64 1j37 h LYS 450 CO 0.05 0.77 0.03 -0.92 -0.57 0.00 0.00 179.45 178.82 1j37 h TYR 451 N 1.13 0.53 0.00 -1.35 3.20 -1.19 -1.18 116.97 118.10 1j37 h TYR 451 Ca 0.29 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1j37 h TYR 451 Cb -0.05 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.08 1j37 h TYR 451 CO 0.00 0.60 0.00 0.00 -1.64 0.00 0.00 178.16 177.13 1j37 h ARG 452 N 0.30 0.00 0.05 1.82 3.08 -1.31 -2.80 114.38 115.53 1j37 h ARG 452 Ca 0.09 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 1j37 h ARG 452 Cb 0.37 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.43 1j37 h ARG 452 CO 0.01 0.00 -0.48 -1.49 -1.07 0.00 0.00 179.97 176.94 1j37 h TRP 453 N 0.00 0.39 0.00 3.04 6.55 0.43 -2.08 115.95 124.27 1j37 h TRP 453 Ca 0.00 -0.25 -0.01 0.00 0.95 0.00 0.00 58.89 59.58 1j37 h TRP 453 Cb 0.68 -0.03 -0.00 0.00 -0.86 0.00 0.00 29.16 28.95 1j37 h TRP 453 CO 0.00 1.12 -0.03 0.66 -1.05 0.00 0.00 178.44 179.14 1j37 h SER 454 N -0.45 0.00 0.00 -3.49 4.64 -1.12 0.17 113.55 113.30 1j37 h SER 454 Ca -0.07 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.20 1j37 h SER 454 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 1j37 h SER 454 CO 0.09 0.03 -0.24 -0.07 -0.87 0.00 0.00 176.83 175.78 1j37 h LEU 455 N 0.00 0.00 -0.97 5.97 3.38 -1.50 -2.68 115.31 119.50 1j37 h LEU 455 Ca -0.00 -0.76 0.18 0.00 0.09 0.00 0.00 57.88 57.39 1j37 h LEU 455 Cb 0.12 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.77 1j37 h LEU 455 CO 0.00 1.02 0.57 -0.26 0.09 0.00 0.00 178.44 179.87 1j37 h PHE 456 N -1.00 1.01 -3.72 1.13 0.05 -0.84 -3.35 116.94 110.22 1j37 h PHE 456 Ca -0.06 0.03 -0.49 0.00 3.82 0.00 0.00 57.97 61.27 1j37 h PHE 456 Cb 0.92 -0.30 -0.03 0.00 2.00 0.00 0.00 35.95 38.54 1j37 h PHE 456 CO 0.20 0.23 0.14 1.03 -0.18 0.00 0.00 178.31 179.73 1j37 s ARG 457 N -5.89 4.13 0.00 1.51 0.52 0.54 -4.59 118.95 115.17 1j37 s ARG 457 Ca -0.11 0.80 0.00 0.00 -0.52 0.00 0.00 55.73 55.90 1j37 s ARG 457 Cb 0.24 -2.55 0.00 0.00 0.52 0.00 0.00 34.95 33.16 1j37 s ARG 457 CO 0.80 0.21 1.06 0.41 0.02 0.00 0.00 175.30 177.80 1j37 n GLY 458 N -0.03 1.98 0.30 -3.53 0.00 -1.26 -4.41 105.19 98.24 1j37 n GLY 458 Ca 0.02 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.24 1j37 n GLY 458 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1j37 h GLU 459 N 0.17 0.00 -6.88 1.61 5.08 -1.73 -3.44 114.58 109.38 1j37 h GLU 459 Ca 0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 1j37 h GLU 459 Cb 0.97 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.00 1j37 h GLU 459 CO 0.00 0.00 -0.86 0.08 -1.00 0.00 0.00 179.01 177.23 1j37 s VAL 460 N -3.88 2.34 -0.07 3.13 1.01 -1.22 -5.06 120.40 116.65 1j37 s VAL 460 Ca -0.02 -1.72 -0.21 0.00 0.00 0.00 0.00 61.98 60.03 1j37 s VAL 460 Cb 0.11 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 1j37 s VAL 460 CO 0.47 0.09 0.62 -1.81 0.00 0.00 0.00 175.10 174.47 1j37 s ASP 461 N -2.06 6.90 0.59 3.32 1.11 -1.26 -4.94 116.67 120.32 1j37 s ASP 461 Ca 0.14 1.08 0.31 0.00 0.18 0.00 0.00 52.55 54.27 1j37 s ASP 461 Cb -0.10 -2.37 1.33 0.00 1.07 0.00 0.00 42.92 42.85 1j37 s ASP 461 CO 0.07 -0.04 1.66 0.07 1.18 0.00 0.00 175.17 178.10 1j37 h LYS 462 N 6.51 0.00 0.00 8.23 -0.00 -1.99 1.03 116.57 130.34 1j37 h LYS 462 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.23 1j37 h LYS 462 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.42 1j37 h LYS 462 CO 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 179.45 180.19 1j37 n ALA 463 N -2.43 2.21 -0.49 0.07 0.00 -1.26 -3.07 120.51 115.54 1j37 n ALA 463 Ca 0.19 -0.11 0.01 0.00 0.00 0.00 0.00 53.44 53.53 1j37 n ALA 463 Cb 1.17 -1.38 0.01 0.00 0.00 0.00 0.00 19.45 19.25 1j37 n ALA 463 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1j37 n ASN 464 N -1.27 1.22 -0.33 0.00 5.03 0.35 -4.85 115.26 115.41 1j37 n ASN 464 Ca 0.11 -1.69 0.12 0.00 0.87 0.00 0.00 54.58 53.99 1j37 n ASN 464 Cb 0.18 -0.03 0.33 0.00 -1.02 0.00 0.00 39.78 39.24 1j37 n ASN 464 CO 0.00 0.00 0.00 -0.50 -1.83 0.00 0.00 177.26 174.93 1j37 h TRP 465 N 0.00 1.00 0.00 3.10 4.06 -1.43 -2.12 115.95 120.56 1j37 h TRP 465 Ca 0.00 0.03 -0.07 0.00 2.06 0.00 0.00 58.89 60.92 1j37 h TRP 465 Cb 0.74 -0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 28.58 1j37 h TRP 465 CO 0.00 0.30 -0.40 -0.97 -3.56 0.00 0.00 178.44 173.81 1j37 h ASN 466 N 0.78 0.00 0.43 -3.49 -0.00 -1.86 -3.32 115.58 108.13 1j37 h ASN 466 Ca 0.52 0.00 -0.31 0.00 -0.00 0.00 0.00 56.30 56.52 1j37 h ASN 466 Cb 0.79 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.09 1j37 h ASN 466 CO -0.30 0.30 -1.61 0.00 -0.00 0.00 0.00 177.43 175.82 1j37 h ALA 468 N 0.54 1.54 0.21 0.00 0.00 -1.53 0.50 119.26 120.52 1j37 h ALA 468 Ca -0.27 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1j37 h ALA 468 Cb 2.01 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1j37 h ALA 468 CO 0.13 0.24 -0.10 0.35 0.00 0.00 0.00 179.25 179.88 1j37 h PHE 469 N 1.00 -0.27 -0.08 0.00 3.57 -1.65 -1.66 116.94 117.84 1j37 h PHE 469 Ca 0.47 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.85 1j37 h PHE 469 Cb 0.43 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 1j37 h PHE 469 CO -0.00 -0.15 -0.45 -1.49 -2.23 0.00 0.00 178.31 173.98 1j37 h TRP 470 N -0.31 0.23 -0.20 0.41 4.06 -1.21 -1.28 115.95 117.65 1j37 h TRP 470 Ca -0.03 -0.07 -0.10 0.00 2.06 0.00 0.00 58.89 60.75 1j37 h TRP 470 Cb 0.24 -0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.34 1j37 h TRP 470 CO -0.06 0.62 -0.31 -0.22 -3.56 0.00 0.00 178.44 174.91 1j37 h LYS 471 N 0.16 0.41 0.00 0.49 1.63 -0.02 0.92 116.57 120.15 1j37 h LYS 471 Ca 0.01 -0.17 -0.11 0.00 -0.85 0.00 0.00 60.65 59.53 1j37 h LYS 471 Cb 0.87 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.46 1j37 h LYS 471 CO 0.07 0.68 -0.54 1.25 -3.45 0.00 0.00 179.45 177.46 1j37 h LEU 472 N 0.35 0.00 -0.06 5.20 5.85 -0.76 0.35 115.31 126.25 1j37 h LEU 472 Ca 0.05 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.59 1j37 h LEU 472 Cb 0.72 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1j37 h LEU 472 CO 0.06 0.54 -0.81 0.03 -0.34 0.00 0.00 178.44 177.91 1j37 h ARG 473 N 0.00 0.00 0.32 1.25 2.47 -0.63 -3.13 114.38 114.67 1j37 h ARG 473 Ca -0.01 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 1j37 h ARG 473 Cb 1.01 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.34 1j37 h ARG 473 CO 0.07 0.81 -0.15 0.22 0.56 0.00 0.00 179.97 181.48 1j37 h ASP 474 N 0.00 -0.36 -0.67 7.04 -0.00 -0.31 -1.86 116.42 120.25 1j37 h ASP 474 Ca -0.01 0.01 0.14 0.00 -0.00 0.00 0.00 57.03 57.17 1j37 h ASP 474 Cb 1.60 0.09 -0.13 0.00 -0.00 0.00 0.00 39.33 40.90 1j37 h ASP 474 CO 0.11 -0.02 -0.15 -0.33 -0.00 0.00 0.00 179.24 178.85 1j37 h GLU 475 N -0.91 0.01 0.03 0.28 5.08 -0.41 -1.05 114.58 117.61 1j37 h GLU 475 Ca -0.04 -0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.00 1j37 h GLU 475 Cb 0.33 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1j37 h GLU 475 CO 0.07 0.01 -1.82 0.66 -1.00 0.00 0.00 179.01 176.93 1j37 n TYR 476 N -5.44 0.99 -0.04 4.33 4.01 -1.18 -4.63 117.16 115.19 1j37 n TYR 476 Ca 0.09 0.32 -0.01 0.00 -0.16 0.00 0.00 57.90 58.14 1j37 n TYR 476 Cb 0.35 -1.17 -0.12 0.00 -0.31 0.00 0.00 39.34 38.10 1j37 n TYR 476 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1j37 n SER 477 N -3.12 1.44 -0.20 7.72 7.64 -0.73 -4.88 113.62 121.49 1j37 n SER 477 Ca -0.21 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.64 1j37 n SER 477 Cb 1.06 1.22 -0.01 0.00 -1.01 0.00 0.00 64.21 65.47 1j37 n SER 477 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j37 n GLY 478 N 1.90 0.57 3.68 0.23 0.00 -0.40 -4.95 105.19 106.22 1j37 n GLY 478 Ca -0.15 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.64 1j37 n GLY 478 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j37 s ILE 479 N -2.10 3.88 0.05 -0.61 1.09 -1.23 0.15 121.20 122.44 1j37 s ILE 479 Ca 0.00 -1.25 -0.07 0.00 -1.10 0.00 0.00 60.65 58.23 1j37 s ILE 479 Cb 0.00 -2.92 -0.01 0.00 -1.06 0.00 0.00 42.46 38.47 1j37 s ILE 479 CO 0.00 -0.04 0.14 -1.83 -0.10 0.00 0.00 174.94 173.11 1j37 s GLU 480 N -2.76 0.68 0.86 2.79 -1.05 -0.63 -3.96 118.70 114.65 1j37 s GLU 480 Ca 0.27 -0.80 -0.11 0.00 -0.15 0.00 0.00 54.97 54.18 1j37 s GLU 480 Cb -0.10 0.27 0.12 0.00 -0.44 0.00 0.00 34.13 33.98 1j37 s GLU 480 CO 0.19 -0.19 1.16 -2.14 0.95 0.00 0.00 175.26 175.23 1j37 s PRO 481 N -2.98 1.34 0.22 -4.83 0.02 -1.26 -1.09 135.00 126.43 1j37 s PRO 481 Ca -0.02 1.57 -0.07 0.00 0.02 0.00 0.00 61.00 62.50 1j37 s PRO 481 Cb 0.01 -1.76 0.19 0.00 0.02 0.00 0.00 34.50 32.96 1j37 s PRO 481 CO -0.06 -2.39 1.78 -1.35 -0.33 0.00 0.00 177.00 174.65 1j37 h PRO 482 N -1.49 1.15 -5.28 5.54 0.11 -1.94 -3.43 132.00 126.66 1j37 h PRO 482 Ca -0.44 -0.21 -0.41 0.00 0.11 0.00 0.00 66.00 65.04 1j37 h PRO 482 Cb 1.27 -0.18 -0.14 0.00 0.11 0.00 0.00 31.00 32.06 1j37 h PRO 482 CO 0.44 0.94 -0.69 0.14 -0.21 0.00 0.00 178.00 178.62 1j37 s VAL 483 N -5.49 1.35 0.23 3.15 -7.23 -1.26 -5.05 120.40 106.09 1j37 s VAL 483 Ca -0.12 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.65 1j37 s VAL 483 Cb 0.16 -2.23 -0.10 0.00 0.56 0.00 0.00 36.38 34.77 1j37 s VAL 483 CO 0.84 -0.45 1.50 -0.69 -0.31 0.00 0.00 175.10 175.98 1j37 s VAL 484 N -3.21 2.59 0.44 1.32 1.01 -1.26 -4.98 120.40 116.31 1j37 s VAL 484 Ca 0.25 0.47 0.06 0.00 0.00 0.00 0.00 61.98 62.77 1j37 s VAL 484 Cb 0.03 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1j37 s VAL 484 CO 0.08 0.06 0.17 -0.13 0.00 0.00 0.00 175.10 175.28 1j37 s ARG 485 N 0.08 2.19 0.34 2.72 1.81 0.65 -5.02 118.95 121.73 1j37 s ARG 485 Ca 0.63 -1.98 -0.03 0.00 -1.72 0.00 0.00 55.73 52.64 1j37 s ARG 485 Cb -0.43 -1.90 0.00 0.00 -0.45 0.00 0.00 34.95 32.18 1j37 s ARG 485 CO 0.40 -0.21 0.48 -1.54 -0.68 0.00 0.00 175.30 173.75 1j37 s SER 486 N -3.93 0.88 0.00 0.23 1.04 -1.26 -1.69 113.70 108.97 1j37 s SER 486 Ca 0.35 -1.47 0.08 0.00 0.48 0.00 0.00 55.95 55.39 1j37 s SER 486 Cb 0.03 0.66 0.42 0.00 0.10 0.00 0.00 66.02 67.23 1j37 s SER 486 CO 0.19 -1.30 1.15 -0.62 0.98 0.00 0.00 173.24 173.64 1j37 n GLU 487 N -0.56 0.11 0.12 4.02 -0.58 -1.20 0.26 120.64 122.81 1j37 n GLU 487 Ca 0.01 0.22 -0.02 0.00 -0.42 0.00 0.00 57.16 56.94 1j37 n GLU 487 Cb 0.62 -1.50 0.08 0.00 -0.57 0.00 0.00 31.44 30.07 1j37 n GLU 487 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1j37 h LYS 488 N 0.00 0.00 -6.58 3.49 1.57 -1.94 -3.45 116.57 109.67 1j37 h LYS 488 Ca 0.00 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.34 1j37 h LYS 488 Cb 0.08 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.42 1j37 h LYS 488 CO 0.00 0.72 -0.18 -0.51 -0.57 0.00 0.00 179.45 178.90 1j37 s ASP 489 N -6.75 5.66 -0.31 0.86 1.11 0.14 -5.02 116.67 112.35 1j37 s ASP 489 Ca -0.00 -0.11 0.01 0.00 0.18 0.00 0.00 52.55 52.62 1j37 s ASP 489 Cb 0.11 -1.02 0.14 0.00 1.07 0.00 0.00 42.92 43.22 1j37 s ASP 489 CO 0.77 -0.78 0.32 0.12 1.18 0.00 0.00 175.17 176.79 1j37 s PHE 490 N -2.47 -0.45 -0.05 4.23 5.36 -1.26 -4.69 117.98 118.65 1j37 s PHE 490 Ca 0.52 -0.31 0.13 0.00 -0.96 0.00 0.00 56.93 56.31 1j37 s PHE 490 Cb -0.10 -0.43 -0.17 0.00 -0.34 0.00 0.00 43.02 41.98 1j37 s PHE 490 CO 0.35 -0.94 0.89 -0.44 -1.46 0.00 0.00 175.22 173.62 1j37 h ASP 491 N 7.94 0.00 -1.22 6.13 3.32 -1.88 0.35 116.42 131.05 1j37 h ASP 491 Ca -0.08 0.00 0.40 0.00 0.02 0.00 0.00 57.03 57.37 1j37 h ASP 491 Cb 1.07 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.49 1j37 h ASP 491 CO 0.30 0.83 0.77 0.00 -1.72 0.00 0.00 179.24 179.42 1j37 h ALA 492 N 1.17 2.54 0.00 3.45 0.00 -1.94 0.39 119.26 124.88 1j37 h ALA 492 Ca -0.17 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1j37 h ALA 492 Cb 1.78 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1j37 h ALA 492 CO 0.08 -1.15 0.00 -2.30 0.00 0.00 0.00 179.25 175.88 1j37 n PRO 493 N -4.75 0.67 0.00 0.00 -0.02 -1.26 -2.75 135.00 126.88 1j37 n PRO 493 Ca 0.35 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.95 1j37 n PRO 493 Cb 1.29 -1.47 0.57 0.00 -0.02 0.00 0.00 33.50 33.87 1j37 n PRO 493 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j37 n ALA 494 N -0.97 2.18 -2.57 3.55 0.00 0.13 -4.39 120.51 118.44 1j37 n ALA 494 Ca 0.15 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 1j37 n ALA 494 Cb 0.07 -1.40 -0.10 0.00 0.00 0.00 0.00 19.45 18.02 1j37 n ALA 494 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1j37 s LYS 495 N -2.77 3.05 0.09 0.00 2.47 -1.11 -4.98 119.74 116.49 1j37 s LYS 495 Ca 0.18 -0.95 -0.16 0.00 -1.56 0.00 0.00 55.97 53.48 1j37 s LYS 495 Cb 0.16 -3.88 -0.03 0.00 -1.46 0.00 0.00 37.83 32.63 1j37 s LYS 495 CO 0.41 -0.67 0.81 0.98 0.16 0.00 0.00 175.35 177.04 1j37 n TYR 496 N 5.11 -0.22 0.16 4.03 9.36 -1.26 0.75 117.16 135.09 1j37 n TYR 496 Ca -0.12 0.66 0.17 0.00 3.32 0.00 0.00 57.90 61.94 1j37 n TYR 496 Cb 0.47 -0.55 0.79 0.00 -0.63 0.00 0.00 39.34 39.42 1j37 n TYR 496 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1j37 h HIS 497 N 0.00 0.00 -0.01 2.98 3.86 -1.93 0.27 115.15 120.31 1j37 h HIS 497 Ca 0.09 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.04 1j37 h HIS 497 Cb 0.22 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.71 1j37 h HIS 497 CO -0.54 0.00 -1.02 0.82 0.86 0.00 0.00 177.93 178.05 1j37 h ILE 498 N 0.00 1.29 -0.39 2.45 1.08 0.07 -1.13 117.51 120.87 1j37 h ILE 498 Ca 0.12 -2.25 -0.13 0.00 -0.39 0.00 0.00 64.86 62.21 1j37 h ILE 498 Cb 0.61 2.36 -0.01 0.00 -3.07 0.00 0.00 36.82 36.70 1j37 h ILE 498 CO -0.00 0.69 -0.25 0.28 -0.69 0.00 0.00 178.15 178.18 1j37 h SER 499 N 0.39 0.89 -0.34 1.72 0.02 -0.63 -3.20 113.55 112.40 1j37 h SER 499 Ca -0.12 -0.43 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 1j37 h SER 499 Cb 1.67 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.96 1j37 h SER 499 CO 0.20 1.13 0.00 0.00 -1.14 0.00 0.00 176.83 177.02 1j37 n ALA 500 N -2.50 2.46 -3.49 3.77 0.00 0.72 -3.77 120.51 117.70 1j37 n ALA 500 Ca -0.02 -0.68 -0.21 0.00 0.00 0.00 0.00 53.44 52.53 1j37 n ALA 500 Cb 0.46 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.95 1j37 n ALA 500 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1j37 n ASP 501 N 0.63 -6.03 -3.95 0.00 4.64 -0.97 -5.00 116.55 105.87 1j37 n ASP 501 Ca 0.15 -0.77 -0.30 0.00 -1.38 0.00 0.00 54.79 52.49 1j37 n ASP 501 Cb 0.35 -3.92 -0.16 0.00 -1.04 0.00 0.00 41.12 36.36 1j37 n ASP 501 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1j37 s VAL 502 N -3.30 1.47 0.21 5.18 1.01 -0.47 -5.06 120.40 119.45 1j37 s VAL 502 Ca 0.33 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 1j37 s VAL 502 Cb -0.10 -1.64 -0.16 0.00 0.00 0.00 0.00 36.38 34.49 1j37 s VAL 502 CO 0.82 0.07 0.91 1.21 0.00 0.00 0.00 175.10 178.11 1j37 n GLU 503 N 4.73 0.79 -0.00 2.72 2.13 -1.26 -4.73 120.64 125.02 1j37 n GLU 503 Ca -0.13 0.28 0.07 0.00 0.66 0.00 0.00 57.16 58.04 1j37 n GLU 503 Cb 0.46 -1.58 -0.10 0.00 0.27 0.00 0.00 31.44 30.49 1j37 n GLU 503 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1j37 n TYR 504 N 0.60 0.00 0.31 4.31 9.36 -1.26 -4.48 117.16 126.00 1j37 n TYR 504 Ca 0.14 0.00 0.19 0.00 3.32 0.00 0.00 57.90 61.55 1j37 n TYR 504 Cb 0.26 -0.20 1.03 0.00 -0.63 0.00 0.00 39.34 39.80 1j37 n TYR 504 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 1j37 h LEU 505 N 0.00 0.00 -2.12 2.98 5.85 -1.92 -1.15 115.31 118.96 1j37 h LEU 505 Ca 0.00 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1j37 h LEU 505 Cb 0.54 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 1j37 h LEU 505 CO 0.00 0.01 0.05 0.08 -0.34 0.00 0.00 178.44 178.24 1j37 h ARG 506 N 0.00 0.00 0.11 1.25 0.11 -1.90 -1.62 114.38 112.33 1j37 h ARG 506 Ca -0.00 0.00 -0.26 0.00 0.10 0.00 0.00 59.98 59.82 1j37 h ARG 506 Cb 0.06 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.17 1j37 h ARG 506 CO 0.00 0.00 -1.09 1.88 0.10 0.00 0.00 179.97 180.86 1j37 h TYR 507 N 0.00 0.89 0.10 4.08 0.05 -1.53 -2.15 116.97 118.42 1j37 h TYR 507 Ca 0.03 -0.56 0.01 0.00 0.05 0.00 0.00 58.73 58.25 1j37 h TYR 507 Cb 0.13 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 1j37 h TYR 507 CO 0.00 1.41 -0.11 1.25 -1.05 0.00 0.00 178.16 179.66 1j37 h LEU 508 N 0.12 -0.30 -1.21 3.88 5.85 -1.50 0.01 115.31 122.16 1j37 h LEU 508 Ca -0.17 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.63 1j37 h LEU 508 Cb 1.79 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.88 1j37 h LEU 508 CO 0.21 -0.17 0.55 -0.37 -0.34 0.00 0.00 178.44 178.32 1j37 h VAL 509 N -0.25 1.11 0.29 1.05 -1.51 -1.39 -2.80 116.25 112.74 1j37 h VAL 509 Ca 0.01 -0.34 -0.01 0.00 -1.23 0.00 0.00 66.70 65.12 1j37 h VAL 509 Cb 0.24 0.02 0.00 0.00 -2.13 0.00 0.00 31.29 29.42 1j37 h VAL 509 CO -0.04 0.18 -0.14 -1.28 -1.23 0.00 0.00 177.57 175.07 1j37 h SER 510 N 1.00 -0.33 0.00 4.19 0.87 -0.63 -2.01 113.55 116.65 1j37 h SER 510 Ca 0.34 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1j37 h SER 510 Cb 0.10 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1j37 h SER 510 CO -0.11 -0.10 0.18 -0.26 -0.53 0.00 0.00 176.83 176.01 1j37 h PHE 511 N -0.55 0.00 0.00 2.24 0.05 -0.77 0.14 116.94 118.05 1j37 h PHE 511 Ca -0.04 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.75 1j37 h PHE 511 Cb 0.41 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.36 1j37 h PHE 511 CO -0.01 0.00 -0.31 0.82 -0.18 0.00 0.00 178.31 178.62 1j37 h ILE 512 N 0.00 0.00 0.00 -0.55 2.04 -1.33 -3.40 117.51 114.27 1j37 h ILE 512 Ca 0.00 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1j37 h ILE 512 Cb 0.36 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 1j37 h ILE 512 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 178.15 177.86 1j37 h ILE 513 N -0.66 0.00 0.00 -0.67 2.10 -1.25 -2.69 117.51 114.34 1j37 h ILE 513 Ca 0.00 -0.44 -0.01 0.00 1.08 0.00 0.00 64.86 65.49 1j37 h ILE 513 Cb 0.31 1.37 -0.00 0.00 -1.09 0.00 0.00 36.82 37.41 1j37 h ILE 513 CO 0.00 0.00 -0.04 0.06 -1.08 0.00 0.00 178.15 177.09 1j37 h GLN 514 N 0.00 0.00 0.07 2.19 3.07 -0.93 0.32 115.11 119.82 1j37 h GLN 514 Ca 0.00 0.00 -0.25 0.00 0.09 0.00 0.00 58.65 58.49 1j37 h GLN 514 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.02 1j37 h GLN 514 CO 0.00 0.04 -1.18 0.74 0.09 0.00 0.00 178.83 178.52 1j37 h PHE 515 N 0.00 0.25 -0.76 0.06 0.04 -1.70 -1.55 116.94 113.28 1j37 h PHE 515 Ca -0.00 -0.19 -0.05 0.00 2.80 0.00 0.00 57.97 60.53 1j37 h PHE 515 Cb 0.21 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.32 1j37 h PHE 515 CO 0.00 1.16 0.26 1.96 -0.60 0.00 0.00 178.31 181.09 1j37 h GLN 516 N 0.04 1.16 0.19 1.51 4.20 -0.51 0.57 115.11 122.27 1j37 h GLN 516 Ca -0.10 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.37 1j37 h GLN 516 Cb 1.89 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 29.50 1j37 h GLN 516 CO 0.16 0.97 -0.09 0.74 -0.67 0.00 0.00 178.83 179.94 1j37 h PHE 517 N 1.12 -0.24 -0.46 2.96 0.05 -1.06 -2.90 116.94 116.41 1j37 h PHE 517 Ca 0.25 -0.01 0.09 0.00 3.82 0.00 0.00 57.97 62.12 1j37 h PHE 517 Cb 0.27 0.08 -0.07 0.00 2.00 0.00 0.00 35.95 38.23 1j37 h PHE 517 CO 0.02 0.12 0.01 -0.92 -0.18 0.00 0.00 178.31 177.36 1j37 h TYR 518 N -0.63 -0.02 -0.43 -0.55 3.20 -1.06 0.36 116.97 117.84 1j37 h TYR 518 Ca -0.03 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1j37 h TYR 518 Cb 0.46 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 1j37 h TYR 518 CO 0.04 -0.09 0.21 -0.22 -1.64 0.00 0.00 178.16 176.45 1j37 h LYS 519 N 0.12 0.60 0.10 1.82 3.64 -0.94 -1.04 116.57 120.88 1j37 h LYS 519 Ca 0.23 -0.07 -0.27 0.00 -1.27 0.00 0.00 60.65 59.27 1j37 h LYS 519 Cb 0.33 -0.12 0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1j37 h LYS 519 CO -0.37 0.47 -1.12 0.77 -2.27 0.00 0.00 179.45 176.93 1j37 h SER 520 N 0.60 0.80 0.21 4.20 0.02 -1.11 -2.91 113.55 115.36 1j37 h SER 520 Ca 0.15 -0.83 0.00 0.00 -0.84 0.00 0.00 61.79 60.28 1j37 h SER 520 Cb 0.07 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 1j37 h SER 520 CO -0.02 1.55 -0.21 0.00 -1.14 0.00 0.00 176.83 177.00 1j37 h ALA 521 N 0.27 -0.43 -0.71 3.77 0.00 -0.71 0.12 119.26 121.57 1j37 h ALA 521 Ca -0.17 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 54.78 1j37 h ALA 521 Cb 1.81 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.86 1j37 h ALA 521 CO 0.22 -0.77 0.47 0.00 0.00 0.00 0.00 179.25 179.16 1j37 h ILE 523 N 0.55 1.36 -0.01 0.00 2.04 -1.14 -2.36 117.51 117.93 1j37 h ILE 523 Ca 0.33 -1.62 -0.05 0.00 1.00 0.00 0.00 64.86 64.52 1j37 h ILE 523 Cb 0.55 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 1j37 h ILE 523 CO -0.11 0.49 -0.24 0.11 0.00 0.00 0.00 178.15 178.40 1j37 h LYS 524 N 0.12 0.02 -6.87 2.37 1.57 0.10 -3.40 116.57 110.48 1j37 h LYS 524 Ca -0.00 -0.01 -0.49 0.00 -1.87 0.00 0.00 60.65 58.28 1j37 h LYS 524 Cb 0.96 -0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.29 1j37 h LYS 524 CO 0.08 0.26 0.09 0.00 -0.57 0.00 0.00 179.45 179.30 1j37 s ALA 525 N -4.51 3.41 -0.07 3.86 0.00 0.15 -4.79 121.76 119.81 1j37 s ALA 525 Ca -0.04 -0.45 -0.00 0.00 0.00 0.00 0.00 51.96 51.47 1j37 s ALA 525 Cb 0.15 -2.58 0.06 0.00 0.00 0.00 0.00 23.12 20.75 1j37 s ALA 525 CO 0.71 -0.22 1.88 0.41 0.00 0.00 0.00 175.76 178.54 1j37 n GLY 526 N -1.93 2.81 0.04 0.00 0.00 -1.26 -4.17 105.19 100.68 1j37 n GLY 526 Ca 0.01 -0.25 0.01 0.00 0.00 0.00 0.00 46.02 45.79 1j37 n GLY 526 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1j37 n GLN 527 N 1.09 0.93 -4.51 1.61 1.13 -0.97 -4.99 117.38 111.68 1j37 n GLN 527 Ca 0.07 -0.09 -0.28 0.00 -1.94 0.00 0.00 57.00 54.76 1j37 n GLN 527 Cb 0.54 -1.41 -0.17 0.00 0.11 0.00 0.00 30.24 29.31 1j37 n GLN 527 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 1j37 s TYR 528 N -2.81 1.96 -0.16 1.08 5.04 -0.93 -4.60 117.35 116.92 1j37 s TYR 528 Ca -0.07 -0.90 -0.01 0.00 -2.44 0.00 0.00 57.07 53.65 1j37 s TYR 528 Cb 0.08 -1.41 0.04 0.00 0.35 0.00 0.00 41.96 41.03 1j37 s TYR 528 CO 0.68 -0.46 -0.03 0.34 -1.34 0.00 0.00 175.55 174.74 1j37 s ASP 529 N 0.93 2.73 0.19 4.32 2.15 -1.21 -4.50 116.67 121.27 1j37 s ASP 529 Ca -0.08 -0.63 -0.10 0.00 0.43 0.00 0.00 52.55 52.16 1j37 s ASP 529 Cb -0.15 -0.81 0.10 0.00 -0.30 0.00 0.00 42.92 41.76 1j37 s ASP 529 CO -0.01 -0.21 1.75 1.55 -0.17 0.00 0.00 175.17 178.09 1j37 h PRO 530 N 8.16 0.99 0.00 4.34 0.13 -1.99 -3.36 132.00 140.27 1j37 h PRO 530 Ca -0.22 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1j37 h PRO 530 Cb 1.11 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1j37 h PRO 530 CO 0.38 0.83 0.00 -3.47 -0.23 0.00 0.00 178.00 175.50 1j37 n ASP 531 N -4.41 0.00 -4.91 1.44 -0.08 -1.26 -4.82 116.55 102.51 1j37 n ASP 531 Ca 0.05 0.27 -0.27 0.00 -1.51 0.00 0.00 54.79 53.33 1j37 n ASP 531 Cb 0.17 0.00 0.07 0.00 2.34 0.00 0.00 41.12 43.70 1j37 n ASP 531 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 1j37 s ASN 532 N -2.44 4.93 0.00 1.67 -0.87 -1.26 -5.11 114.94 111.86 1j37 s ASN 532 Ca 0.00 0.67 0.00 0.00 -1.57 0.00 0.00 52.86 51.96 1j37 s ASN 532 Cb 0.00 -1.35 0.00 0.00 -0.02 0.00 0.00 41.25 39.88 1j37 s ASN 532 CO 0.00 -1.57 0.00 0.55 -2.57 0.00 0.00 177.10 173.51 1j37 n VAL 533 N -2.99 0.00 -0.62 1.60 3.14 -1.26 -4.52 118.33 113.68 1j37 n VAL 533 Ca 0.07 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.45 1j37 n VAL 533 Cb 0.60 -1.24 0.00 0.00 -1.06 0.00 0.00 33.84 32.14 1j37 n VAL 533 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1j37 n GLU 534 N 0.00 0.00 -3.09 1.45 0.00 -1.26 -4.75 120.64 112.98 1j37 n GLU 534 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 57.16 56.98 1j37 n GLU 534 Cb 0.00 -3.49 -0.02 0.00 0.00 0.00 0.00 31.44 27.93 1j37 n GLU 534 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1j37 n LEU 535 N 0.00 -0.13 -4.79 4.31 4.77 -1.26 -5.11 117.00 114.78 1j37 n LEU 535 Ca 0.00 -4.58 -0.38 0.00 -0.03 0.00 0.00 56.01 51.02 1j37 n LEU 535 Cb 0.00 0.73 -0.06 0.00 -2.33 0.00 0.00 43.42 41.76 1j37 n LEU 535 CO 0.00 2.16 0.48 -2.16 -1.33 0.00 0.00 177.39 176.54 1j37 s PRO 536 N -1.37 4.45 0.32 3.23 0.04 -1.26 -3.33 135.00 137.07 1j37 s PRO 536 Ca 0.35 1.07 0.09 0.00 0.04 0.00 0.00 61.00 62.56 1j37 s PRO 536 Cb 0.27 -3.05 0.90 0.00 0.04 0.00 0.00 34.50 32.65 1j37 s PRO 536 CO -0.10 0.47 1.67 1.25 0.04 0.00 0.00 177.00 180.32 1j37 h LEU 537 N 3.82 0.37 -0.70 -3.56 6.46 -1.92 0.14 115.31 119.92 1j37 h LEU 537 Ca -0.47 0.18 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 1j37 h LEU 537 Cb 1.20 0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.29 1j37 h LEU 537 CO 0.66 -0.09 0.00 -0.90 -0.62 0.00 0.00 178.44 177.49 1j37 n ASP 538 N -5.07 0.54 -0.76 1.25 5.75 -1.26 -3.36 116.55 113.64 1j37 n ASP 538 Ca 0.27 -1.55 0.01 0.00 -0.01 0.00 0.00 54.79 53.50 1j37 n ASP 538 Cb 0.82 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 1j37 n ASP 538 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1j37 n ASN 539 N -0.07 0.24 -4.93 -1.12 4.05 0.49 -4.81 115.26 109.10 1j37 n ASN 539 Ca 0.00 -1.97 -0.25 0.00 0.45 0.00 0.00 54.58 52.81 1j37 n ASN 539 Cb 0.14 -0.21 -0.01 0.00 1.23 0.00 0.00 39.78 40.92 1j37 n ASN 539 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1j37 n ASP 541 N -1.94 1.05 0.00 0.00 4.64 -1.26 -4.61 116.55 114.43 1j37 n ASP 541 Ca -0.03 -0.32 0.00 0.00 -1.38 0.00 0.00 54.79 53.06 1j37 n ASP 541 Cb 0.56 0.85 0.00 0.00 -1.04 0.00 0.00 41.12 41.49 1j37 n ASP 541 CO 0.00 0.00 0.00 2.30 -0.82 0.00 0.00 177.20 178.68 1j37 n ILE 542 N -0.96 0.00 -1.92 5.18 -5.35 -1.26 -4.79 119.36 110.26 1j37 n ILE 542 Ca 0.00 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.07 1j37 n ILE 542 Cb 0.00 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 37.89 1j37 n ILE 542 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1j37 s TYR 543 N 0.00 2.82 -0.16 4.28 5.04 -1.26 -1.53 117.35 126.53 1j37 s TYR 543 Ca 0.00 1.12 0.00 0.00 -2.44 0.00 0.00 57.07 55.75 1j37 s TYR 543 Cb 0.00 -3.91 0.00 0.00 0.35 0.00 0.00 41.96 38.40 1j37 s TYR 543 CO 0.00 -2.78 0.00 0.41 -1.34 0.00 0.00 175.55 171.84 1j37 n GLY 544 N 1.25 0.36 3.62 8.97 0.00 -1.25 -4.97 105.19 113.17 1j37 n GLY 544 Ca 0.03 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1j37 n GLY 544 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j37 s SER 545 N -2.12 6.67 0.06 1.61 0.15 -0.58 -4.73 113.70 114.77 1j37 s SER 545 Ca 0.00 0.74 -0.15 0.00 0.70 0.00 0.00 55.95 57.24 1j37 s SER 545 Cb 0.00 -2.39 -0.25 0.00 -1.71 0.00 0.00 66.02 61.66 1j37 s SER 545 CO 0.00 -0.53 1.15 0.00 1.20 0.00 0.00 173.24 175.06 1j37 h ALA 546 N 7.98 0.08 0.00 5.45 0.00 -1.80 -2.83 119.26 128.14 1j37 h ALA 546 Ca -0.25 -0.71 -0.04 0.00 0.00 0.00 0.00 54.91 53.91 1j37 h ALA 546 Cb 1.10 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1j37 h ALA 546 CO 0.85 0.66 -0.21 -0.09 0.00 0.00 0.00 179.25 180.46 1j37 h ARG 547 N 0.32 0.00 0.45 0.00 9.65 -1.88 0.20 114.38 123.12 1j37 h ARG 547 Ca -0.14 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.71 1j37 h ARG 547 Cb 1.73 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.32 1j37 h ARG 547 CO 0.21 0.21 -0.22 0.00 2.80 0.00 0.00 179.97 182.97 1j37 h ALA 548 N 1.79 -0.61 -0.35 2.80 0.00 -1.84 -2.21 119.26 118.84 1j37 h ALA 548 Ca -0.00 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.86 1j37 h ALA 548 Cb 0.42 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1j37 h ALA 548 CO 0.03 -0.58 0.26 0.78 0.00 0.00 0.00 179.25 179.74 1j37 h GLY 549 N -1.14 0.00 0.87 0.00 0.00 -1.33 0.04 103.07 101.51 1j37 h GLY 549 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1j37 h GLY 549 CO 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.62 1j37 h ALA 550 N 1.81 -0.07 -0.53 3.60 0.00 -0.88 0.37 119.26 123.55 1j37 h ALA 550 Ca 0.16 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1j37 h ALA 550 Cb 0.68 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1j37 h ALA 550 CO -0.00 -0.47 0.34 0.00 0.00 0.00 0.00 179.25 179.12 1j37 h ALA 551 N 0.73 0.67 0.00 0.00 0.00 -0.62 -0.08 119.26 119.96 1j37 h ALA 551 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1j37 h ALA 551 Cb 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1j37 h ALA 551 CO 0.01 0.09 0.00 0.74 0.00 0.00 0.00 179.25 180.10 1j37 h PHE 552 N 0.70 0.00 0.13 0.00 0.04 -0.46 -2.60 116.94 114.75 1j37 h PHE 552 Ca 0.20 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.63 1j37 h PHE 552 Cb -0.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 1j37 h PHE 552 CO -0.04 0.00 -1.77 1.25 -0.60 0.00 0.00 178.31 177.14 1j37 h HIS 553 N 0.00 0.52 -0.31 -0.55 2.76 0.16 -2.63 115.15 115.09 1j37 h HIS 553 Ca 0.00 -0.38 -0.04 0.00 -2.20 0.00 0.00 60.37 57.75 1j37 h HIS 553 Cb 0.09 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.02 1j37 h HIS 553 CO 0.00 1.58 0.02 -0.91 -1.30 0.00 0.00 177.93 177.32 1j37 h ASN 554 N 0.08 0.44 0.05 3.26 2.35 -0.99 -2.27 115.58 118.49 1j37 h ASN 554 Ca -0.34 -0.07 -0.10 0.00 -0.55 0.00 0.00 56.30 55.24 1j37 h ASN 554 Cb 2.05 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 40.31 1j37 h ASN 554 CO 0.14 0.49 -0.47 -0.03 -1.65 0.00 0.00 177.43 175.91 1j37 h MET 555 N 0.46 0.11 -0.33 0.81 4.05 -1.61 -3.37 114.93 115.05 1j37 h MET 555 Ca 0.10 -0.19 -0.04 0.00 -0.28 0.00 0.00 59.70 59.30 1j37 h MET 555 Cb 0.28 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.13 1j37 h MET 555 CO 0.01 1.09 0.06 -0.07 0.23 0.00 0.00 176.91 178.23 1j37 h LEU 556 N -0.75 0.52 -2.25 3.39 3.38 -1.45 -3.12 115.31 115.03 1j37 h LEU 556 Ca -0.10 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.67 1j37 h LEU 556 Cb 1.28 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1j37 h LEU 556 CO 0.03 0.64 0.23 0.77 0.09 0.00 0.00 178.44 180.20 1j37 h SER 557 N 0.38 0.00 0.35 -0.43 4.64 -1.54 -2.62 113.55 114.34 1j37 h SER 557 Ca 0.10 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.30 1j37 h SER 557 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1j37 h SER 557 CO 0.00 0.00 -0.52 0.24 -0.87 0.00 0.00 176.83 175.69 1j37 h MET 558 N 0.00 0.19 -3.83 4.77 2.86 -1.69 -3.42 114.93 113.80 1j37 h MET 558 Ca 0.07 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1j37 h MET 558 Cb 0.54 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1j37 h MET 558 CO -0.00 0.66 -0.53 0.41 1.06 0.00 0.00 176.91 178.52 1j37 n GLY 559 N 0.05 0.01 4.47 8.32 0.00 -0.99 -1.75 105.19 115.29 1j37 n GLY 559 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1j37 n GLY 559 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j37 n ALA 560 N 0.84 0.00 0.20 4.61 0.00 -1.24 -4.33 120.51 120.59 1j37 n ALA 560 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.51 1j37 n ALA 560 Cb 0.27 -0.66 0.37 0.00 0.00 0.00 0.00 19.45 19.43 1j37 n ALA 560 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1j37 n SER 561 N 0.00 0.36 -3.74 0.00 3.41 -0.72 -4.67 113.62 108.26 1j37 n SER 561 Ca 0.00 0.64 -0.13 0.00 -0.26 0.00 0.00 58.87 59.12 1j37 n SER 561 Cb 0.00 -0.70 -0.08 0.00 -0.26 0.00 0.00 64.21 63.17 1j37 n SER 561 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1j37 s LYS 562 N -3.29 0.75 0.81 4.33 -0.14 -1.26 -4.90 119.74 116.03 1j37 s LYS 562 Ca 0.00 -0.28 -0.14 0.00 -1.36 0.00 0.00 55.97 54.20 1j37 s LYS 562 Cb 0.05 0.33 0.03 0.00 -1.68 0.00 0.00 37.83 36.56 1j37 s LYS 562 CO 0.18 -0.22 0.78 -0.35 -0.76 0.00 0.00 175.35 174.98 1j37 n PRO 563 N 0.99 0.13 0.11 -1.68 -0.04 -1.26 -4.72 135.00 128.53 1j37 n PRO 563 Ca -0.20 0.10 0.14 0.00 -0.04 0.00 0.00 63.50 63.50 1j37 n PRO 563 Cb 0.57 -2.09 0.65 0.00 -0.04 0.00 0.00 33.50 32.60 1j37 n PRO 563 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 1j37 h TRP 564 N -0.85 0.03 -0.22 0.54 5.08 -1.91 -1.74 115.95 116.88 1j37 h TRP 564 Ca -0.45 0.00 0.07 0.00 1.08 0.00 0.00 58.89 59.58 1j37 h TRP 564 Cb 1.31 -0.01 -0.01 0.00 -3.00 0.00 0.00 29.16 27.45 1j37 h TRP 564 CO 0.40 0.02 0.17 -1.35 -1.28 0.00 0.00 178.44 176.41 1j37 h PRO 565 N 0.03 0.00 0.03 0.12 0.11 -1.88 0.58 132.00 131.00 1j37 h PRO 565 Ca 0.14 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.03 1j37 h PRO 565 Cb 0.51 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.61 1j37 h PRO 565 CO -0.01 0.00 -1.01 -0.44 -0.21 0.00 0.00 178.00 176.33 1j37 h ASP 566 N 0.00 0.18 -0.21 -2.05 3.45 -1.64 -2.53 116.42 113.62 1j37 h ASP 566 Ca 0.11 -0.18 -0.08 0.00 0.43 0.00 0.00 57.03 57.31 1j37 h ASP 566 Cb 0.46 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1j37 h ASP 566 CO -0.00 1.08 -0.17 0.00 -1.57 0.00 0.00 179.24 178.58 1j37 h ALA 567 N 0.90 0.30 -0.31 3.45 0.00 -0.93 -2.73 119.26 119.94 1j37 h ALA 567 Ca -0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1j37 h ALA 567 Cb 1.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1j37 h ALA 567 CO 0.15 0.21 0.11 1.25 0.00 0.00 0.00 179.25 180.97 1j37 h LEU 568 N 0.17 0.44 -2.48 0.00 5.85 -1.32 -2.23 115.31 115.73 1j37 h LEU 568 Ca 0.04 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.59 1j37 h LEU 568 Cb 0.70 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1j37 h LEU 568 CO 0.04 0.51 0.12 -0.08 -0.34 0.00 0.00 178.44 178.69 1j37 h GLU 569 N 0.35 0.00 0.00 1.25 4.81 -0.89 1.05 114.58 121.16 1j37 h GLU 569 Ca 0.10 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1j37 h GLU 569 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1j37 h GLU 569 CO -0.01 0.00 -0.00 0.00 -0.73 0.00 0.00 179.01 178.27 1j37 h ALA 570 N 1.83 1.00 0.00 2.92 0.00 -1.08 -0.62 119.26 123.30 1j37 h ALA 570 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1j37 h ALA 570 Cb 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1j37 h ALA 570 CO -0.00 0.00 -0.28 0.35 0.00 0.00 0.00 179.25 179.32 1j37 h PHE 571 N 0.00 0.00 0.00 0.00 3.57 0.13 -3.41 116.94 117.23 1j37 h PHE 571 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1j37 h PHE 571 Cb 0.97 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1j37 h PHE 571 CO 0.00 0.47 -0.36 0.27 -2.23 0.00 0.00 178.31 176.45 1j37 n ASN 572 N -4.65 0.38 0.00 0.41 0.23 -0.64 -4.83 115.26 106.15 1j37 n ASN 572 Ca -0.09 -2.05 0.00 0.00 -0.53 0.00 0.00 54.58 51.92 1j37 n ASN 572 Cb 0.27 -0.21 0.00 0.00 -2.08 0.00 0.00 39.78 37.77 1j37 n ASN 572 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1j37 n GLY 573 N -0.22 2.24 3.95 4.83 0.00 -0.24 -5.01 105.19 110.75 1j37 n GLY 573 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1j37 n GLY 573 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j37 s GLU 574 N -0.14 3.44 -0.02 1.61 2.02 -1.26 -4.88 118.70 119.47 1j37 s GLU 574 Ca 0.00 -0.48 0.03 0.00 0.02 0.00 0.00 54.97 54.54 1j37 s GLU 574 Cb 0.00 -2.73 0.05 0.00 0.10 0.00 0.00 34.13 31.55 1j37 s GLU 574 CO 0.00 0.21 0.95 0.54 0.02 0.00 0.00 175.26 176.98 1j37 n ARG 575 N -1.69 0.32 -4.28 1.61 1.74 -1.26 -1.77 116.66 111.33 1j37 n ARG 575 Ca -0.06 -1.20 -0.20 0.00 -0.77 0.00 0.00 57.85 55.63 1j37 n ARG 575 Cb 0.57 -0.68 -0.13 0.00 -1.02 0.00 0.00 32.46 31.20 1j37 n ARG 575 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1j37 s ILE 576 N -0.50 1.18 -0.08 0.55 1.01 -1.26 -4.76 121.20 117.33 1j37 s ILE 576 Ca 0.05 -1.19 -0.18 0.00 0.00 0.00 0.00 60.65 59.33 1j37 s ILE 576 Cb 0.05 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.37 1j37 s ILE 576 CO 0.00 -0.09 0.49 -0.32 0.00 0.00 0.00 174.94 175.03 1j37 s MET 577 N -1.46 4.29 0.21 2.79 -2.45 -1.26 -5.07 119.30 116.35 1j37 s MET 577 Ca 0.01 0.50 -0.12 0.00 -1.25 0.00 0.00 55.69 54.83 1j37 s MET 577 Cb -0.09 -3.40 -0.00 0.00 1.25 0.00 0.00 34.83 32.59 1j37 s MET 577 CO 0.02 0.25 0.42 -1.54 1.05 0.00 0.00 175.02 175.23 1j37 s SER 578 N 0.29 -0.08 0.00 1.11 1.04 -1.26 -5.02 113.70 109.78 1j37 s SER 578 Ca 0.27 -0.84 0.27 0.00 0.48 0.00 0.00 55.95 56.12 1j37 s SER 578 Cb -0.16 0.54 1.15 0.00 0.10 0.00 0.00 66.02 67.65 1j37 s SER 578 CO 0.12 -1.05 1.79 0.61 0.98 0.00 0.00 173.24 175.69 1j37 n GLY 579 N -0.32 -0.20 3.01 7.32 0.00 -1.26 -4.59 105.19 109.15 1j37 n GLY 579 Ca -0.05 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 1j37 n GLY 579 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1j37 n LYS 580 N -0.09 2.56 0.00 1.61 4.81 -1.26 -3.44 118.16 122.36 1j37 n LYS 580 Ca 0.19 -2.56 0.00 0.00 -0.87 0.00 0.00 58.31 55.07 1j37 n LYS 580 Cb 0.28 -3.28 0.00 0.00 0.02 0.00 0.00 35.03 32.05 1j37 n LYS 580 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j37 n ALA 581 N 7.31 0.00 0.00 3.14 0.00 -1.26 -4.85 120.51 124.85 1j37 n ALA 581 Ca 0.51 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.84 1j37 n ALA 581 Cb 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.77 1j37 n ALA 581 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1j37 h ILE 582 N 0.00 1.09 -0.57 0.00 5.03 -1.85 -2.58 117.51 118.63 1j37 h ILE 582 Ca 0.00 -1.45 0.06 0.00 -0.12 0.00 0.00 64.86 63.36 1j37 h ILE 582 Cb 0.00 1.90 -0.06 0.00 -3.03 0.00 0.00 36.82 35.64 1j37 h ILE 582 CO 0.00 0.31 0.26 0.00 -0.68 0.00 0.00 178.15 178.04 1j37 h ALA 583 N -0.19 0.73 -0.08 1.87 0.00 -1.94 0.35 119.26 120.00 1j37 h ALA 583 Ca -0.01 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1j37 h ALA 583 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1j37 h ALA 583 CO 0.02 -0.11 -0.20 1.49 0.00 0.00 0.00 179.25 180.45 1j37 h GLU 584 N 0.49 0.14 -0.02 0.00 4.81 -1.82 0.16 114.58 118.34 1j37 h GLU 584 Ca 0.26 -0.04 -0.24 0.00 -0.13 0.00 0.00 59.36 59.22 1j37 h GLU 584 Cb 0.23 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.61 1j37 h GLU 584 CO -0.22 0.34 -0.95 -0.92 -0.73 0.00 0.00 179.01 176.54 1j37 h TYR 585 N 0.13 0.83 -0.59 0.92 3.20 -0.69 -3.29 116.97 117.47 1j37 h TYR 585 Ca 0.02 -0.43 0.00 0.00 3.14 0.00 0.00 58.73 61.46 1j37 h TYR 585 Cb 0.44 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1j37 h TYR 585 CO 0.00 1.26 0.00 1.19 -1.64 0.00 0.00 178.16 178.97 1j37 n PHE 586 N -3.82 1.21 0.00 -3.82 3.72 0.11 -4.61 117.46 110.26 1j37 n PHE 586 Ca -0.08 -0.60 -0.10 0.00 -0.05 0.00 0.00 57.45 56.62 1j37 n PHE 586 Cb 0.83 -0.18 -0.04 0.00 -0.94 0.00 0.00 39.48 39.16 1j37 n PHE 586 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1j37 h GLU 587 N 3.65 -0.12 0.00 -1.08 4.57 -0.76 -0.71 114.58 120.13 1j37 h GLU 587 Ca 0.00 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1j37 h GLU 587 Cb 1.27 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1j37 h GLU 587 CO 0.16 -0.08 -0.03 -1.00 -1.18 0.00 0.00 179.01 176.88 1j37 h PRO 588 N -0.13 0.00 0.09 0.92 0.13 -1.85 -2.26 132.00 128.90 1j37 h PRO 588 Ca 0.08 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1j37 h PRO 588 Cb 0.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.37 1j37 h PRO 588 CO -0.19 0.03 -0.04 1.25 -0.23 0.00 0.00 178.00 178.82 1j37 h LEU 589 N 0.00 -0.10 -0.90 1.56 6.46 -1.61 -2.81 115.31 117.91 1j37 h LEU 589 Ca -0.00 -0.44 0.24 0.00 -0.12 0.00 0.00 57.88 57.56 1j37 h LEU 589 Cb 0.09 0.03 -0.13 0.00 -0.73 0.00 0.00 40.66 39.91 1j37 h LEU 589 CO 0.00 0.55 0.36 -0.09 -0.62 0.00 0.00 178.44 178.65 1j37 h ARG 590 N -0.93 0.31 -0.30 1.25 1.12 -0.83 0.20 114.38 115.21 1j37 h ARG 590 Ca -0.01 -0.02 -0.15 0.00 -1.11 0.00 0.00 59.98 58.69 1j37 h ARG 590 Cb 0.53 -0.07 -0.00 0.00 -0.01 0.00 0.00 29.97 30.42 1j37 h ARG 590 CO 0.02 0.21 -0.38 -0.39 -3.11 0.00 0.00 179.97 176.32 1j37 h VAL 591 N 0.32 1.29 -0.52 0.20 -1.51 -1.52 -2.94 116.25 111.58 1j37 h VAL 591 Ca 0.58 -1.56 0.04 0.00 -1.23 0.00 0.00 66.70 64.52 1j37 h VAL 591 Cb 1.16 1.58 -0.03 0.00 -2.13 0.00 0.00 31.29 31.88 1j37 h VAL 591 CO -0.58 0.51 0.35 -0.25 -1.23 0.00 0.00 177.57 176.36 1j37 h TRP 592 N 0.55 0.56 0.23 5.19 7.01 -0.39 -3.19 115.95 125.91 1j37 h TRP 592 Ca 0.04 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 1j37 h TRP 592 Cb 0.97 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.85 1j37 h TRP 592 CO 0.07 0.32 -0.11 -0.07 -2.79 0.00 0.00 178.44 175.87 1j37 h LEU 593 N 0.58 -0.26 -0.90 0.65 3.38 -1.10 -2.45 115.31 115.20 1j37 h LEU 593 Ca 0.21 -0.26 0.22 0.00 0.09 0.00 0.00 57.88 58.14 1j37 h LEU 593 Cb 0.12 0.07 -0.17 0.00 0.09 0.00 0.00 40.66 40.78 1j37 h LEU 593 CO -0.06 0.23 -0.05 -0.33 0.09 0.00 0.00 178.44 178.33 1j37 h GLU 594 N -0.87 0.04 0.82 1.13 5.08 -1.51 0.90 114.58 120.17 1j37 h GLU 594 Ca -0.03 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1j37 h GLU 594 Cb 0.51 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.76 1j37 h GLU 594 CO 0.05 0.02 -0.39 0.00 -1.00 0.00 0.00 179.01 177.69 1j37 h ALA 595 N 1.88 -1.10 -0.99 3.43 0.00 -1.64 -2.82 119.26 118.02 1j37 h ALA 595 Ca 0.50 -0.24 0.21 0.00 0.00 0.00 0.00 54.91 55.38 1j37 h ALA 595 Cb 0.92 0.42 -0.10 0.00 0.00 0.00 0.00 17.79 19.04 1j37 h ALA 595 CO -0.85 -1.03 0.62 1.49 0.00 0.00 0.00 179.25 179.48 1j37 h GLU 596 N -1.27 0.60 0.00 0.00 4.57 -0.41 -0.43 114.58 117.64 1j37 h GLU 596 Ca -0.11 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 57.98 1j37 h GLU 596 Cb 0.85 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 1j37 h GLU 596 CO 0.18 0.40 -0.27 -0.91 -1.18 0.00 0.00 179.01 177.24 1j37 h ASN 597 N 0.62 0.00 0.48 1.04 2.35 0.78 -1.95 115.58 118.90 1j37 h ASN 597 Ca 0.57 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 56.02 1j37 h ASN 597 Cb 1.08 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.46 1j37 h ASN 597 CO -0.34 0.27 -1.42 0.40 -1.65 0.00 0.00 177.43 174.69 1j37 h ILE 598 N 0.00 1.30 -0.34 2.81 2.04 -0.87 0.76 117.51 123.21 1j37 h ILE 598 Ca -0.00 -2.87 -0.06 0.00 1.00 0.00 0.00 64.86 62.92 1j37 h ILE 598 Cb 0.69 2.88 -0.02 0.00 -0.74 0.00 0.00 36.82 39.63 1j37 h ILE 598 CO 0.03 0.85 -0.05 0.50 0.00 0.00 0.00 178.15 179.48 1j37 h LYS 599 N 0.09 0.55 -0.02 2.37 3.64 -0.95 -2.59 116.57 119.66 1j37 h LYS 599 Ca -0.21 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1j37 h LYS 599 Cb 2.03 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.78 1j37 h LYS 599 CO 0.20 0.62 -0.25 0.09 -2.27 0.00 0.00 179.45 177.83 1j37 n ASN 600 N -4.24 2.45 -3.12 4.20 3.02 -0.76 -4.98 115.26 111.84 1j37 n ASN 600 Ca 0.01 -1.72 -0.11 0.00 -0.03 0.00 0.00 54.58 52.72 1j37 n ASN 600 Cb 0.28 0.26 0.05 0.00 -0.61 0.00 0.00 39.78 39.77 1j37 n ASN 600 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1j37 n ASN 601 N 0.60 -6.61 -4.73 6.41 4.05 -0.80 -4.96 115.26 109.21 1j37 n ASN 601 Ca 0.11 -0.55 -0.36 0.00 0.45 0.00 0.00 54.58 54.23 1j37 n ASN 601 Cb 0.52 -4.98 -0.07 0.00 1.23 0.00 0.00 39.78 36.48 1j37 n ASN 601 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1j37 s VAL 602 N -3.30 5.30 0.07 3.44 1.01 0.26 -5.01 120.40 122.17 1j37 s VAL 602 Ca 0.35 0.56 -0.31 0.00 0.00 0.00 0.00 61.98 62.59 1j37 s VAL 602 Cb -0.05 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1j37 s VAL 602 CO 0.70 0.40 1.25 -2.28 0.00 0.00 0.00 175.10 175.16 1j37 s HIS 603 N 0.41 3.38 -0.07 5.22 2.46 -1.26 -4.86 115.29 120.57 1j37 s HIS 603 Ca 0.17 1.21 0.01 0.00 0.47 0.00 0.00 55.06 56.93 1j37 s HIS 603 Cb -0.13 -3.48 -0.03 0.00 -0.13 0.00 0.00 32.58 28.81 1j37 s HIS 603 CO 0.04 -1.55 -0.10 0.42 -2.47 0.00 0.00 174.74 171.08 1j37 s ILE 604 N 1.10 3.41 0.00 0.89 -1.09 -1.26 -4.41 121.20 119.84 1j37 s ILE 604 Ca 0.60 -0.58 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 1j37 s ILE 604 Cb -0.31 -2.38 0.00 0.00 -1.58 0.00 0.00 42.46 38.18 1j37 s ILE 604 CO 0.29 0.58 0.00 0.61 -1.23 0.00 0.00 174.94 175.20 1j37 n GLY 605 N 2.46 -0.09 3.27 6.18 0.00 -1.26 -5.07 105.19 110.69 1j37 n GLY 605 Ca -0.18 -1.76 -0.11 0.00 0.00 0.00 0.00 46.02 43.98 1j37 n GLY 605 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1j37 s TRP 606 N -2.24 -0.12 0.26 1.61 1.48 -1.26 -4.72 118.94 113.95 1j37 s TRP 606 Ca 0.00 -0.09 -0.12 0.00 -1.06 0.00 0.00 56.10 54.83 1j37 s TRP 606 Cb 0.00 0.13 -0.08 0.00 -1.16 0.00 0.00 33.47 32.37 1j37 s TRP 606 CO 0.00 -0.57 0.63 -1.50 -4.06 0.00 0.00 176.95 171.45 1j37 s ILE 607 N -3.04 4.82 0.83 0.66 1.10 -0.72 -4.99 121.20 119.86 1j37 s ILE 607 Ca -0.02 0.68 -0.15 0.00 -0.51 0.00 0.00 60.65 60.65 1j37 s ILE 607 Cb 0.01 -3.62 -0.04 0.00 0.15 0.00 0.00 42.46 38.96 1j37 s ILE 607 CO -0.06 -0.11 0.24 0.35 -2.11 0.00 0.00 174.94 173.25 1j37 n THR 608 N -0.19 0.78 -2.97 4.00 -2.24 -1.26 -4.29 114.28 108.11 1j37 n THR 608 Ca 0.02 -0.35 -0.31 0.00 -2.27 0.00 0.00 64.05 61.13 1j37 n THR 608 Cb 0.53 -0.54 -0.04 0.00 -2.10 0.00 0.00 70.33 68.18 1j37 n THR 608 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1j37 s SER 609 N -1.56 6.62 -0.21 3.42 0.15 -1.26 -4.87 113.70 116.00 1j37 s SER 609 Ca 0.58 1.19 0.13 0.00 0.70 0.00 0.00 55.95 58.55 1j37 s SER 609 Cb -0.29 -2.34 0.42 0.00 -1.71 0.00 0.00 66.02 62.10 1j37 s SER 609 CO 0.66 -0.32 1.27 0.59 1.20 0.00 0.00 173.24 176.63 1j37 n ASN 610 N -0.92 2.18 -0.27 5.45 5.03 -1.26 -4.71 115.26 120.76 1j37 n ASN 610 Ca 0.03 -3.62 0.11 0.00 0.87 0.00 0.00 54.58 51.97 1j37 n ASN 610 Cb 0.54 -0.53 0.05 0.00 -1.02 0.00 0.00 39.78 38.81 1j37 n ASN 610 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1j37 n LYS 611 N -1.15 0.70 -3.77 3.52 4.76 -1.26 -4.82 118.16 116.14 1j37 n LYS 611 Ca 0.22 -0.55 -0.37 0.00 -2.87 0.00 0.00 58.31 54.74 1j37 n LYS 611 Cb 0.77 -1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 32.34 1j37 n LYS 611 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1j37 n VAL 613 N 4.86 0.00 -3.45 0.00 0.24 -0.68 -5.00 118.33 114.29 1j37 n VAL 613 Ca -0.15 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.16 1j37 n VAL 613 Cb 0.48 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.80 1j37 n VAL 613 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1j37 s SER 614 N 1.21 -0.54 0.98 -1.34 0.01 -1.26 -3.25 113.70 109.51 1j37 s SER 614 Ca 0.00 0.76 0.00 0.00 1.31 0.00 0.00 55.95 58.02 1j37 s SER 614 Cb 0.00 1.54 0.00 0.00 0.21 0.00 0.00 66.02 67.77 1j37 s SER 614 CO 0.00 -0.11 0.00 -0.24 0.41 0.00 0.00 173.24 173.30 1j37 n SER 615 N 4.67 0.00 -0.73 2.44 2.88 -1.26 -5.05 113.62 116.56 1j37 n SER 615 Ca -0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 1j37 n SER 615 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1j37 n SER 615 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1j37 n HIS 616 N 6.89 0.00 -4.28 0.66 -0.00 -1.26 -5.05 115.22 112.18 1j37 n HIS 616 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.57 1j37 n HIS 616 Cb 0.00 -0.99 -0.10 0.00 -0.00 0.00 0.00 29.99 28.90 1j37 n HIS 616 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1j37 s HIS 617 N 0.00 1.39 -0.32 1.57 0.09 -1.26 -5.06 115.29 111.69 1j37 s HIS 617 Ca 0.00 -0.71 0.07 0.00 -0.00 0.00 0.00 55.06 54.43 1j37 s HIS 617 Cb 0.00 -0.68 0.48 0.00 -0.00 0.00 0.00 32.58 32.38 1j37 s HIS 617 CO 0.00 0.16 1.44 0.72 -0.00 0.00 0.00 174.74 177.06 1j37 n HIS 618 N -0.24 1.57 -3.63 1.40 8.25 -1.26 -4.94 115.22 116.37 1j37 n HIS 618 Ca -0.10 -1.88 -0.39 0.00 -0.26 0.00 0.00 57.72 55.09 1j37 n HIS 618 Cb 0.60 -0.54 -0.10 0.00 1.12 0.00 0.00 29.99 31.08 1j37 n HIS 618 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1j37 s HIS 619 N -3.39 3.44 -0.46 4.41 0.09 -1.26 -5.41 115.29 112.71 1j37 s HIS 619 Ca 0.48 -1.93 0.04 0.00 -0.00 0.00 0.00 55.06 53.64 1j37 s HIS 619 Cb 0.42 -3.25 0.03 0.00 -0.00 0.00 0.00 32.58 29.77 1j37 s HIS 619 CO -0.00 -0.95 0.62 1.58 -0.00 0.00 0.00 174.74 175.99