#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p62 s ILE 21 N 0.00 4.05 0.18 0.55 1.01 -1.26 -4.73 121.20 121.00 1p62 s ILE 21 Ca 0.00 1.40 -0.30 0.00 0.00 0.00 0.00 60.65 61.75 1p62 s ILE 21 Cb 0.00 -3.90 -0.08 0.00 0.01 0.00 0.00 42.46 38.50 1p62 s ILE 21 CO 0.00 -0.01 1.08 -0.54 0.00 0.00 0.00 174.94 175.47 1p62 s LYS 22 N 2.32 4.62 -0.14 2.79 1.02 -1.09 -4.96 119.74 124.31 1p62 s LYS 22 Ca 0.59 1.69 0.02 0.00 0.02 0.00 0.00 55.97 58.29 1p62 s LYS 22 Cb -0.27 -3.28 0.01 0.00 -0.52 0.00 0.00 37.83 33.77 1p62 s LYS 22 CO 0.23 0.12 -0.21 0.15 -0.92 0.00 0.00 175.35 174.73 1p62 s LYS 23 N -0.47 3.06 -0.09 1.68 1.02 -1.26 -1.06 119.74 122.62 1p62 s LYS 23 Ca 0.48 -0.84 0.02 0.00 0.02 0.00 0.00 55.97 55.65 1p62 s LYS 23 Cb -0.29 -2.45 0.01 0.00 -0.52 0.00 0.00 37.83 34.59 1p62 s LYS 23 CO 0.35 0.02 -0.14 0.42 -0.92 0.00 0.00 175.35 175.08 1p62 s ILE 24 N 0.73 1.37 -0.12 2.17 -1.09 -0.12 -1.02 121.20 123.12 1p62 s ILE 24 Ca -0.09 -0.59 -0.15 0.00 -2.23 0.00 0.00 60.65 57.59 1p62 s ILE 24 Cb -0.16 -1.25 -0.05 0.00 -1.58 0.00 0.00 42.46 39.43 1p62 s ILE 24 CO 0.00 0.41 0.38 -0.55 -1.23 0.00 0.00 174.94 173.95 1p62 s SER 25 N 0.80 6.59 -0.31 3.58 0.15 -0.84 -0.62 113.70 123.04 1p62 s SER 25 Ca -0.11 0.69 -0.16 0.00 0.70 0.00 0.00 55.95 57.07 1p62 s SER 25 Cb -0.16 -2.23 -0.02 0.00 -1.71 0.00 0.00 66.02 61.91 1p62 s SER 25 CO 0.02 0.10 0.44 -0.63 1.20 0.00 0.00 173.24 174.37 1p62 s ILE 26 N 0.27 5.10 0.11 6.45 1.01 0.08 -0.52 121.20 133.71 1p62 s ILE 26 Ca 0.21 0.41 0.08 0.00 0.00 0.00 0.00 60.65 61.35 1p62 s ILE 26 Cb -0.14 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1p62 s ILE 26 CO 0.08 -0.04 -0.12 -1.61 0.00 0.00 0.00 174.94 173.24 1p62 s GLU 27 N 2.21 2.03 0.00 2.79 0.41 -0.45 -1.15 118.70 124.53 1p62 s GLU 27 Ca 0.16 -1.07 0.00 0.00 -0.41 0.00 0.00 54.97 53.66 1p62 s GLU 27 Cb -0.16 -2.25 0.00 0.00 -1.78 0.00 0.00 34.13 29.94 1p62 s GLU 27 CO 0.11 0.50 0.00 0.41 -0.49 0.00 0.00 175.26 175.79 1p62 n GLY 28 N 0.74 1.78 3.61 -1.39 0.00 -1.26 -1.30 105.19 107.36 1p62 n GLY 28 Ca -0.14 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 1p62 n GLY 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1p62 s ASN 29 N 0.00 2.28 -0.17 1.61 3.84 -1.26 -4.89 114.94 116.35 1p62 s ASN 29 Ca 0.00 1.74 -0.39 0.00 0.21 0.00 0.00 52.86 54.42 1p62 s ASN 29 Cb 0.00 -2.37 -0.16 0.00 -0.55 0.00 0.00 41.25 38.17 1p62 s ASN 29 CO 0.00 -3.43 1.60 -0.38 -2.79 0.00 0.00 177.10 172.10 1p62 n ILE 30 N -4.42 0.20 -1.52 -5.21 5.41 -1.26 -1.75 119.36 110.81 1p62 n ILE 30 Ca 0.07 -0.04 -0.16 0.00 1.00 0.00 0.00 62.75 63.62 1p62 n ILE 30 Cb 0.54 -1.05 -0.07 0.00 -0.71 0.00 0.00 39.64 38.35 1p62 n ILE 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1p62 n ALA 31 N 4.37 -0.26 0.19 -1.39 0.00 -1.26 -4.75 120.51 117.41 1p62 n ALA 31 Ca 0.24 0.25 0.04 0.00 0.00 0.00 0.00 53.44 53.98 1p62 n ALA 31 Cb 0.14 -1.71 0.40 0.00 0.00 0.00 0.00 19.45 18.28 1p62 n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p62 h ALA 32 N 0.04 1.28 0.00 0.00 0.00 -1.68 -3.44 119.26 115.46 1p62 h ALA 32 Ca -0.33 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1p62 h ALA 32 Cb 1.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1p62 h ALA 32 CO 0.48 0.44 0.00 0.41 0.00 0.00 0.00 179.25 180.58 1p62 n GLY 33 N -0.34 1.61 0.23 0.00 0.00 -1.26 -4.95 105.19 100.48 1p62 n GLY 33 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1p62 n GLY 33 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p62 h LYS 34 N 0.00 0.74 -0.13 1.61 1.57 -1.90 0.41 116.57 118.87 1p62 h LYS 34 Ca 0.00 -0.15 -0.16 0.00 -1.87 0.00 0.00 60.65 58.47 1p62 h LYS 34 Cb 0.00 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.21 1p62 h LYS 34 CO 0.00 0.69 -0.54 0.77 -0.57 0.00 0.00 179.45 179.81 1p62 h SER 35 N 0.64 0.69 -0.76 0.86 0.02 -1.98 0.64 113.55 113.66 1p62 h SER 35 Ca 0.16 -0.62 0.12 0.00 -0.84 0.00 0.00 61.79 60.60 1p62 h SER 35 Cb 0.26 -0.20 -0.08 0.00 0.14 0.00 0.00 62.40 62.51 1p62 h SER 35 CO -0.01 1.20 0.37 0.74 -1.14 0.00 0.00 176.83 177.99 1p62 h THR 36 N 0.23 0.76 -0.14 -2.27 2.02 -1.97 0.12 112.91 111.66 1p62 h THR 36 Ca -0.03 -0.20 -0.20 0.00 0.77 0.00 0.00 66.41 66.75 1p62 h THR 36 Cb 1.17 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1p62 h THR 36 CO 0.11 0.10 -0.72 0.15 0.37 0.00 0.00 175.52 175.54 1p62 h PHE 37 N 0.57 0.85 -0.08 3.16 3.57 -0.59 -3.02 116.94 121.40 1p62 h PHE 37 Ca 0.40 -0.36 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 1p62 h PHE 37 Cb 0.52 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1p62 h PHE 37 CO -0.12 1.16 -0.36 0.28 -2.23 0.00 0.00 178.31 177.04 1p62 h VAL 38 N 0.45 1.28 0.00 1.41 2.07 -0.25 -3.00 116.25 118.20 1p62 h VAL 38 Ca -0.03 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.15 1p62 h VAL 38 Cb 1.32 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 1p62 h VAL 38 CO 0.14 0.40 0.00 0.59 0.02 0.00 0.00 177.57 178.71 1p62 n ASN 39 N -4.08 0.00 -0.62 0.57 3.02 0.36 -1.88 115.26 112.63 1p62 n ASN 39 Ca -0.01 0.31 0.07 0.00 -0.03 0.00 0.00 54.58 54.92 1p62 n ASN 39 Cb 0.42 -0.42 0.09 0.00 -0.61 0.00 0.00 39.78 39.26 1p62 n ASN 39 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1p62 n ILE 40 N -1.42 0.19 -0.04 2.41 -6.64 -1.13 -4.71 119.36 108.02 1p62 n ILE 40 Ca 0.07 -0.60 -0.15 0.00 -1.77 0.00 0.00 62.75 60.30 1p62 n ILE 40 Cb 0.22 1.14 -0.12 0.00 -1.44 0.00 0.00 39.64 39.44 1p62 n ILE 40 CO 0.00 0.00 0.00 -0.07 -1.77 0.00 0.00 176.55 174.71 1p62 h LEU 41 N 2.77 0.11 -2.48 7.28 3.38 -1.46 -3.32 115.31 121.59 1p62 h LEU 41 Ca 0.00 -0.86 -0.00 0.00 0.09 0.00 0.00 57.88 57.10 1p62 h LEU 41 Cb 0.64 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1p62 h LEU 41 CO 0.00 0.97 -0.02 0.11 0.09 0.00 0.00 178.44 179.59 1p62 h LYS 42 N -0.72 0.00 0.00 1.13 1.57 -1.84 -1.07 116.57 115.63 1p62 h LYS 42 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1p62 h LYS 42 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1p62 h LYS 42 CO 0.03 0.02 -0.03 0.00 -0.57 0.00 0.00 179.45 178.90 1p62 n GLN 43 N -3.61 0.12 0.00 3.15 10.64 -1.25 -3.10 117.38 123.33 1p62 n GLN 43 Ca -0.03 0.09 0.13 0.00 -1.83 0.00 0.00 57.00 55.37 1p62 n GLN 43 Cb 0.11 -1.64 0.41 0.00 -0.86 0.00 0.00 30.24 28.27 1p62 n GLN 43 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1p62 n LEU 44 N -1.84 0.43 -3.62 2.61 4.77 -0.40 -4.90 117.00 114.04 1p62 n LEU 44 Ca 0.06 0.10 0.01 0.00 -0.03 0.00 0.00 56.01 56.15 1p62 n LEU 44 Cb 0.38 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 1p62 n LEU 44 CO 0.29 0.09 0.89 0.00 -1.33 0.00 0.00 177.39 177.34 1p62 h GLU 46 N 5.57 0.00 -0.22 0.00 3.07 -1.91 -2.83 114.58 118.26 1p62 h GLU 46 Ca -0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.60 1p62 h GLU 46 Cb 1.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1p62 h GLU 46 CO 0.21 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.57 1p62 n ASP 47 N -3.00 1.31 -4.78 1.42 8.00 -1.26 -4.88 116.55 113.35 1p62 n ASP 47 Ca 0.00 -1.90 -0.36 0.00 0.71 0.00 0.00 54.79 53.24 1p62 n ASP 47 Cb 0.27 -0.14 -0.08 0.00 -0.02 0.00 0.00 41.12 41.15 1p62 n ASP 47 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1p62 s TRP 48 N -1.71 3.39 0.08 1.24 0.52 -1.07 -2.14 118.94 119.25 1p62 s TRP 48 Ca 0.21 0.37 0.02 0.00 0.02 0.00 0.00 56.10 56.71 1p62 s TRP 48 Cb 0.11 -1.87 -0.04 0.00 -1.15 0.00 0.00 33.47 30.52 1p62 s TRP 48 CO 0.15 0.60 -0.07 -2.00 0.02 0.00 0.00 176.95 175.65 1p62 s GLU 49 N -0.93 0.74 -0.02 4.98 2.56 -0.32 -4.79 118.70 120.93 1p62 s GLU 49 Ca 0.14 -1.15 0.05 0.00 0.00 0.00 0.00 54.97 54.01 1p62 s GLU 49 Cb -0.12 -0.25 -0.01 0.00 2.00 0.00 0.00 34.13 35.75 1p62 s GLU 49 CO 0.03 0.01 -0.18 0.08 -0.56 0.00 0.00 175.26 174.64 1p62 s VAL 50 N -2.90 1.43 -0.53 3.70 1.01 -1.26 -1.15 120.40 120.70 1p62 s VAL 50 Ca 0.05 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 1p62 s VAL 50 Cb 0.00 -1.20 0.14 0.00 0.00 0.00 0.00 36.38 35.33 1p62 s VAL 50 CO -0.03 0.41 0.34 -0.69 0.00 0.00 0.00 175.10 175.12 1p62 s VAL 51 N -0.34 3.46 0.70 2.92 1.01 -0.21 -4.95 120.40 123.00 1p62 s VAL 51 Ca 0.05 -2.64 -0.16 0.00 0.00 0.00 0.00 61.98 59.23 1p62 s VAL 51 Cb -0.08 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 33.01 1p62 s VAL 51 CO -0.00 -0.80 1.22 -2.16 0.00 0.00 0.00 175.10 173.36 1p62 s PRO 52 N 0.38 2.31 0.23 2.72 0.05 -1.26 -1.29 135.00 138.14 1p62 s PRO 52 Ca 0.14 1.82 -0.31 0.00 0.05 0.00 0.00 61.00 62.69 1p62 s PRO 52 Cb -0.21 -1.85 -0.12 0.00 0.05 0.00 0.00 34.50 32.37 1p62 s PRO 52 CO -0.04 -1.72 1.67 -1.91 0.05 0.00 0.00 177.00 175.05 1p62 n GLU 53 N -2.44 2.70 -1.81 4.56 2.13 -1.26 -4.82 120.64 119.70 1p62 n GLU 53 Ca 0.14 0.97 -0.42 0.00 0.66 0.00 0.00 57.16 58.51 1p62 n GLU 53 Cb 0.50 -2.78 -0.00 0.00 0.27 0.00 0.00 31.44 29.42 1p62 n GLU 53 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1p62 n PRO 54 N 3.28 3.15 0.22 5.31 -0.04 -1.26 -4.66 135.00 141.00 1p62 n PRO 54 Ca 0.13 -2.76 0.10 0.00 -0.04 0.00 0.00 63.50 60.94 1p62 n PRO 54 Cb 0.35 -3.15 0.40 0.00 -0.04 0.00 0.00 33.50 31.07 1p62 n PRO 54 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1p62 h VAL 55 N 3.79 0.49 0.06 0.52 2.07 -2.00 -2.94 116.25 118.24 1p62 h VAL 55 Ca 0.58 -1.19 -0.27 0.00 0.82 0.00 0.00 66.70 66.64 1p62 h VAL 55 Cb 0.59 1.84 0.02 0.00 -1.52 0.00 0.00 31.29 32.22 1p62 h VAL 55 CO 1.82 0.22 -1.12 0.00 0.02 0.00 0.00 177.57 178.51 1p62 h ALA 56 N 1.78 0.13 -0.34 1.67 0.00 -1.97 -0.92 119.26 119.61 1p62 h ALA 56 Ca -0.00 -0.74 0.10 0.00 0.00 0.00 0.00 54.91 54.26 1p62 h ALA 56 Cb 0.82 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1p62 h ALA 56 CO 0.03 0.74 0.33 0.07 0.00 0.00 0.00 179.25 180.42 1p62 h ARG 57 N 0.29 0.00 0.17 0.00 0.11 -1.77 -2.81 114.38 110.36 1p62 h ARG 57 Ca -0.14 0.00 -0.31 0.00 0.10 0.00 0.00 59.98 59.62 1p62 h ARG 57 Cb 1.78 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.87 1p62 h ARG 57 CO 0.21 0.00 -1.48 -1.49 0.10 0.00 0.00 179.97 177.31 1p62 h TRP 58 N 0.00 0.64 0.00 4.08 6.55 -1.21 -3.33 115.95 122.68 1p62 h TRP 58 Ca 0.16 -0.47 0.00 0.00 0.95 0.00 0.00 58.89 59.53 1p62 h TRP 58 Cb 0.82 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 29.10 1p62 h TRP 58 CO 0.00 1.45 -0.62 0.00 -1.05 0.00 0.00 178.44 178.22 1p62 s ASN 60 N -3.74 2.21 -0.19 0.00 3.84 -1.06 -4.05 114.94 111.94 1p62 s ASN 60 Ca 0.08 -2.27 -0.29 0.00 0.21 0.00 0.00 52.86 50.58 1p62 s ASN 60 Cb 0.15 -0.19 -0.01 0.00 -0.55 0.00 0.00 41.25 40.65 1p62 s ASN 60 CO 0.72 -0.26 1.28 -0.69 -2.79 0.00 0.00 177.10 175.36 1p62 s VAL 61 N 0.90 4.23 0.01 -5.21 1.01 0.69 -4.60 120.40 117.44 1p62 s VAL 61 Ca 0.21 1.48 -0.03 0.00 0.00 0.00 0.00 61.98 63.64 1p62 s VAL 61 Cb -0.15 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1p62 s VAL 61 CO -0.04 -0.19 0.05 -1.10 0.00 0.00 0.00 175.10 173.81 1p62 s GLN 62 N 3.64 0.40 0.68 2.72 -1.52 -1.26 -4.07 119.66 120.25 1p62 s GLN 62 Ca 0.56 -0.52 -0.15 0.00 -1.95 0.00 0.00 55.36 53.30 1p62 s GLN 62 Cb -0.21 0.15 0.01 0.00 -0.22 0.00 0.00 33.01 32.74 1p62 s GLN 62 CO 0.16 -0.08 1.13 -1.54 -0.25 0.00 0.00 175.29 174.71 1p62 s SER 63 N -1.45 4.88 -1.11 5.90 1.04 -1.26 -5.09 113.70 116.61 1p62 s SER 63 Ca -0.15 2.07 -0.03 0.00 0.48 0.00 0.00 55.95 58.33 1p62 s SER 63 Cb -0.09 -2.56 0.24 0.00 0.10 0.00 0.00 66.02 63.71 1p62 s SER 63 CO 0.00 -1.79 2.09 0.41 0.98 0.00 0.00 173.24 174.93 1p62 n THR 64 N -2.52 5.57 -1.51 2.02 -1.04 -1.26 -5.23 114.28 110.30 1p62 n THR 64 Ca 0.11 -5.16 -0.14 0.00 -2.04 0.00 0.00 64.05 56.82 1p62 n THR 64 Cb 0.52 -1.74 -0.11 0.00 -1.82 0.00 0.00 70.33 67.18 1p62 n THR 64 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1p62 n ASN 77 N 0.63 0.80 -4.71 8.00 4.05 -1.26 -5.36 115.26 117.41 1p62 n ASN 77 Ca 0.53 -1.49 -0.25 0.00 0.45 0.00 0.00 54.58 53.83 1p62 n ASN 77 Cb 0.26 -1.38 0.10 0.00 1.23 0.00 0.00 39.78 39.99 1p62 n ASN 77 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1p62 s GLY 78 N 7.53 1.75 0.85 8.20 0.00 -1.26 -5.03 107.32 119.36 1p62 s GLY 78 Ca 0.92 -1.29 -0.11 0.00 0.00 0.00 0.00 44.72 44.25 1p62 s GLY 78 CO 0.19 -0.78 1.10 -0.32 0.00 0.00 0.00 173.10 173.29 1p62 s GLY 79 N -4.64 1.65 -0.54 0.20 0.00 -1.26 -4.44 107.32 98.29 1p62 s GLY 79 Ca 0.64 0.17 -0.02 0.00 0.00 0.00 0.00 44.72 45.52 1p62 s GLY 79 CO 0.45 0.60 0.33 0.21 0.00 0.00 0.00 173.10 174.69 1p62 s ASN 80 N -3.27 5.11 0.26 1.64 3.84 -1.26 -0.22 114.94 121.04 1p62 s ASN 80 Ca 0.63 -2.61 0.12 0.00 0.21 0.00 0.00 52.86 51.20 1p62 s ASN 80 Cb -0.19 -1.81 0.26 0.00 -0.55 0.00 0.00 41.25 38.97 1p62 s ASN 80 CO 0.57 -0.40 1.54 1.62 -2.79 0.00 0.00 177.10 177.64 1p62 h VAL 81 N 5.67 1.33 -0.12 -5.21 3.04 -1.37 -1.66 116.25 117.93 1p62 h VAL 81 Ca -0.06 -2.32 0.04 0.00 -1.01 0.00 0.00 66.70 63.36 1p62 h VAL 81 Cb 0.97 2.29 -0.05 0.00 -2.01 0.00 0.00 31.29 32.50 1p62 h VAL 81 CO 0.70 0.63 -0.16 0.25 -1.01 0.00 0.00 177.57 177.99 1p62 h LEU 82 N 0.00 -0.48 -1.09 3.16 5.85 -1.90 -2.16 115.31 118.69 1p62 h LEU 82 Ca -0.01 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1p62 h LEU 82 Cb 1.24 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.47 1p62 h LEU 82 CO 0.08 -0.20 0.35 -0.61 -0.34 0.00 0.00 178.44 177.72 1p62 h GLN 83 N -0.20 0.98 -0.75 1.25 4.15 -1.83 -2.01 115.11 116.71 1p62 h GLN 83 Ca 0.09 -0.12 -0.05 0.00 0.77 0.00 0.00 58.65 59.33 1p62 h GLN 83 Cb 0.33 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.80 1p62 h GLN 83 CO -0.23 0.75 0.26 0.52 -1.93 0.00 0.00 178.83 178.20 1p62 h MET 84 N 0.98 1.15 -0.30 1.69 2.86 -1.11 -1.38 114.93 118.82 1p62 h MET 84 Ca 0.24 -0.23 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 1p62 h MET 84 Cb 0.08 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1p62 h MET 84 CO -0.03 0.96 -0.01 1.98 1.06 0.00 0.00 176.91 180.86 1p62 h MET 85 N 1.10 0.54 -0.03 1.72 1.85 -0.96 -2.11 114.93 117.05 1p62 h MET 85 Ca 0.25 -0.18 -0.08 0.00 -0.61 0.00 0.00 59.70 59.07 1p62 h MET 85 Cb 0.27 -0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.24 1p62 h MET 85 CO -0.01 0.70 -0.36 1.88 -0.40 0.00 0.00 176.91 178.72 1p62 h TYR 86 N 0.33 0.06 -0.04 1.39 0.99 -1.16 -0.57 116.97 117.97 1p62 h TYR 86 Ca 0.08 -0.01 -0.18 0.00 2.00 0.00 0.00 58.73 60.62 1p62 h TYR 86 Cb 0.46 -0.01 -0.01 0.00 1.00 0.00 0.00 36.73 38.17 1p62 h TYR 86 CO 0.04 0.41 -0.78 0.93 -0.00 0.00 0.00 178.16 178.76 1p62 h GLU 87 N 0.05 0.29 -0.99 4.88 5.08 -1.17 -3.41 114.58 119.31 1p62 h GLU 87 Ca 0.00 -0.26 -0.33 0.00 -1.00 0.00 0.00 59.36 57.77 1p62 h GLU 87 Cb 0.66 0.06 -0.23 0.00 0.50 0.00 0.00 28.75 29.74 1p62 h GLU 87 CO 0.05 0.93 -0.70 1.17 -1.00 0.00 0.00 179.01 179.46 1p62 n LYS 88 N -3.77 0.64 0.06 2.33 4.81 -0.80 -5.04 118.16 116.40 1p62 n LYS 88 Ca -0.04 -2.33 0.02 0.00 -0.87 0.00 0.00 58.31 55.09 1p62 n LYS 88 Cb 0.74 -1.43 0.38 0.00 0.02 0.00 0.00 35.03 34.74 1p62 n LYS 88 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1p62 h PRO 89 N 4.41 0.38 0.00 1.64 0.13 -1.31 -1.02 132.00 136.22 1p62 h PRO 89 Ca -0.00 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 1p62 h PRO 89 Cb 1.00 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 1p62 h PRO 89 CO 0.30 0.41 -0.03 1.05 -0.23 0.00 0.00 178.00 179.50 1p62 h GLU 90 N 0.37 0.00 0.13 0.86 9.09 -1.86 -1.89 114.58 121.29 1p62 h GLU 90 Ca 0.08 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 59.15 1p62 h GLU 90 Cb 0.25 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.34 1p62 h GLU 90 CO 0.01 0.03 -1.80 -0.09 0.05 0.00 0.00 179.01 177.21 1p62 h ARG 91 N 0.00 0.28 -0.00 1.06 9.65 -1.46 -3.44 114.38 120.47 1p62 h ARG 91 Ca -0.00 -0.48 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 1p62 h ARG 91 Cb 0.20 0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.96 1p62 h ARG 91 CO 0.00 1.23 -0.10 0.91 2.80 0.00 0.00 179.97 184.82 1p62 n TRP 92 N -3.64 0.00 -0.11 2.20 7.02 -0.92 -4.73 117.44 117.26 1p62 n TRP 92 Ca -0.29 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.09 1p62 n TRP 92 Cb 1.01 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.88 1p62 n TRP 92 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 1p62 h SER 93 N 0.48 0.47 -0.42 -0.99 0.02 -1.58 -1.27 113.55 110.25 1p62 h SER 93 Ca 0.00 -0.20 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 1p62 h SER 93 Cb 0.15 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.52 1p62 h SER 93 CO 0.00 0.54 0.18 0.15 -1.14 0.00 0.00 176.83 176.56 1p62 h PHE 94 N 0.37 0.32 -0.22 3.45 3.57 -1.83 0.11 116.94 122.71 1p62 h PHE 94 Ca 0.10 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 1p62 h PHE 94 Cb 0.24 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1p62 h PHE 94 CO 0.01 0.14 0.02 1.15 -2.23 0.00 0.00 178.31 177.40 1p62 h THR 95 N 0.36 1.24 0.18 4.41 2.02 -1.82 -1.52 112.91 117.79 1p62 h THR 95 Ca 0.19 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.56 1p62 h THR 95 Cb 0.15 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1p62 h THR 95 CO -0.17 0.25 -0.25 0.15 0.37 0.00 0.00 175.52 175.87 1p62 h PHE 96 N 0.15 -0.67 -0.75 3.16 3.57 -1.09 -2.06 116.94 119.24 1p62 h PHE 96 Ca 0.06 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 1p62 h PHE 96 Cb 0.36 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 1p62 h PHE 96 CO 0.03 -0.36 0.33 1.96 -2.23 0.00 0.00 178.31 178.03 1p62 h GLN 97 N -0.49 1.11 -0.47 1.11 1.08 -0.87 0.18 115.11 116.76 1p62 h GLN 97 Ca 0.01 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.02 1p62 h GLN 97 Cb 0.49 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 1p62 h GLN 97 CO -0.11 0.89 0.26 1.15 -0.95 0.00 0.00 178.83 180.07 1p62 h THR 98 N 1.08 1.16 -0.26 -0.54 2.02 -1.31 -2.66 112.91 112.41 1p62 h THR 98 Ca 0.25 -0.41 -0.16 0.00 0.77 0.00 0.00 66.41 66.86 1p62 h THR 98 Cb 0.18 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1p62 h THR 98 CO -0.03 0.17 -0.49 0.22 0.37 0.00 0.00 175.52 175.76 1p62 h TYR 99 N 0.61 0.86 -0.16 3.16 3.20 -0.84 -2.69 116.97 121.12 1p62 h TYR 99 Ca 0.16 -0.29 0.00 0.00 3.14 0.00 0.00 58.73 61.75 1p62 h TYR 99 Cb 0.05 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1p62 h TYR 99 CO -0.02 1.05 0.10 0.00 -1.64 0.00 0.00 178.16 177.65 1p62 h ALA 100 N 0.90 0.20 -0.11 1.82 0.00 -0.64 -1.09 119.26 120.32 1p62 h ALA 100 Ca 0.03 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1p62 h ALA 100 Cb 1.05 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1p62 h ALA 100 CO 0.10 -0.33 -0.72 0.00 0.00 0.00 0.00 179.25 178.30 1p62 h LEU 102 N 0.37 0.15 -1.72 0.00 5.85 -1.29 -1.61 115.31 117.07 1p62 h LEU 102 Ca -0.03 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1p62 h LEU 102 Cb 1.31 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1p62 h LEU 102 CO 0.13 0.12 -0.05 0.77 -0.34 0.00 0.00 178.44 179.07 1p62 h SER 103 N 0.18 0.11 -0.00 1.25 4.64 -1.18 -1.98 113.55 116.56 1p62 h SER 103 Ca 0.05 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1p62 h SER 103 Cb -0.02 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1p62 h SER 103 CO -0.01 0.18 -0.00 -0.09 -0.87 0.00 0.00 176.83 176.03 1p62 h ARG 104 N 0.12 0.01 -0.48 4.77 2.43 -1.06 -2.23 114.38 117.93 1p62 h ARG 104 Ca 0.03 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1p62 h ARG 104 Cb 0.17 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 1p62 h ARG 104 CO 0.01 0.41 0.21 0.82 -1.51 0.00 0.00 179.97 179.91 1p62 h ILE 105 N -0.40 0.90 -0.25 1.20 2.04 -1.01 0.71 117.51 120.69 1p62 h ILE 105 Ca 0.00 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.74 1p62 h ILE 105 Cb 0.41 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1p62 h ILE 105 CO 0.00 0.07 0.12 0.03 0.00 0.00 0.00 178.15 178.38 1p62 h ARG 106 N 0.41 0.25 -0.78 2.37 3.08 -1.39 0.15 114.38 118.47 1p62 h ARG 106 Ca 0.22 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.21 1p62 h ARG 106 Cb 0.18 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 1p62 h ARG 106 CO -0.19 0.17 0.31 0.00 -1.07 0.00 0.00 179.97 179.19 1p62 h ALA 107 N 1.13 1.08 -0.27 0.04 0.00 -1.07 -1.46 119.26 118.70 1p62 h ALA 107 Ca 0.10 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1p62 h ALA 107 Cb 0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1p62 h ALA 107 CO -0.07 0.66 -0.48 1.96 0.00 0.00 0.00 179.25 181.32 1p62 h GLN 108 N 1.14 0.81 -0.43 0.00 4.20 -0.52 -2.67 115.11 117.63 1p62 h GLN 108 Ca 0.26 -0.50 -0.05 0.00 0.06 0.00 0.00 58.65 58.42 1p62 h GLN 108 Cb 0.21 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1p62 h GLN 108 CO -0.02 1.13 0.07 -0.07 -0.67 0.00 0.00 178.83 179.27 1p62 h LEU 109 N 0.57 0.61 -0.80 1.46 3.38 -0.66 -2.36 115.31 117.50 1p62 h LEU 109 Ca 0.02 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1p62 h LEU 109 Cb 1.08 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1p62 h LEU 109 CO 0.11 0.64 -0.21 0.00 0.09 0.00 0.00 178.44 179.07 1p62 h ALA 110 N 1.45 0.98 -0.06 1.53 0.00 -1.12 -2.73 119.26 119.31 1p62 h ALA 110 Ca 0.14 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.56 1p62 h ALA 110 Cb 0.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1p62 h ALA 110 CO 0.00 0.60 -0.58 0.77 0.00 0.00 0.00 179.25 180.04 1p62 h SER 111 N 0.60 0.21 0.05 0.00 0.02 -1.19 -2.87 113.55 110.37 1p62 h SER 111 Ca 0.09 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 60.79 1p62 h SER 111 Cb 0.68 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 1p62 h SER 111 CO 0.05 0.75 -0.42 -0.07 -1.14 0.00 0.00 176.83 176.00 1p62 h LEU 112 N 0.14 0.49 -2.52 5.07 3.38 -1.17 -3.19 115.31 117.52 1p62 h LEU 112 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1p62 h LEU 112 Cb 1.07 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1p62 h LEU 112 CO 0.09 0.85 0.00 0.59 0.09 0.00 0.00 178.44 180.06 1p62 n ASN 113 N -4.02 3.68 -0.77 -0.43 3.02 -1.05 -4.36 115.26 111.33 1p62 n ASN 113 Ca -0.02 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 1p62 n ASN 113 Cb 0.51 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1p62 n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p62 n GLY 114 N 1.59 1.41 0.16 7.41 0.00 -1.09 -4.96 105.19 109.71 1p62 n GLY 114 Ca 0.23 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.50 1p62 n GLY 114 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1p62 h LYS 115 N 0.00 0.00 -0.51 1.61 2.10 -1.90 -2.35 116.57 115.52 1p62 h LYS 115 Ca 0.00 0.00 0.09 0.00 -2.00 0.00 0.00 60.65 58.74 1p62 h LYS 115 Cb 0.00 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.30 1p62 h LYS 115 CO 0.00 0.00 0.35 1.25 -2.00 0.00 0.00 179.45 179.05 1p62 h LEU 116 N 0.00 0.28 -1.78 7.07 5.85 -1.90 -2.79 115.31 122.04 1p62 h LEU 116 Ca 0.00 0.00 0.25 0.00 0.84 0.00 0.00 57.88 58.97 1p62 h LEU 116 Cb 0.57 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1p62 h LEU 116 CO 0.00 0.17 0.78 0.50 -0.34 0.00 0.00 178.44 179.56 1p62 h LYS 117 N 0.32 0.00 -0.06 1.25 3.64 -1.62 -2.35 116.57 117.74 1p62 h LYS 117 Ca 0.23 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1p62 h LYS 117 Cb 0.51 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1p62 h LYS 117 CO -0.05 0.00 -0.46 -0.25 -2.27 0.00 0.00 179.45 176.41 1p62 n ASP 118 N -3.77 1.90 -4.89 4.20 10.43 -1.05 -5.03 116.55 118.33 1p62 n ASP 118 Ca 0.18 -3.89 -0.22 0.00 2.57 0.00 0.00 54.79 53.43 1p62 n ASP 118 Cb 1.07 -0.54 0.06 0.00 1.84 0.00 0.00 41.12 43.55 1p62 n ASP 118 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1p62 s ALA 119 N -3.25 3.93 -0.06 2.24 0.00 -0.89 -5.07 121.76 118.65 1p62 s ALA 119 Ca 0.39 -1.53 -0.15 0.00 0.00 0.00 0.00 51.96 50.68 1p62 s ALA 119 Cb 0.38 -1.99 -0.11 0.00 0.00 0.00 0.00 23.12 21.40 1p62 s ALA 119 CO -0.06 -0.95 0.59 0.93 0.00 0.00 0.00 175.76 176.27 1p62 h GLU 120 N -0.08 -0.25 -2.16 0.00 5.08 -1.96 -3.40 114.58 111.82 1p62 h GLU 120 Ca -0.39 0.02 -0.58 0.00 -1.00 0.00 0.00 59.36 57.41 1p62 h GLU 120 Cb 1.29 0.06 -0.41 0.00 0.50 0.00 0.00 28.75 30.18 1p62 h GLU 120 CO 0.47 0.05 -0.77 0.36 -1.00 0.00 0.00 179.01 178.13 1p62 n LYS 121 N -4.93 2.22 -2.11 2.33 -0.00 -1.26 -5.12 118.16 109.29 1p62 n LYS 121 Ca -0.06 -4.32 -0.41 0.00 -0.00 0.00 0.00 58.31 53.52 1p62 n LYS 121 Cb 0.21 -2.00 -0.03 0.00 -0.00 0.00 0.00 35.03 33.21 1p62 n LYS 121 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1p62 s PRO 122 N -2.51 4.33 -0.05 -1.58 0.04 -1.26 -4.81 135.00 129.16 1p62 s PRO 122 Ca 0.42 2.19 0.01 0.00 0.04 0.00 0.00 61.00 63.66 1p62 s PRO 122 Cb 0.21 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.64 1p62 s PRO 122 CO -0.07 -0.31 -0.05 0.08 0.04 0.00 0.00 177.00 176.68 1p62 s VAL 123 N -0.17 0.60 -0.19 -0.36 1.01 -0.91 -2.66 120.40 117.72 1p62 s VAL 123 Ca 0.56 -0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.37 1p62 s VAL 123 Cb -0.39 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 1p62 s VAL 123 CO 0.43 0.24 -0.10 -0.22 0.00 0.00 0.00 175.10 175.46 1p62 s LEU 124 N 0.93 2.71 -0.21 3.92 2.96 -0.22 -1.17 118.68 127.60 1p62 s LEU 124 Ca -0.11 -0.41 -0.06 0.00 -0.22 0.00 0.00 54.13 53.33 1p62 s LEU 124 Cb -0.14 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.86 1p62 s LEU 124 CO 0.00 0.04 0.03 -0.36 -1.32 0.00 0.00 176.35 174.74 1p62 s PHE 125 N 1.10 3.08 -0.18 5.38 0.40 -0.30 -0.94 117.98 126.52 1p62 s PHE 125 Ca 0.01 -0.38 -0.10 0.00 -0.60 0.00 0.00 56.93 55.86 1p62 s PHE 125 Cb -0.15 -2.13 -0.05 0.00 0.51 0.00 0.00 43.02 41.21 1p62 s PHE 125 CO -0.02 -0.23 0.14 -0.06 0.70 0.00 0.00 175.22 175.76 1p62 s PHE 126 N 1.10 3.46 -0.72 0.36 2.99 0.20 -1.04 117.98 124.34 1p62 s PHE 126 Ca 0.03 0.40 -0.24 0.00 0.00 0.00 0.00 56.93 57.12 1p62 s PHE 126 Cb -0.14 -2.12 0.06 0.00 0.00 0.00 0.00 43.02 40.82 1p62 s PHE 126 CO 0.02 0.41 1.12 -2.00 -0.00 0.00 0.00 175.22 174.76 1p62 s GLU 127 N -0.00 3.18 0.23 0.44 2.12 -0.41 -0.74 118.70 123.51 1p62 s GLU 127 Ca 0.10 -0.66 0.00 0.00 0.36 0.00 0.00 54.97 54.78 1p62 s GLU 127 Cb -0.11 -4.29 0.00 0.00 0.26 0.00 0.00 34.13 29.98 1p62 s GLU 127 CO 0.00 -1.96 0.00 0.54 -0.54 0.00 0.00 175.26 173.30 1p62 n ARG 128 N 8.36 -1.72 -4.26 4.30 1.74 -0.30 -4.01 116.66 120.77 1p62 n ARG 128 Ca 0.02 1.20 -0.14 0.00 -0.77 0.00 0.00 57.85 58.15 1p62 n ARG 128 Cb 0.47 -2.08 -0.10 0.00 -1.02 0.00 0.00 32.46 29.73 1p62 n ARG 128 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1p62 s SER 129 N -5.48 0.70 0.62 0.55 1.04 -1.26 -4.82 113.70 105.04 1p62 s SER 129 Ca 0.00 -1.41 0.40 0.00 0.48 0.00 0.00 55.95 55.42 1p62 s SER 129 Cb 0.00 0.29 1.99 0.00 0.10 0.00 0.00 66.02 68.41 1p62 s SER 129 CO 0.00 -0.80 2.22 -0.37 0.98 0.00 0.00 173.24 175.27 1p62 h VAL 130 N 2.49 0.05 0.03 5.02 -1.51 -1.98 -2.38 116.25 117.97 1p62 h VAL 130 Ca -0.37 -0.21 -0.21 0.00 -1.23 0.00 0.00 66.70 64.68 1p62 h VAL 130 Cb 1.25 1.20 0.02 0.00 -2.13 0.00 0.00 31.29 31.63 1p62 h VAL 130 CO 0.56 0.01 -0.84 1.88 -1.23 0.00 0.00 177.57 177.94 1p62 h TYR 131 N 0.00 0.79 -0.34 5.19 -1.99 -2.00 -2.98 116.97 115.64 1p62 h TYR 131 Ca -0.00 -0.45 -0.07 0.00 2.00 0.00 0.00 58.73 60.21 1p62 h TYR 131 Cb 0.20 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 38.83 1p62 h TYR 131 CO 0.00 1.29 -0.09 0.66 -0.00 0.00 0.00 178.16 180.02 1p62 h SER 132 N 0.07 0.55 -0.45 3.88 4.64 -1.91 0.44 113.55 120.76 1p62 h SER 132 Ca -0.11 -0.14 0.09 0.00 -0.47 0.00 0.00 61.79 61.16 1p62 h SER 132 Cb 1.55 -0.15 -0.09 0.00 -0.31 0.00 0.00 62.40 63.40 1p62 h SER 132 CO 0.16 0.68 -0.15 0.44 -0.87 0.00 0.00 176.83 177.09 1p62 h ASP 133 N 0.53 -0.54 0.00 4.97 3.32 -1.43 -1.84 116.42 121.44 1p62 h ASP 133 Ca 0.10 0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 1p62 h ASP 133 Cb 0.47 0.32 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 1p62 h ASP 133 CO 0.03 -0.19 -0.29 -0.09 -1.72 0.00 0.00 179.24 176.98 1p62 h ARG 134 N -0.05 0.01 0.00 3.56 2.43 -1.45 0.04 114.38 118.92 1p62 h ARG 134 Ca 0.22 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1p62 h ARG 134 Cb 0.38 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1p62 h ARG 134 CO -0.49 1.00 -0.42 1.88 -1.51 0.00 0.00 179.97 180.44 1p62 h TYR 135 N -0.99 0.00 0.00 2.20 -1.99 -0.95 -1.69 116.97 113.56 1p62 h TYR 135 Ca -0.08 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.65 1p62 h TYR 135 Cb 1.08 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.81 1p62 h TYR 135 CO 0.24 0.00 -0.04 -0.89 -0.00 0.00 0.00 178.16 177.47 1p62 n ILE 136 N -2.20 0.10 -0.00 -2.88 2.08 -0.74 -4.72 119.36 110.98 1p62 n ILE 136 Ca 0.04 0.29 -0.10 0.00 0.56 0.00 0.00 62.75 63.53 1p62 n ILE 136 Cb 0.44 -1.34 -0.08 0.00 -0.75 0.00 0.00 39.64 37.91 1p62 n ILE 136 CO 0.00 0.00 0.00 -0.26 0.56 0.00 0.00 176.55 176.85 1p62 h PHE 137 N -0.04 -0.10 -0.47 1.39 -1.00 -1.47 -2.07 116.94 113.19 1p62 h PHE 137 Ca 0.00 -0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 1p62 h PHE 137 Cb 0.04 0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.61 1p62 h PHE 137 CO -0.02 0.45 0.17 0.00 -1.61 0.00 0.00 178.31 177.30 1p62 h ALA 138 N -0.23 0.61 -0.41 2.45 0.00 -1.08 -2.07 119.26 118.53 1p62 h ALA 138 Ca -0.01 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1p62 h ALA 138 Cb 0.59 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1p62 h ALA 138 CO 0.02 0.24 0.21 1.03 0.00 0.00 0.00 179.25 180.74 1p62 h SER 139 N 0.61 0.31 -0.78 0.00 0.87 -1.42 -1.24 113.55 111.90 1p62 h SER 139 Ca 0.15 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1p62 h SER 139 Cb 0.23 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.11 1p62 h SER 139 CO -0.01 0.22 0.48 -1.13 -0.53 0.00 0.00 176.83 175.86 1p62 h ASN 140 N 0.42 0.92 -0.61 6.23 -0.00 -1.19 -0.91 115.58 120.45 1p62 h ASN 140 Ca 0.17 -0.06 -0.06 0.00 -0.00 0.00 0.00 56.30 56.36 1p62 h ASN 140 Cb 0.07 -0.23 -0.02 0.00 -0.00 0.00 0.00 38.32 38.13 1p62 h ASN 140 CO -0.11 0.71 0.15 -0.07 -0.00 0.00 0.00 177.43 178.10 1p62 h LEU 141 N 1.06 0.93 -0.40 0.34 3.38 -0.97 -0.71 115.31 118.93 1p62 h LEU 141 Ca 0.28 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1p62 h LEU 141 Cb -0.06 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1p62 h LEU 141 CO -0.05 0.92 0.25 0.22 0.09 0.00 0.00 178.44 179.87 1p62 h TYR 142 N 0.89 0.52 0.00 1.13 3.20 -1.01 0.20 116.97 121.91 1p62 h TYR 142 Ca 0.19 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.02 1p62 h TYR 142 Cb 0.36 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1p62 h TYR 142 CO 0.03 0.35 -0.22 0.93 -1.64 0.00 0.00 178.16 177.61 1p62 h GLU 143 N 0.54 0.00 -0.45 1.82 5.08 -0.93 -1.93 114.58 118.70 1p62 h GLU 143 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1p62 h GLU 143 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1p62 h GLU 143 CO -0.03 0.22 0.00 0.43 -1.00 0.00 0.00 179.01 178.63 1p62 n SER 144 N -3.71 1.93 -3.11 1.42 7.64 -0.29 -4.94 113.62 112.56 1p62 n SER 144 Ca -0.01 -2.11 -0.22 0.00 1.01 0.00 0.00 58.87 57.53 1p62 n SER 144 Cb 0.33 -0.31 0.02 0.00 -1.01 0.00 0.00 64.21 63.25 1p62 n SER 144 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1p62 n GLU 145 N 0.31 -4.29 0.00 1.43 1.02 -0.73 -4.89 120.64 113.50 1p62 n GLU 145 Ca 0.10 0.75 0.11 0.00 -0.02 0.00 0.00 57.16 58.10 1p62 n GLU 145 Cb 0.36 -5.56 0.02 0.00 -0.02 0.00 0.00 31.44 26.24 1p62 n GLU 145 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1p62 s MET 147 N -2.92 1.25 0.81 0.00 -1.94 -1.21 -4.13 119.30 111.16 1p62 s MET 147 Ca 0.11 -0.54 -0.08 0.00 -1.71 0.00 0.00 55.69 53.47 1p62 s MET 147 Cb 0.17 -1.20 0.15 0.00 2.01 0.00 0.00 34.83 35.96 1p62 s MET 147 CO 0.77 0.32 1.13 0.54 -0.01 0.00 0.00 175.02 177.77 1p62 s ASN 148 N -0.34 3.91 0.27 3.03 2.20 -1.26 -4.64 114.94 118.12 1p62 s ASN 148 Ca 0.05 -0.01 -0.02 0.00 -0.94 0.00 0.00 52.86 51.94 1p62 s ASN 148 Cb -0.06 -0.27 0.40 0.00 -2.00 0.00 0.00 41.25 39.33 1p62 s ASN 148 CO -0.00 -2.18 1.90 -0.33 -2.94 0.00 0.00 177.10 173.54 1p62 h GLU 149 N -0.98 1.16 -0.22 3.55 4.39 -1.99 -1.57 114.58 118.91 1p62 h GLU 149 Ca -0.41 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.21 1p62 h GLU 149 Cb 1.26 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 1p62 h GLU 149 CO 0.42 0.76 0.07 1.15 -1.16 0.00 0.00 179.01 180.25 1p62 h THR 150 N 1.19 1.19 -0.68 1.13 2.02 -1.99 -1.17 112.91 114.60 1p62 h THR 150 Ca 0.42 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1p62 h THR 150 Cb 0.11 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1p62 h THR 150 CO -0.15 0.19 0.40 -0.33 0.37 0.00 0.00 175.52 176.00 1p62 h GLU 151 N 0.19 0.93 -0.41 6.66 5.08 -1.87 -1.76 114.58 123.40 1p62 h GLU 151 Ca 0.07 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 1p62 h GLU 151 Cb 0.23 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1p62 h GLU 151 CO -0.00 0.67 -0.17 2.35 -1.00 0.00 0.00 179.01 180.86 1p62 h TRP 152 N 0.92 0.97 -0.03 4.33 -0.00 -1.15 0.61 115.95 121.59 1p62 h TRP 152 Ca 0.24 -0.23 0.02 0.00 -0.00 0.00 0.00 58.89 58.92 1p62 h TRP 152 Cb -0.01 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 28.91 1p62 h TRP 152 CO -0.01 1.00 -0.08 1.15 -0.00 0.00 0.00 178.44 180.50 1p62 h THR 153 N 0.66 0.79 -0.55 2.65 2.02 -1.16 -1.69 112.91 115.63 1p62 h THR 153 Ca 0.09 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.31 1p62 h THR 153 Cb 0.73 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 1p62 h THR 153 CO 0.06 0.00 0.32 0.40 0.37 0.00 0.00 175.52 176.67 1p62 h ILE 154 N -0.12 1.03 -0.25 3.11 2.04 -1.22 -1.72 117.51 120.38 1p62 h ILE 154 Ca 0.04 -0.22 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1p62 h ILE 154 Cb 0.18 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1p62 h ILE 154 CO -0.10 0.12 0.13 0.22 0.00 0.00 0.00 178.15 178.51 1p62 h TYR 155 N 0.63 0.24 -0.61 1.37 3.20 -0.78 -1.03 116.97 119.98 1p62 h TYR 155 Ca 0.23 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.03 1p62 h TYR 155 Cb 0.05 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 1p62 h TYR 155 CO -0.07 0.14 0.10 1.96 -1.64 0.00 0.00 178.16 178.64 1p62 h GLN 156 N 0.27 1.02 -0.26 1.82 4.20 -1.20 0.16 115.11 121.13 1p62 h GLN 156 Ca 0.10 -0.28 0.04 0.00 0.06 0.00 0.00 58.65 58.57 1p62 h GLN 156 Cb 0.02 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 1p62 h GLN 156 CO -0.06 0.96 0.03 0.22 -0.67 0.00 0.00 178.83 179.30 1p62 h ASP 157 N 0.93 -0.03 -0.35 1.46 3.58 -1.16 -0.20 116.42 120.64 1p62 h ASP 157 Ca 0.19 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.69 1p62 h ASP 157 Cb 0.43 0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 1p62 h ASP 157 CO 0.01 0.02 0.23 -0.25 -2.88 0.00 0.00 179.24 176.37 1p62 h TRP 158 N 0.12 0.44 0.00 0.28 7.01 -0.98 -1.81 115.95 121.01 1p62 h TRP 158 Ca 0.12 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.13 1p62 h TRP 158 Cb 0.14 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.05 1p62 h TRP 158 CO -0.18 0.28 -0.00 1.25 -2.79 0.00 0.00 178.44 177.00 1p62 h HIS 159 N 0.48 -0.00 -0.35 2.65 2.76 -0.76 -0.33 115.15 119.59 1p62 h HIS 159 Ca 0.13 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.37 1p62 h HIS 159 Cb -0.06 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 28.84 1p62 h HIS 159 CO -0.05 0.10 -0.09 -0.44 -1.30 0.00 0.00 177.93 176.15 1p62 h ASP 160 N -0.11 -0.34 -0.25 3.26 3.32 -0.98 -1.05 116.42 120.27 1p62 h ASP 160 Ca -0.00 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.11 1p62 h ASP 160 Cb 0.11 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1p62 h ASP 160 CO 0.00 -0.12 -0.02 -0.25 -1.72 0.00 0.00 179.24 177.13 1p62 h TRP 161 N -0.01 0.49 -0.61 4.55 7.01 -1.10 -1.09 115.95 125.19 1p62 h TRP 161 Ca 0.17 -0.09 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 1p62 h TRP 161 Cb 0.27 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.17 1p62 h TRP 161 CO -0.33 0.63 0.32 0.52 -2.79 0.00 0.00 178.44 176.79 1p62 h MET 162 N 0.21 0.85 -0.03 2.65 2.86 -0.87 -2.35 114.93 118.25 1p62 h MET 162 Ca 0.07 -0.09 -0.20 0.00 -2.06 0.00 0.00 59.70 57.42 1p62 h MET 162 Cb 0.45 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1p62 h MET 162 CO 0.02 0.64 -0.83 -0.97 1.06 0.00 0.00 176.91 176.83 1p62 h ASN 163 N 0.86 0.41 -0.63 1.22 -1.24 -1.03 -2.09 115.58 113.08 1p62 h ASN 163 Ca 0.22 -0.30 0.01 0.00 0.71 0.00 0.00 56.30 56.94 1p62 h ASN 163 Cb 0.05 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 38.94 1p62 h ASN 163 CO -0.03 1.07 0.41 -1.13 -1.29 0.00 0.00 177.43 176.46 1p62 h ASN 164 N 0.20 0.70 0.41 1.15 -0.00 -0.90 2.12 115.58 119.25 1p62 h ASN 164 Ca -0.05 -0.02 -0.28 0.00 -0.00 0.00 0.00 56.30 55.96 1p62 h ASN 164 Cb 1.43 -0.17 0.01 0.00 -0.00 0.00 0.00 38.32 39.59 1p62 h ASN 164 CO 0.14 0.50 -1.21 1.56 -0.00 0.00 0.00 177.43 178.41 1p62 h GLN 165 N 0.82 0.41 0.00 6.67 1.08 -1.35 -3.40 115.11 119.34 1p62 h GLN 165 Ca 0.23 -0.60 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 1p62 h GLN 165 Cb -0.05 0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1p62 h GLN 165 CO -0.05 1.26 0.00 1.19 -0.95 0.00 0.00 178.83 180.27 1p62 n PHE 166 N -3.66 0.00 -0.08 2.96 3.01 -0.79 -4.85 117.46 114.04 1p62 n PHE 166 Ca -0.10 -0.37 -0.09 0.00 1.01 0.00 0.00 57.45 57.90 1p62 n PHE 166 Cb 0.99 -0.04 -0.02 0.00 -0.01 0.00 0.00 39.48 40.40 1p62 n PHE 166 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1p62 h GLY 167 N 0.00 0.41 1.17 1.37 0.00 0.33 -3.07 103.07 103.28 1p62 h GLY 167 Ca 0.00 -0.16 -0.20 0.00 0.00 0.00 0.00 47.33 46.97 1p62 h GLY 167 CO 0.00 0.16 -0.63 1.46 0.00 0.00 0.00 176.54 177.53 1p62 h GLN 168 N 0.38 0.85 -0.08 4.80 4.20 -1.89 -1.75 115.11 121.63 1p62 h GLN 168 Ca 0.11 -0.59 0.02 0.00 0.06 0.00 0.00 58.65 58.24 1p62 h GLN 168 Cb -0.02 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1p62 h GLN 168 CO -0.02 1.22 0.06 0.66 -0.67 0.00 0.00 178.83 180.07 1p62 h SER 169 N 0.63 0.00 -0.06 1.46 4.64 -1.91 -2.73 113.55 115.58 1p62 h SER 169 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1p62 h SER 169 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1p62 h SER 169 CO 0.14 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.28 1p62 n LEU 170 N -4.41 3.02 -4.64 5.97 4.77 -0.92 -5.01 117.00 115.78 1p62 n LEU 170 Ca -0.01 -1.04 -0.45 0.00 -0.03 0.00 0.00 56.01 54.48 1p62 n LEU 170 Cb 0.17 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1p62 n LEU 170 CO 0.33 0.52 0.81 -0.62 -1.33 0.00 0.00 177.39 177.10 1p62 n GLU 171 N 1.35 1.73 -3.34 3.23 1.02 -0.71 -4.96 120.64 118.97 1p62 n GLU 171 Ca 0.14 0.61 -0.37 0.00 -0.02 0.00 0.00 57.16 57.52 1p62 n GLU 171 Cb 0.60 -2.14 -0.06 0.00 -0.02 0.00 0.00 31.44 29.82 1p62 n GLU 171 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1p62 s LEU 172 N -0.01 4.45 0.10 -4.62 1.43 -1.26 -4.66 118.68 114.10 1p62 s LEU 172 Ca 0.63 1.15 0.22 0.00 -1.03 0.00 0.00 54.13 55.09 1p62 s LEU 172 Cb -0.67 -2.99 -0.14 0.00 0.03 0.00 0.00 46.19 42.42 1p62 s LEU 172 CO 0.56 0.22 0.79 0.47 0.23 0.00 0.00 176.35 178.63 1p62 n ASP 173 N 1.39 0.51 -3.59 2.29 8.00 -0.19 -4.98 116.55 119.97 1p62 n ASP 173 Ca -0.09 0.20 -0.05 0.00 0.71 0.00 0.00 54.79 55.56 1p62 n ASP 173 Cb 0.51 1.04 -0.02 0.00 -0.02 0.00 0.00 41.12 42.64 1p62 n ASP 173 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1p62 s GLY 174 N -4.47 -0.36 -0.04 0.44 0.00 -1.16 -4.35 107.32 97.37 1p62 s GLY 174 Ca -0.04 1.05 0.02 0.00 0.00 0.00 0.00 44.72 45.76 1p62 s GLY 174 CO 0.84 0.33 -0.10 -0.42 0.00 0.00 0.00 173.10 173.74 1p62 s ILE 175 N -2.78 0.92 -0.29 0.90 1.01 -0.48 -1.99 121.20 118.49 1p62 s ILE 175 Ca 0.09 -0.40 -0.07 0.00 0.00 0.00 0.00 60.65 60.27 1p62 s ILE 175 Cb -0.00 -0.84 0.00 0.00 0.01 0.00 0.00 42.46 41.64 1p62 s ILE 175 CO -0.05 0.29 0.08 -0.63 0.00 0.00 0.00 174.94 174.63 1p62 s ILE 176 N 0.43 4.01 -0.35 2.92 1.01 0.32 -1.29 121.20 128.26 1p62 s ILE 176 Ca -0.08 -0.62 -0.16 0.00 0.00 0.00 0.00 60.65 59.79 1p62 s ILE 176 Cb -0.12 -3.04 -0.01 0.00 0.01 0.00 0.00 42.46 39.30 1p62 s ILE 176 CO 0.02 0.12 0.42 -0.47 0.00 0.00 0.00 174.94 175.02 1p62 s TYR 177 N 1.52 3.20 -0.53 3.97 5.04 0.03 -1.35 117.35 129.23 1p62 s TYR 177 Ca 0.03 0.04 -0.20 0.00 -2.44 0.00 0.00 57.07 54.50 1p62 s TYR 177 Cb -0.17 -2.76 0.06 0.00 0.35 0.00 0.00 41.96 39.44 1p62 s TYR 177 CO 0.03 -0.47 0.72 -0.51 -1.34 0.00 0.00 175.55 173.97 1p62 s LEU 178 N 2.15 4.78 -0.21 6.97 1.43 -0.42 -0.71 118.68 132.67 1p62 s LEU 178 Ca 0.14 -0.83 -0.13 0.00 -1.03 0.00 0.00 54.13 52.28 1p62 s LEU 178 Cb -0.16 -2.52 -0.05 0.00 0.03 0.00 0.00 46.19 43.49 1p62 s LEU 178 CO 0.12 -1.01 0.25 -1.58 0.23 0.00 0.00 176.35 174.36 1p62 s GLN 179 N 2.99 4.15 0.01 1.70 0.74 -0.37 -4.44 119.66 124.44 1p62 s GLN 179 Ca 0.19 -0.06 -0.13 0.00 0.05 0.00 0.00 55.36 55.40 1p62 s GLN 179 Cb -0.18 -3.50 0.02 0.00 1.10 0.00 0.00 33.01 30.45 1p62 s GLN 179 CO 0.13 0.10 0.28 0.00 -0.55 0.00 0.00 175.29 175.25 1p62 s ALA 180 N 0.92 -0.67 0.65 1.58 0.00 -1.26 -1.06 121.76 121.91 1p62 s ALA 180 Ca 0.13 0.15 -0.15 0.00 0.00 0.00 0.00 51.96 52.08 1p62 s ALA 180 Cb -0.13 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1p62 s ALA 180 CO 0.04 -0.30 1.10 0.95 0.00 0.00 0.00 175.76 177.56 1p62 s THR 181 N -1.72 3.37 0.43 0.00 -4.23 -1.26 -4.87 115.64 107.36 1p62 s THR 181 Ca -0.11 0.63 0.10 0.00 -1.18 0.00 0.00 61.69 61.13 1p62 s THR 181 Cb -0.04 -3.16 0.24 0.00 1.34 0.00 0.00 72.50 70.88 1p62 s THR 181 CO 0.02 -0.40 2.05 1.55 -0.54 0.00 0.00 174.62 177.29 1p62 h PRO 182 N 0.08 0.35 -0.66 3.99 0.13 -1.97 -1.57 132.00 132.36 1p62 h PRO 182 Ca -0.47 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.57 1p62 h PRO 182 Cb 1.24 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1p62 h PRO 182 CO 0.55 0.28 0.16 0.93 -0.23 0.00 0.00 178.00 179.69 1p62 h GLU 183 N 0.36 1.06 -0.54 0.86 3.07 -1.95 -1.04 114.58 116.40 1p62 h GLU 183 Ca 0.09 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 58.68 1p62 h GLU 183 Cb 0.05 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 1p62 h GLU 183 CO -0.01 0.94 0.25 1.15 -1.40 0.00 0.00 179.01 179.94 1p62 h THR 184 N 0.98 1.20 -0.93 1.13 2.02 -1.80 -2.36 112.91 113.16 1p62 h THR 184 Ca 0.21 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.81 1p62 h THR 184 Cb 0.36 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.33 1p62 h THR 184 CO 0.00 0.23 0.61 0.00 0.37 0.00 0.00 175.52 176.74 1p62 h LEU 186 N 1.26 0.79 -0.39 0.00 5.85 -0.97 -0.63 115.31 121.23 1p62 h LEU 186 Ca 0.34 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 1p62 h LEU 186 Cb -0.14 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.67 1p62 h LEU 186 CO -0.07 0.84 -0.14 -0.74 -0.34 0.00 0.00 178.44 177.98 1p62 h HIS 187 N 0.78 0.90 0.00 1.25 2.76 -1.13 -3.04 115.15 116.67 1p62 h HIS 187 Ca 0.16 -0.21 -0.05 0.00 -2.20 0.00 0.00 60.37 58.07 1p62 h HIS 187 Cb 0.42 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.16 1p62 h HIS 187 CO 0.02 0.94 -0.24 0.00 -1.30 0.00 0.00 177.93 177.36 1p62 h ARG 188 N 0.60 0.00 -0.55 5.26 3.08 -0.70 -0.92 114.38 121.15 1p62 h ARG 188 Ca 0.09 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1p62 h ARG 188 Cb 0.68 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.71 1p62 h ARG 188 CO 0.05 0.24 0.20 0.82 -1.07 0.00 0.00 179.97 180.21 1p62 h ILE 189 N 0.00 1.23 -0.38 2.04 2.04 -1.02 -1.58 117.51 119.83 1p62 h ILE 189 Ca -0.00 -0.73 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 1p62 h ILE 189 Cb 0.48 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1p62 h ILE 189 CO 0.03 0.28 0.11 0.22 0.00 0.00 0.00 178.15 178.78 1p62 h TYR 190 N 0.75 0.62 -0.20 1.37 3.20 -1.34 -2.25 116.97 119.11 1p62 h TYR 190 Ca 0.18 -0.07 0.03 0.00 3.14 0.00 0.00 58.73 62.01 1p62 h TYR 190 Cb 0.23 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 1p62 h TYR 190 CO 0.01 0.59 0.04 -0.07 -1.64 0.00 0.00 178.16 177.09 1p62 h LEU 191 N 0.46 0.01 -0.73 2.82 3.38 -1.05 -3.22 115.31 116.97 1p62 h LEU 191 Ca 0.12 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 1p62 h LEU 191 Cb 0.28 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1p62 h LEU 191 CO -0.00 0.03 -0.34 -0.09 0.09 0.00 0.00 178.44 178.13 1p62 h ARG 192 N 0.12 0.58 -1.03 1.13 9.65 -1.22 -3.48 114.38 120.13 1p62 h ARG 192 Ca 0.09 -0.27 -0.25 0.00 -1.10 0.00 0.00 59.98 58.46 1p62 h ARG 192 Cb 0.09 -0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.59 1p62 h ARG 192 CO -0.12 0.84 -0.26 0.41 2.80 0.00 0.00 179.97 183.64 1p62 n GLY 193 N -0.14 0.74 3.65 2.80 0.00 -0.86 -4.98 105.19 106.41 1p62 n GLY 193 Ca -0.01 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 1p62 n GLY 193 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1p62 s ARG 194 N -3.65 3.97 0.25 1.61 3.52 -1.26 -4.88 118.95 118.50 1p62 s ARG 194 Ca 0.00 2.42 -0.04 0.00 -0.13 0.00 0.00 55.73 57.98 1p62 s ARG 194 Cb 0.00 -4.17 0.46 0.00 -1.56 0.00 0.00 34.95 29.68 1p62 s ARG 194 CO 0.00 -1.14 1.74 -0.91 -0.81 0.00 0.00 175.30 174.18 1p62 h ASN 195 N 11.16 0.32 0.56 -2.12 4.21 -1.97 -2.07 115.58 125.67 1p62 h ASN 195 Ca -0.46 0.10 -0.02 0.00 1.21 0.00 0.00 56.30 57.13 1p62 h ASN 195 Cb 1.23 0.07 -0.00 0.00 -1.12 0.00 0.00 38.32 38.50 1p62 h ASN 195 CO 0.95 0.13 -0.09 -0.33 -1.29 0.00 0.00 177.43 176.79 1p62 h GLU 196 N 0.47 0.00 -0.01 0.81 3.07 -2.00 -2.98 114.58 113.95 1p62 h GLU 196 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 1p62 h GLU 196 Cb 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.53 1p62 h GLU 196 CO -0.39 0.09 -0.45 0.39 -1.40 0.00 0.00 179.01 177.25 1p62 n GLU 197 N -3.39 0.83 0.22 2.33 1.02 -0.78 -4.55 120.64 116.32 1p62 n GLU 197 Ca -0.01 -0.61 0.08 0.00 -0.02 0.00 0.00 57.16 56.60 1p62 n GLU 197 Cb 0.26 -1.49 0.49 0.00 -0.02 0.00 0.00 31.44 30.69 1p62 n GLU 197 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1p62 h GLN 198 N 1.49 0.00 -0.01 3.49 1.08 -1.56 -2.05 115.11 117.56 1p62 h GLN 198 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1p62 h GLN 198 Cb 0.61 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 1p62 h GLN 198 CO 0.00 0.27 -0.02 0.41 -0.95 0.00 0.00 178.83 178.54 1p62 n GLY 199 N -0.30 -0.64 3.69 3.46 0.00 -1.26 -4.92 105.19 105.22 1p62 n GLY 199 Ca -0.01 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1p62 n GLY 199 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p62 s ILE 200 N -2.09 3.33 0.42 -0.61 1.01 -0.77 -4.99 121.20 117.50 1p62 s ILE 200 Ca 0.41 0.79 -0.13 0.00 0.00 0.00 0.00 60.65 61.72 1p62 s ILE 200 Cb 0.21 -3.51 -0.07 0.00 0.01 0.00 0.00 42.46 39.10 1p62 s ILE 200 CO 0.38 0.01 0.83 -2.16 0.00 0.00 0.00 174.94 173.99 1p62 s PRO 201 N 2.31 3.86 0.33 2.79 0.04 -1.26 -4.97 135.00 138.10 1p62 s PRO 201 Ca 0.68 0.64 0.08 0.00 0.04 0.00 0.00 61.00 62.45 1p62 s PRO 201 Cb -0.36 -2.32 0.82 0.00 0.04 0.00 0.00 34.50 32.67 1p62 s PRO 201 CO 0.29 -0.07 1.78 1.25 0.04 0.00 0.00 177.00 180.30 1p62 h LEU 202 N 1.32 0.71 -0.80 -3.56 5.85 -1.95 -1.82 115.31 115.05 1p62 h LEU 202 Ca -0.47 0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.43 1p62 h LEU 202 Cb 1.18 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 1p62 h LEU 202 CO 0.63 0.24 0.45 -0.08 -0.34 0.00 0.00 178.44 179.34 1p62 h GLU 203 N 0.68 0.74 -0.25 1.25 4.81 -1.99 0.92 114.58 120.75 1p62 h GLU 203 Ca 0.57 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.73 1p62 h GLU 203 Cb 1.00 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 1p62 h GLU 203 CO -0.36 0.49 0.06 -0.92 -0.73 0.00 0.00 179.01 177.55 1p62 h TYR 204 N 0.76 0.42 -0.97 0.92 3.20 -1.72 -1.71 116.97 117.86 1p62 h TYR 204 Ca 0.39 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 62.22 1p62 h TYR 204 Cb 0.36 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 1p62 h TYR 204 CO -0.07 0.49 0.64 -0.07 -1.64 0.00 0.00 178.16 177.51 1p62 h LEU 205 N 0.22 1.11 -0.56 2.82 3.38 -1.28 -2.26 115.31 118.73 1p62 h LEU 205 Ca 0.08 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1p62 h LEU 205 Cb 0.28 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1p62 h LEU 205 CO 0.00 0.80 0.08 -0.08 0.09 0.00 0.00 178.44 179.33 1p62 h GLU 206 N 1.30 0.94 -0.41 1.13 4.81 -0.74 -0.54 114.58 121.08 1p62 h GLU 206 Ca 0.36 -0.26 0.08 0.00 -0.13 0.00 0.00 59.36 59.40 1p62 h GLU 206 Cb -0.14 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.07 1p62 h GLU 206 CO -0.08 0.91 0.00 0.87 -0.73 0.00 0.00 179.01 179.98 1p62 h LYS 207 N 0.83 0.11 -0.80 1.92 1.57 -0.98 -1.74 116.57 117.48 1p62 h LYS 207 Ca 0.17 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 1p62 h LYS 207 Cb 0.43 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 1p62 h LYS 207 CO 0.01 0.07 0.37 -0.07 -0.57 0.00 0.00 179.45 179.26 1p62 h LEU 208 N 0.11 1.05 -0.17 2.94 3.38 -1.29 -2.70 115.31 118.63 1p62 h LEU 208 Ca 0.20 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.09 1p62 h LEU 208 Cb 0.29 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 1p62 h LEU 208 CO -0.34 0.90 -0.14 -0.74 0.09 0.00 0.00 178.44 178.21 1p62 h HIS 209 N 1.14 -0.36 0.00 1.13 2.76 -0.79 -1.58 115.15 117.45 1p62 h HIS 209 Ca 0.27 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.41 1p62 h HIS 209 Cb 0.14 0.19 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 1p62 h HIS 209 CO 0.02 -0.21 -0.27 1.88 -1.30 0.00 0.00 177.93 178.04 1p62 h TYR 210 N -0.16 0.00 -0.26 5.26 -1.99 -1.18 -0.07 116.97 118.57 1p62 h TYR 210 Ca 0.11 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.70 1p62 h TYR 210 Cb 0.32 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.04 1p62 h TYR 210 CO -0.28 0.27 -0.39 0.87 -0.00 0.00 0.00 178.16 178.63 1p62 h LYS 211 N 0.00 0.73 -0.52 4.88 1.57 -1.19 -1.41 116.57 120.63 1p62 h LYS 211 Ca -0.00 -0.43 0.04 0.00 -1.87 0.00 0.00 60.65 58.38 1p62 h LYS 211 Cb 0.54 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 1p62 h LYS 211 CO 0.04 1.06 0.28 0.45 -0.57 0.00 0.00 179.45 180.71 1p62 h HIS 212 N 0.47 0.53 -0.61 -1.35 3.86 -0.69 -1.83 115.15 115.52 1p62 h HIS 212 Ca 0.03 0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 59.16 1p62 h HIS 212 Cb 0.98 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.27 1p62 h HIS 212 CO 0.08 0.27 0.01 0.93 0.86 0.00 0.00 177.93 180.09 1p62 h GLU 213 N 0.56 1.06 -0.54 2.45 4.39 -0.92 -0.26 114.58 121.32 1p62 h GLU 213 Ca 0.22 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1p62 h GLU 213 Cb 0.10 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1p62 h GLU 213 CO -0.14 1.03 0.33 1.03 -1.16 0.00 0.00 179.01 180.11 1p62 h SER 214 N 0.96 0.64 -0.08 1.42 0.87 -1.09 -0.58 113.55 115.69 1p62 h SER 214 Ca 0.17 -0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.60 1p62 h SER 214 Cb 0.54 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1p62 h SER 214 CO 0.03 0.49 -0.30 -0.25 -0.53 0.00 0.00 176.83 176.27 1p62 h TRP 215 N 0.72 0.46 0.00 2.24 7.01 -1.08 -0.11 115.95 125.19 1p62 h TRP 215 Ca 0.19 -0.19 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1p62 h TRP 215 Cb -0.03 -0.07 0.00 0.00 -2.10 0.00 0.00 29.16 26.95 1p62 h TRP 215 CO -0.03 0.91 -1.15 1.28 -2.79 0.00 0.00 178.44 176.67 1p62 n LEU 216 N -4.44 0.11 -0.07 0.65 4.77 -0.13 -3.71 117.00 114.19 1p62 n LEU 216 Ca -0.08 -0.14 -0.10 0.00 -0.03 0.00 0.00 56.01 55.66 1p62 n LEU 216 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1p62 n LEU 216 CO 0.41 0.03 -0.67 -0.11 -1.33 0.00 0.00 177.39 175.73 1p62 n LEU 217 N -1.65 1.68 0.14 2.23 7.94 -0.57 -4.67 117.00 122.09 1p62 n LEU 217 Ca -0.01 0.28 0.01 0.00 -1.11 0.00 0.00 56.01 55.18 1p62 n LEU 217 Cb 0.21 -0.64 0.07 0.00 0.53 0.00 0.00 43.42 43.60 1p62 n LEU 217 CO 0.19 -0.21 0.46 0.45 -1.11 0.00 0.00 177.39 177.17 1p62 h HIS 218 N -0.75 0.00 -5.24 1.96 3.86 -1.29 -3.48 115.15 110.21 1p62 h HIS 218 Ca -0.12 0.00 -0.41 0.00 -1.16 0.00 0.00 60.37 58.69 1p62 h HIS 218 Cb 0.91 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.38 1p62 h HIS 218 CO -0.27 0.56 -0.62 0.54 0.86 0.00 0.00 177.93 179.00 1p62 n ARG 219 N -3.32 -4.80 0.00 2.45 1.74 -0.35 -4.89 116.66 107.47 1p62 n ARG 219 Ca 0.01 0.71 0.11 0.00 -0.77 0.00 0.00 57.85 57.91 1p62 n ARG 219 Cb 0.72 -5.54 0.04 0.00 -1.02 0.00 0.00 32.46 26.66 1p62 n ARG 219 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1p62 n THR 220 N -4.40 0.00 -2.76 0.55 -2.24 -0.20 -4.93 114.28 100.30 1p62 n THR 220 Ca -0.04 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.08 1p62 n THR 220 Cb 0.57 1.15 -0.03 0.00 -2.10 0.00 0.00 70.33 69.92 1p62 n THR 220 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1p62 s LEU 221 N -2.49 4.11 -0.04 3.22 0.20 -1.13 -5.00 118.68 117.55 1p62 s LEU 221 Ca 0.19 1.25 -0.21 0.00 0.69 0.00 0.00 54.13 56.05 1p62 s LEU 221 Cb 0.18 -3.39 -0.05 0.00 -0.43 0.00 0.00 46.19 42.51 1p62 s LEU 221 CO 0.57 -0.58 0.60 -1.59 -0.29 0.00 0.00 176.35 175.06 1p62 s LYS 222 N 2.92 4.35 0.43 1.98 -2.85 -1.26 -4.89 119.74 120.42 1p62 s LYS 222 Ca 0.40 0.72 0.03 0.00 -1.00 0.00 0.00 55.97 56.12 1p62 s LYS 222 Cb -0.15 -3.38 -0.02 0.00 -2.06 0.00 0.00 37.83 32.21 1p62 s LYS 222 CO 0.08 0.26 0.10 0.95 0.10 0.00 0.00 175.35 176.83 1p62 s THR 223 N 0.20 0.77 -0.67 3.79 -4.23 -1.26 -5.06 115.64 109.18 1p62 s THR 223 Ca 0.32 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 58.94 1p62 s THR 223 Cb -0.18 -2.32 0.61 0.00 1.34 0.00 0.00 72.50 71.95 1p62 s THR 223 CO 0.16 0.00 1.45 0.59 -0.54 0.00 0.00 174.62 176.28 1p62 n ASN 224 N -1.29 4.38 -3.66 3.99 5.03 -1.26 -4.69 115.26 117.77 1p62 n ASN 224 Ca -0.09 -2.60 -0.29 0.00 0.87 0.00 0.00 54.58 52.47 1p62 n ASN 224 Cb 0.65 -0.60 -0.12 0.00 -1.02 0.00 0.00 39.78 38.69 1p62 n ASN 224 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1p62 s PHE 225 N -2.18 1.94 0.36 3.10 0.40 -1.26 -5.02 117.98 115.33 1p62 s PHE 225 Ca 0.41 -2.47 0.11 0.00 -0.60 0.00 0.00 56.93 54.38 1p62 s PHE 225 Cb 0.30 -1.74 0.90 0.00 0.51 0.00 0.00 43.02 42.99 1p62 s PHE 225 CO 0.14 -0.76 1.83 -0.44 0.70 0.00 0.00 175.22 176.69 1p62 h ASP 226 N 6.34 0.61 -0.03 1.36 3.32 -2.05 -2.16 116.42 123.81 1p62 h ASP 226 Ca 0.07 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.20 1p62 h ASP 226 Cb 0.90 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 1p62 h ASP 226 CO 0.48 0.24 0.03 0.10 -1.72 0.00 0.00 179.24 178.37 1p62 h TYR 227 N 0.61 0.00 0.00 4.55 -0.00 -1.99 -2.83 116.97 117.31 1p62 h TYR 227 Ca 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 59.19 1p62 h TYR 227 Cb 0.99 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.71 1p62 h TYR 227 CO -0.00 0.00 -0.23 -0.07 -0.00 0.00 0.00 178.16 177.85 1p62 h LEU 228 N 0.00 0.00 -2.16 0.10 3.38 -1.80 -2.14 115.31 112.70 1p62 h LEU 228 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1p62 h LEU 228 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1p62 h LEU 228 CO -0.00 0.23 -0.04 -0.61 0.09 0.00 0.00 178.44 178.11 1p62 h GLN 229 N 0.00 0.00 -0.00 1.13 5.75 -1.70 -2.98 115.11 117.31 1p62 h GLN 229 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1p62 h GLN 229 Cb 0.47 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.02 1p62 h GLN 229 CO 0.03 0.04 -0.41 0.39 -2.65 0.00 0.00 178.83 176.23 1p62 n GLU 230 N -3.28 3.13 -1.68 1.69 -0.58 -0.84 -5.01 120.64 114.07 1p62 n GLU 230 Ca -0.02 -0.18 -0.45 0.00 -0.42 0.00 0.00 57.16 56.09 1p62 n GLU 230 Cb 0.20 -1.02 -0.04 0.00 -0.57 0.00 0.00 31.44 30.01 1p62 n GLU 230 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1p62 n VAL 231 N -0.95 0.26 -1.90 2.62 0.31 -1.00 -4.92 118.33 112.76 1p62 n VAL 231 Ca 0.03 -0.06 -0.40 0.00 -0.01 0.00 0.00 64.34 63.89 1p62 n VAL 231 Cb 0.18 -1.57 -0.00 0.00 -0.91 0.00 0.00 33.84 31.54 1p62 n VAL 231 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1p62 s PRO 232 N 0.56 4.05 -0.06 5.55 0.02 -1.26 -4.87 135.00 139.00 1p62 s PRO 232 Ca 0.75 2.42 0.03 0.00 0.02 0.00 0.00 61.00 64.23 1p62 s PRO 232 Cb -0.65 -2.90 0.00 0.00 0.02 0.00 0.00 34.50 30.97 1p62 s PRO 232 CO 0.41 -0.52 -0.15 0.42 -0.33 0.00 0.00 177.00 176.83 1p62 s ILE 233 N -1.16 1.30 -0.27 2.83 1.01 -1.26 -1.39 121.20 122.27 1p62 s ILE 233 Ca 0.54 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 60.50 1p62 s ILE 233 Cb -0.44 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 1p62 s ILE 233 CO 0.58 0.39 0.10 -0.22 0.00 0.00 0.00 174.94 175.79 1p62 s LEU 234 N 0.34 3.69 -0.27 2.97 2.96 -0.41 -5.00 118.68 122.96 1p62 s LEU 234 Ca -0.10 -0.33 -0.12 0.00 -0.22 0.00 0.00 54.13 53.37 1p62 s LEU 234 Cb -0.14 -1.95 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1p62 s LEU 234 CO 0.03 -0.09 0.23 -0.89 -1.32 0.00 0.00 176.35 174.31 1p62 s THR 235 N 1.61 5.29 -0.17 3.68 2.01 -1.26 -0.79 115.64 126.01 1p62 s THR 235 Ca 0.06 0.27 -0.00 0.00 0.31 0.00 0.00 61.69 62.33 1p62 s THR 235 Cb -0.16 -3.56 0.01 0.00 0.01 0.00 0.00 72.50 68.79 1p62 s THR 235 CO 0.05 0.25 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.31 1p62 s LEU 236 N 1.67 2.40 -0.21 4.42 1.43 0.11 -4.99 118.68 123.52 1p62 s LEU 236 Ca 0.09 -0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 52.37 1p62 s LEU 236 Cb -0.15 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 1p62 s LEU 236 CO 0.09 0.04 1.26 -0.62 0.23 0.00 0.00 176.35 177.35 1p62 s ASP 237 N 1.10 6.87 -0.19 2.29 3.68 -1.26 -1.23 116.67 127.93 1p62 s ASP 237 Ca 0.00 1.52 0.15 0.00 2.13 0.00 0.00 52.55 56.36 1p62 s ASP 237 Cb -0.14 -2.54 0.44 0.00 -1.45 0.00 0.00 42.92 39.23 1p62 s ASP 237 CO -0.05 -0.85 1.33 1.33 0.13 0.00 0.00 175.17 177.06 1p62 n VAL 238 N 5.62 2.22 0.22 1.11 0.24 -0.23 -4.68 118.33 122.83 1p62 n VAL 238 Ca 0.14 -2.31 0.08 0.00 -2.04 0.00 0.00 64.34 60.21 1p62 n VAL 238 Cb 0.45 -0.26 0.53 0.00 -1.47 0.00 0.00 33.84 33.09 1p62 n VAL 238 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 1p62 h ASN 239 N 1.01 0.00 -3.80 -1.34 2.35 -1.92 -3.45 115.58 108.43 1p62 h ASN 239 Ca 0.05 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.32 1p62 h ASN 239 Cb 1.32 0.00 0.06 0.00 0.05 0.00 0.00 38.32 39.74 1p62 h ASN 239 CO 0.17 0.24 0.22 -1.61 -1.65 0.00 0.00 177.43 174.79 1p62 s GLU 240 N -4.11 2.99 0.24 0.81 0.41 -1.26 -5.00 118.70 112.78 1p62 s GLU 240 Ca -0.02 0.11 -0.31 0.00 -0.41 0.00 0.00 54.97 54.34 1p62 s GLU 240 Cb 0.13 -2.23 -0.11 0.00 -1.78 0.00 0.00 34.13 30.13 1p62 s GLU 240 CO 0.65 -0.70 1.63 -0.51 -0.49 0.00 0.00 175.26 175.84 1p62 s ASP 241 N -4.29 6.43 0.22 -0.19 1.11 -1.26 -4.89 116.67 113.81 1p62 s ASP 241 Ca 0.54 2.84 -0.08 0.00 0.18 0.00 0.00 52.55 56.03 1p62 s ASP 241 Cb -0.11 -2.61 0.27 0.00 1.07 0.00 0.00 42.92 41.54 1p62 s ASP 241 CO 0.46 -0.90 1.84 0.15 1.18 0.00 0.00 175.17 177.90 1p62 h PHE 242 N 5.94 0.86 -0.72 4.23 3.57 -1.94 -2.41 116.94 126.47 1p62 h PHE 242 Ca -0.45 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.23 1p62 h PHE 242 Cb 1.21 -0.28 -0.11 0.00 2.79 0.00 0.00 35.95 39.57 1p62 h PHE 242 CO 0.62 0.44 0.16 -0.22 -2.23 0.00 0.00 178.31 177.09 1p62 h LYS 243 N 0.86 0.26 0.00 1.11 3.64 -2.01 -1.35 116.57 119.08 1p62 h LYS 243 Ca 0.33 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.53 1p62 h LYS 243 Cb 0.14 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1p62 h LYS 243 CO -0.16 0.17 -0.77 -0.44 -2.27 0.00 0.00 179.45 175.98 1p62 h ASP 244 N 0.26 0.00 0.31 4.20 3.32 -1.83 -3.35 116.42 119.33 1p62 h ASP 244 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 1p62 h ASP 244 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1p62 h ASP 244 CO -0.50 0.77 -0.69 0.29 -1.72 0.00 0.00 179.24 177.40 1p62 n LYS 245 N -3.37 0.01 -0.02 3.56 4.76 -0.82 -4.62 118.16 117.67 1p62 n LYS 245 Ca 0.00 -0.01 -0.09 0.00 -2.87 0.00 0.00 58.31 55.34 1p62 n LYS 245 Cb 0.82 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 1p62 n LYS 245 CO 0.00 0.00 0.00 -0.92 -1.37 0.00 0.00 177.40 175.11 1p62 h TYR 246 N 0.02 -0.65 -0.26 2.13 3.20 -1.41 -2.71 116.97 117.29 1p62 h TYR 246 Ca 0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1p62 h TYR 246 Cb 0.50 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 1p62 h TYR 246 CO 0.00 -0.32 0.10 0.93 -1.64 0.00 0.00 178.16 177.23 1p62 h GLU 247 N -0.29 0.39 -0.50 1.82 4.39 -1.88 -2.02 114.58 116.50 1p62 h GLU 247 Ca 0.11 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.67 1p62 h GLU 247 Cb 0.46 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 1p62 h GLU 247 CO -0.34 0.43 0.01 0.66 -1.16 0.00 0.00 179.01 178.61 1p62 h SER 248 N 0.27 0.80 -0.46 1.42 4.64 -1.85 -2.61 113.55 115.76 1p62 h SER 248 Ca 0.09 -0.19 0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1p62 h SER 248 Cb 0.18 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.02 1p62 h SER 248 CO -0.01 0.86 0.21 -0.07 -0.87 0.00 0.00 176.83 176.95 1p62 h LEU 249 N 0.78 0.29 -0.05 5.97 3.38 -1.23 -2.48 115.31 121.96 1p62 h LEU 249 Ca 0.15 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1p62 h LEU 249 Cb 0.45 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1p62 h LEU 249 CO 0.02 0.21 0.00 0.58 0.09 0.00 0.00 178.44 179.34 1p62 h VAL 250 N 0.42 0.96 -0.64 1.22 2.07 -1.05 -1.73 116.25 117.50 1p62 h VAL 250 Ca 0.20 -0.01 0.09 0.00 0.82 0.00 0.00 66.70 67.80 1p62 h VAL 250 Cb 0.14 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 1p62 h VAL 250 CO -0.16 0.00 0.29 -0.33 0.02 0.00 0.00 177.57 177.39 1p62 h GLU 251 N 0.02 0.49 -0.54 1.57 5.08 -1.40 0.25 114.58 120.05 1p62 h GLU 251 Ca 0.02 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1p62 h GLU 251 Cb 0.03 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1p62 h GLU 251 CO -0.04 0.32 0.04 0.87 -1.00 0.00 0.00 179.01 179.21 1p62 h LYS 252 N 0.50 0.90 -0.17 2.33 1.57 -1.12 -1.80 116.57 118.77 1p62 h LYS 252 Ca 0.32 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1p62 h LYS 252 Cb 0.35 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1p62 h LYS 252 CO -0.28 0.86 0.04 0.28 -0.57 0.00 0.00 179.45 179.78 1p62 h VAL 253 N 0.84 1.21 -0.58 0.50 2.07 -0.69 -1.97 116.25 117.62 1p62 h VAL 253 Ca 0.17 -0.67 0.05 0.00 0.82 0.00 0.00 66.70 67.07 1p62 h VAL 253 Cb 0.43 1.32 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 1p62 h VAL 253 CO 0.02 0.20 0.31 0.11 0.02 0.00 0.00 177.57 178.23 1p62 h LYS 254 N 0.09 0.57 -0.05 1.57 1.57 -0.74 -1.76 116.57 117.82 1p62 h LYS 254 Ca 0.05 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1p62 h LYS 254 Cb 0.28 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1p62 h LYS 254 CO 0.00 0.37 0.02 1.49 -0.57 0.00 0.00 179.45 180.76 1p62 h GLU 255 N 0.58 0.07 -0.49 3.15 4.81 -1.35 -2.46 114.58 118.89 1p62 h GLU 255 Ca 0.26 -0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.58 1p62 h GLU 255 Cb 0.16 -0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.44 1p62 h GLU 255 CO -0.17 0.21 -0.15 0.35 -0.73 0.00 0.00 179.01 178.51 1p62 h PHE 256 N -0.08 -0.34 -0.22 0.92 3.04 -1.26 -2.53 116.94 116.47 1p62 h PHE 256 Ca 0.02 0.05 -0.03 0.00 3.98 0.00 0.00 57.97 61.98 1p62 h PHE 256 Cb 0.16 0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.89 1p62 h PHE 256 CO -0.02 -0.24 0.00 -0.07 -2.02 0.00 0.00 178.31 175.96 1p62 h LEU 257 N -0.04 0.29 -1.54 0.59 3.38 -1.25 -2.16 115.31 114.59 1p62 h LEU 257 Ca 0.23 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.19 1p62 h LEU 257 Cb 0.39 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1p62 h LEU 257 CO -0.52 0.34 0.34 0.28 0.09 0.00 0.00 178.44 178.97 1p62 h SER 258 N 0.31 0.53 1.00 -0.43 0.02 -0.99 -2.75 113.55 111.24 1p62 h SER 258 Ca 0.07 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1p62 h SER 258 Cb 0.21 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1p62 h SER 258 CO 0.00 0.37 0.00 0.71 -1.14 0.00 0.00 176.83 176.78 1p62 h THR 259 N 0.62 0.00 -0.02 -2.27 1.35 -1.30 -3.52 112.91 107.77 1p62 h THR 259 Ca 0.20 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1p62 h THR 259 Cb 0.02 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1p62 h THR 259 CO -0.05 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.40