#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tm9 n GLU 2 N 0.00 0.00 -3.34 0.03 2.13 -1.26 -5.19 120.64 113.00 1tm9 n GLU 2 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1tm9 n GLU 2 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1tm9 n GLU 2 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1tm9 n GLN 3 N -0.35 -1.68 0.00 5.31 -0.06 -1.26 -5.14 117.38 114.20 1tm9 n GLN 3 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1tm9 n GLN 3 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1tm9 n GLN 3 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 1tm9 n ASN 4 N 1.03 -0.74 -0.02 1.69 2.85 -1.26 -4.93 115.26 113.88 1tm9 n ASN 4 Ca 0.00 -0.01 -0.03 0.00 -0.11 0.00 0.00 54.58 54.44 1tm9 n ASN 4 Cb 0.00 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 1tm9 n ASN 4 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1tm9 n ASN 5 N -1.13 0.88 0.00 1.20 3.02 -1.26 -4.18 115.26 113.79 1tm9 n ASN 5 Ca 0.00 0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1tm9 n ASN 5 Cb 0.00 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 1tm9 n ASN 5 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1tm9 n ILE 6 N -3.36 0.00 -0.30 2.41 2.08 -1.26 0.15 119.36 119.08 1tm9 n ILE 6 Ca -0.04 1.48 0.13 0.00 0.56 0.00 0.00 62.75 64.87 1tm9 n ILE 6 Cb 0.16 -2.44 0.29 0.00 -0.75 0.00 0.00 39.64 36.91 1tm9 n ILE 6 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1tm9 h LYS 7 N 0.00 0.28 -0.43 0.38 3.64 -2.00 0.47 116.57 118.91 1tm9 h LYS 7 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1tm9 h LYS 7 Cb 0.00 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1tm9 h LYS 7 CO 0.00 0.19 0.27 1.49 -2.27 0.00 0.00 179.45 179.13 1tm9 h GLU 8 N 0.29 0.58 -0.99 1.90 4.57 -1.67 -1.99 114.58 117.27 1tm9 h GLU 8 Ca 0.55 -0.05 0.17 0.00 -1.18 0.00 0.00 59.36 58.85 1tm9 h GLU 8 Cb 1.07 -0.13 -0.09 0.00 -0.16 0.00 0.00 28.75 29.44 1tm9 h GLU 8 CO -0.59 0.41 0.61 1.96 -1.18 0.00 0.00 179.01 180.22 1tm9 h GLN 9 N 0.58 0.75 0.89 1.92 4.20 0.62 -1.51 115.11 122.56 1tm9 h GLN 9 Ca 0.16 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 1tm9 h GLN 9 Cb -0.03 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 27.59 1tm9 h GLN 9 CO -0.03 0.50 -0.43 -0.07 -0.67 0.00 0.00 178.83 178.13 1tm9 h LEU 10 N 0.77 -1.01 -0.78 1.46 3.38 -0.58 -2.79 115.31 115.76 1tm9 h LEU 10 Ca 0.54 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.64 1tm9 h LEU 10 Cb 0.82 0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.72 1tm9 h LEU 10 CO -0.32 -0.71 -0.50 0.40 0.09 0.00 0.00 178.44 177.40 1tm9 h ILE 11 N -1.22 0.03 -0.73 1.22 5.03 -0.94 0.53 117.51 121.42 1tm9 h ILE 11 Ca -0.12 0.00 0.07 0.00 -0.12 0.00 0.00 64.86 64.68 1tm9 h ILE 11 Cb 0.92 0.03 -0.09 0.00 -3.03 0.00 0.00 36.82 34.65 1tm9 h ILE 11 CO 0.20 0.00 -0.43 -0.24 -0.68 0.00 0.00 178.15 177.00 1tm9 n SER 12 N -5.36 -0.77 0.00 1.72 2.88 -0.69 0.22 113.62 111.61 1tm9 n SER 12 Ca 0.03 1.49 0.00 0.00 -1.33 0.00 0.00 58.87 59.06 1tm9 n SER 12 Cb 0.33 -0.26 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 1tm9 n SER 12 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1tm9 n PHE 13 N -4.69 0.00 -0.34 0.66 3.72 -0.02 -1.90 117.46 114.89 1tm9 n PHE 13 Ca 0.01 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.58 1tm9 n PHE 13 Cb 0.19 -0.34 0.33 0.00 -0.94 0.00 0.00 39.48 38.72 1tm9 n PHE 13 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1tm9 n PHE 14 N -1.72 0.70 -0.25 1.38 7.35 -0.05 0.20 117.46 125.07 1tm9 n PHE 14 Ca 0.00 1.19 0.06 0.00 -0.76 0.00 0.00 57.45 57.94 1tm9 n PHE 14 Cb 0.00 -1.29 0.19 0.00 0.35 0.00 0.00 39.48 38.73 1tm9 n PHE 14 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 1tm9 h ASN 15 N 0.00 0.19 -0.40 -2.13 -1.24 0.29 0.18 115.58 112.47 1tm9 h ASN 15 Ca 0.63 0.12 -0.26 0.00 0.71 0.00 0.00 56.30 57.50 1tm9 h ASN 15 Cb 1.37 0.12 -0.10 0.00 0.73 0.00 0.00 38.32 40.44 1tm9 h ASN 15 CO -0.91 0.05 0.17 0.00 -1.29 0.00 0.00 177.43 175.46 1tm9 n GLN 16 N -5.06 1.77 0.00 6.67 10.64 0.54 -4.17 117.38 127.77 1tm9 n GLN 16 Ca 0.15 -1.26 0.00 0.00 -1.83 0.00 0.00 57.00 54.06 1tm9 n GLN 16 Cb 0.44 -1.65 0.00 0.00 -0.86 0.00 0.00 30.24 28.18 1tm9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1tm9 n ALA 17 N 1.11 1.55 -3.20 2.61 0.00 0.56 -4.67 120.51 118.48 1tm9 n ALA 17 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.40 1tm9 n ALA 17 Cb 0.61 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.91 1tm9 n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tm9 n SER 19 N 3.70 1.39 -3.57 0.00 7.64 -1.26 -4.57 113.62 116.95 1tm9 n SER 19 Ca -0.18 0.22 -0.32 0.00 1.01 0.00 0.00 58.87 59.59 1tm9 n SER 19 Cb 0.52 -0.50 0.02 0.00 -1.01 0.00 0.00 64.21 63.25 1tm9 n SER 19 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1tm9 n THR 20 N -3.88 0.00 -0.10 0.44 -2.24 -1.26 -4.94 114.28 102.30 1tm9 n THR 20 Ca -0.10 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 1tm9 n THR 20 Cb 0.33 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.52 1tm9 n THR 20 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1tm9 n HIS 21 N -1.74 0.00 -0.36 4.78 8.25 -1.26 -4.38 115.22 120.51 1tm9 n HIS 21 Ca 0.03 0.00 0.37 0.00 -0.26 0.00 0.00 57.72 57.86 1tm9 n HIS 21 Cb 0.45 -0.57 0.72 0.00 1.12 0.00 0.00 29.99 31.71 1tm9 n HIS 21 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1tm9 h GLN 22 N -0.99 0.00 -0.92 -0.41 4.20 -2.01 0.88 115.11 115.86 1tm9 h GLN 22 Ca -0.10 0.00 0.22 0.00 0.06 0.00 0.00 58.65 58.83 1tm9 h GLN 22 Cb 1.08 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.79 1tm9 h GLN 22 CO -0.06 0.00 0.61 1.05 -0.67 0.00 0.00 178.83 179.76 1tm9 h GLU 23 N 0.00 0.34 0.96 1.46 -0.00 -1.96 -1.28 114.58 114.10 1tm9 h GLU 23 Ca 0.61 -0.02 -0.05 0.00 -0.00 0.00 0.00 59.36 59.90 1tm9 h GLU 23 Cb 2.66 -0.08 0.01 0.00 -0.00 0.00 0.00 28.75 31.34 1tm9 h GLU 23 CO -0.01 0.23 -0.46 0.00 -0.00 0.00 0.00 179.01 178.77 1tm9 h ARG 24 N 0.35 -1.24 -0.20 1.06 -0.00 0.56 1.53 114.38 116.44 1tm9 h ARG 24 Ca 0.48 0.08 0.06 0.00 -0.50 0.00 0.00 59.98 60.10 1tm9 h ARG 24 Cb 1.29 0.28 -0.01 0.00 0.00 0.00 0.00 29.97 31.53 1tm9 h ARG 24 CO -0.17 -0.83 0.36 -0.07 0.00 0.00 0.00 179.97 179.26 1tm9 h LEU 25 N -1.31 0.00 0.00 3.04 3.38 -1.42 1.19 115.31 120.19 1tm9 h LEU 25 Ca -0.13 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.68 1tm9 h LEU 25 Cb 0.98 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 1tm9 h LEU 25 CO 0.22 0.00 -1.40 -0.67 0.09 0.00 0.00 178.44 176.68 1tm9 n ASP 26 N -3.35 0.87 0.18 -0.43 -0.08 -0.58 -4.23 116.55 108.92 1tm9 n ASP 26 Ca 0.02 0.38 -0.11 0.00 -1.51 0.00 0.00 54.79 53.57 1tm9 n ASP 26 Cb 0.47 0.16 -0.06 0.00 2.34 0.00 0.00 41.12 44.03 1tm9 n ASP 26 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1tm9 h PHE 27 N 0.00 -0.47 -1.90 -0.67 3.57 1.14 0.26 116.94 118.87 1tm9 h PHE 27 Ca -0.16 -0.01 0.55 0.00 3.53 0.00 0.00 57.97 61.88 1tm9 h PHE 27 Cb 1.56 0.15 -0.08 0.00 2.79 0.00 0.00 35.95 40.38 1tm9 h PHE 27 CO 0.00 -0.16 1.39 0.44 -2.23 0.00 0.00 178.31 177.74 1tm9 n ILE 28 N -5.13 0.00 0.00 1.41 -5.35 -0.26 0.21 119.36 110.24 1tm9 n ILE 28 Ca -0.08 1.45 0.00 0.00 -0.27 0.00 0.00 62.75 63.84 1tm9 n ILE 28 Cb 0.26 -2.42 0.00 0.00 -1.74 0.00 0.00 39.64 35.75 1tm9 n ILE 28 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tm9 n SER 30 N -2.14 -0.14 -0.28 0.00 7.64 0.91 0.98 113.62 120.58 1tm9 n SER 30 Ca 0.00 1.61 0.13 0.00 1.01 0.00 0.00 58.87 61.63 1tm9 n SER 30 Cb 0.00 -0.57 0.26 0.00 -1.01 0.00 0.00 64.21 62.88 1tm9 n SER 30 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1tm9 n THR 31 N -5.42 -0.34 -1.91 0.44 -1.04 0.56 0.19 114.28 106.75 1tm9 n THR 31 Ca 0.21 1.77 -0.26 0.00 -2.04 0.00 0.00 64.05 63.73 1tm9 n THR 31 Cb 0.70 -2.61 0.03 0.00 -1.82 0.00 0.00 70.33 66.63 1tm9 n THR 31 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1tm9 n ARG 32 N -5.13 3.42 -2.70 -2.82 0.63 0.27 -4.61 116.66 105.73 1tm9 n ARG 32 Ca 0.20 -4.01 -0.05 0.00 -0.92 0.00 0.00 57.85 53.06 1tm9 n ARG 32 Cb 0.66 -2.28 0.11 0.00 0.45 0.00 0.00 32.46 31.40 1tm9 n ARG 32 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1tm9 n GLU 33 N -0.73 1.27 0.00 -0.14 -0.58 0.51 -5.03 120.64 115.93 1tm9 n GLU 33 Ca 0.47 -1.93 0.00 0.00 -0.42 0.00 0.00 57.16 55.28 1tm9 n GLU 33 Cb 0.89 -0.15 0.00 0.00 -0.57 0.00 0.00 31.44 31.60 1tm9 n GLU 33 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1tm9 n SER 34 N -0.79 0.00 0.02 1.62 2.88 -1.12 -4.73 113.62 111.49 1tm9 n SER 34 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 1tm9 n SER 34 Cb 0.85 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.31 1tm9 n SER 34 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1tm9 n ASP 35 N 0.00 -0.34 -0.00 -3.46 9.92 -1.26 -4.94 116.55 116.46 1tm9 n ASP 35 Ca 0.00 0.12 0.04 0.00 -0.53 0.00 0.00 54.79 54.42 1tm9 n ASP 35 Cb 0.00 0.55 -0.06 0.00 -0.64 0.00 0.00 41.12 40.97 1tm9 n ASP 35 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1tm9 n THR 36 N -2.39 0.00 0.00 -3.53 5.66 -1.26 -5.00 114.28 107.76 1tm9 n THR 36 Ca 0.00 -0.19 0.00 0.00 -3.05 0.00 0.00 64.05 60.81 1tm9 n THR 36 Cb 0.00 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.15 1tm9 n THR 36 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1tm9 n PHE 37 N -1.73 0.00 0.34 1.09 3.72 -1.26 -4.59 117.46 115.03 1tm9 n PHE 37 Ca -0.01 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.43 1tm9 n PHE 37 Cb 0.20 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 38.95 1tm9 n PHE 37 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1tm9 n SER 38 N 1.89 0.00 0.09 4.37 2.88 -1.26 -0.87 113.62 120.73 1tm9 n SER 38 Ca 0.00 0.44 0.08 0.00 -1.33 0.00 0.00 58.87 58.07 1tm9 n SER 38 Cb 0.00 -0.47 -0.01 0.00 -0.75 0.00 0.00 64.21 62.98 1tm9 n SER 38 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1tm9 h SER 39 N 0.00 0.00 -2.62 -3.46 0.02 -1.94 -3.46 113.55 102.09 1tm9 h SER 39 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 1tm9 h SER 39 Cb 0.15 0.00 0.22 0.00 0.14 0.00 0.00 62.40 62.91 1tm9 h SER 39 CO 0.00 0.16 -1.18 0.52 -1.14 0.00 0.00 176.83 175.19 1tm9 n VAL 40 N -2.77 0.25 -1.20 2.27 0.31 -0.05 -4.81 118.33 112.33 1tm9 n VAL 40 Ca -0.02 -0.39 -0.36 0.00 -0.01 0.00 0.00 64.34 63.56 1tm9 n VAL 40 Cb 0.63 -0.30 0.06 0.00 -0.91 0.00 0.00 33.84 33.32 1tm9 n VAL 40 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1tm9 n ASP 41 N 1.33 -1.98 0.00 4.52 -0.08 -1.26 -4.79 116.55 114.29 1tm9 n ASP 41 Ca 0.03 0.54 0.00 0.00 -1.51 0.00 0.00 54.79 53.85 1tm9 n ASP 41 Cb 0.54 -1.13 0.00 0.00 2.34 0.00 0.00 41.12 42.86 1tm9 n ASP 41 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 1tm9 n VAL 42 N -2.39 -0.21 -2.54 5.18 3.14 -1.26 -5.00 118.33 115.24 1tm9 n VAL 42 Ca 0.08 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 61.12 1tm9 n VAL 42 Cb 0.50 -0.13 -0.04 0.00 -1.06 0.00 0.00 33.84 33.12 1tm9 n VAL 42 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1tm9 s PRO 43 N -4.96 3.93 0.10 1.45 0.04 -1.26 -4.94 135.00 129.35 1tm9 s PRO 43 Ca 0.00 1.42 0.26 0.00 0.04 0.00 0.00 61.00 62.72 1tm9 s PRO 43 Cb 0.00 -2.25 0.75 0.00 0.04 0.00 0.00 34.50 33.03 1tm9 s PRO 43 CO 0.00 -0.33 1.64 1.28 0.04 0.00 0.00 177.00 179.63 1tm9 n LEU 44 N -0.65 0.53 0.37 -3.56 4.77 -1.26 -2.99 117.00 114.21 1tm9 n LEU 44 Ca 0.08 0.37 -0.18 0.00 -0.03 0.00 0.00 56.01 56.25 1tm9 n LEU 44 Cb 0.51 -0.32 -0.09 0.00 -2.33 0.00 0.00 43.42 41.20 1tm9 n LEU 44 CO 0.42 -0.05 0.65 -0.33 -1.33 0.00 0.00 177.39 176.74 1tm9 h GLU 45 N 0.00 -0.87 -0.02 3.23 5.08 -1.96 -1.51 114.58 118.53 1tm9 h GLU 45 Ca 0.00 0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1tm9 h GLU 45 Cb 0.64 0.20 0.01 0.00 0.50 0.00 0.00 28.75 30.10 1tm9 h GLU 45 CO 0.00 -0.58 -0.33 -1.00 -1.00 0.00 0.00 179.01 176.11 1tm9 h PRO 46 N -0.90 0.26 -0.76 2.33 0.13 -1.83 -3.31 132.00 127.91 1tm9 h PRO 46 Ca -0.09 -0.25 0.12 0.00 -0.87 0.00 0.00 66.00 64.91 1tm9 h PRO 46 Cb 0.69 0.06 -0.13 0.00 0.13 0.00 0.00 31.00 31.75 1tm9 h PRO 46 CO 0.15 0.94 -0.38 0.82 -0.23 0.00 0.00 178.00 179.29 1tm9 h ILE 47 N -0.33 0.08 -1.07 -3.56 1.08 -1.59 2.41 117.51 114.53 1tm9 h ILE 47 Ca -0.03 0.00 0.31 0.00 -0.39 0.00 0.00 64.86 64.75 1tm9 h ILE 47 Cb 1.04 0.08 -0.04 0.00 -3.07 0.00 0.00 36.82 34.83 1tm9 h ILE 47 CO 0.07 0.00 0.95 0.11 -0.69 0.00 0.00 178.15 178.59 1tm9 h LYS 48 N -0.10 0.00 -0.08 2.37 1.57 -1.35 1.84 116.57 120.81 1tm9 h LYS 48 Ca 0.27 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.87 1tm9 h LYS 48 Cb 0.57 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.89 1tm9 h LYS 48 CO -0.81 0.00 -0.63 -0.97 -0.57 0.00 0.00 179.45 176.47 1tm9 h ASN 49 N 0.00 0.69 -0.11 0.86 -0.00 0.40 -2.82 115.58 114.60 1tm9 h ASN 49 Ca 0.51 -0.67 0.00 0.00 -0.00 0.00 0.00 56.30 56.14 1tm9 h ASN 49 Cb 2.41 -0.21 0.00 0.00 -0.00 0.00 0.00 38.32 40.52 1tm9 h ASN 49 CO -0.01 1.26 0.00 2.30 -0.00 0.00 0.00 177.43 180.98 1tm9 n ILE 50 N -4.14 0.15 -0.06 2.57 -5.35 0.59 -2.94 119.36 110.18 1tm9 n ILE 50 Ca -0.09 -0.16 -0.00 0.00 -0.27 0.00 0.00 62.75 62.23 1tm9 n ILE 50 Cb 0.67 0.05 -0.16 0.00 -1.74 0.00 0.00 39.64 38.46 1tm9 n ILE 50 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1tm9 n ILE 51 N -0.20 0.73 1.06 7.28 5.41 0.92 -4.14 119.36 130.42 1tm9 n ILE 51 Ca 0.08 -0.67 0.03 0.00 1.00 0.00 0.00 62.75 63.18 1tm9 n ILE 51 Cb 0.13 -0.25 0.09 0.00 -0.71 0.00 0.00 39.64 38.90 1tm9 n ILE 51 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1tm9 n GLU 52 N -2.50 1.67 0.06 0.38 1.02 -1.11 -3.19 120.64 116.97 1tm9 n GLU 52 Ca -0.19 -0.76 0.11 0.00 -0.02 0.00 0.00 57.16 56.31 1tm9 n GLU 52 Cb 0.87 -1.35 -0.06 0.00 -0.02 0.00 0.00 31.44 30.88 1tm9 n GLU 52 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1tm9 n ILE 53 N 0.11 0.38 -1.15 -3.67 0.13 -1.26 -4.00 119.36 109.91 1tm9 n ILE 53 Ca 0.07 -0.52 0.07 0.00 -1.10 0.00 0.00 62.75 61.27 1tm9 n ILE 53 Cb 0.29 -0.19 0.21 0.00 -0.84 0.00 0.00 39.64 39.10 1tm9 n ILE 53 CO 0.00 0.00 0.00 0.35 2.80 0.00 0.00 176.55 179.70 1tm9 n THR 54 N -2.50 2.19 0.00 9.51 -2.24 -1.19 -4.66 114.28 115.39 1tm9 n THR 54 Ca -0.01 -2.27 0.00 0.00 -2.27 0.00 0.00 64.05 59.50 1tm9 n THR 54 Cb 0.55 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 1tm9 n THR 54 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1tm9 n LYS 55 N -0.98 0.00 -1.42 -0.78 5.02 -1.26 -4.25 118.16 114.49 1tm9 n LYS 55 Ca 0.21 0.35 -0.40 0.00 -2.02 0.00 0.00 58.31 56.46 1tm9 n LYS 55 Cb 0.82 -1.05 0.02 0.00 -0.02 0.00 0.00 35.03 34.79 1tm9 n LYS 55 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1tm9 n ASP 56 N -1.56 -1.47 0.18 4.39 9.92 -1.26 -4.73 116.55 122.03 1tm9 n ASP 56 Ca 0.00 0.81 0.02 0.00 -0.53 0.00 0.00 54.79 55.09 1tm9 n ASP 56 Cb 0.00 -1.08 0.34 0.00 -0.64 0.00 0.00 41.12 39.74 1tm9 n ASP 56 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 1tm9 h GLU 57 N 0.46 0.00 -0.19 -1.24 9.09 -1.99 -2.13 114.58 118.57 1tm9 h GLU 57 Ca -0.42 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 58.91 1tm9 h GLU 57 Cb 1.41 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.50 1tm9 h GLU 57 CO 0.48 0.39 -0.21 -0.91 0.05 0.00 0.00 179.01 178.81 1tm9 h ASN 58 N 0.00 0.34 0.28 3.06 4.21 -1.97 -2.01 115.58 119.49 1tm9 h ASN 58 Ca -0.00 -0.10 -0.01 0.00 1.21 0.00 0.00 56.30 57.40 1tm9 h ASN 58 Cb 0.69 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.81 1tm9 h ASN 58 CO 0.05 0.56 -0.13 1.56 -1.29 0.00 0.00 177.43 178.18 1tm9 h GLN 59 N 0.31 -0.36 -0.91 0.81 7.50 -1.71 -1.99 115.11 118.76 1tm9 h GLN 59 Ca 0.05 0.02 0.24 0.00 0.50 0.00 0.00 58.65 59.47 1tm9 h GLN 59 Cb 0.55 0.08 -0.13 0.00 0.05 0.00 0.00 27.48 28.03 1tm9 h GLN 59 CO 0.04 -0.07 0.38 1.96 -1.50 0.00 0.00 178.83 179.64 1tm9 h GLN 60 N -1.00 0.32 0.00 1.46 4.20 -1.37 0.98 115.11 119.69 1tm9 h GLN 60 Ca -0.04 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1tm9 h GLN 60 Cb 0.46 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1tm9 h GLN 60 CO 0.06 0.21 0.00 -0.89 -0.67 0.00 0.00 178.83 177.54 1tm9 n ILE 61 N -5.10 0.00 -0.06 2.54 5.41 -0.76 0.03 119.36 121.42 1tm9 n ILE 61 Ca 0.24 1.19 0.24 0.00 1.00 0.00 0.00 62.75 65.42 1tm9 n ILE 61 Cb 0.73 -2.15 0.58 0.00 -0.71 0.00 0.00 39.64 38.09 1tm9 n ILE 61 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 1tm9 h GLU 62 N 0.00 0.00 0.06 0.38 4.81 -0.85 1.34 114.58 120.32 1tm9 h GLU 62 Ca 0.00 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.03 1tm9 h GLU 62 Cb 0.00 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.40 1tm9 h GLU 62 CO 0.00 0.00 -0.80 0.82 -0.73 0.00 0.00 179.01 178.30 1tm9 h ILE 63 N 0.00 1.41 0.06 2.32 2.04 0.12 -2.29 117.51 121.18 1tm9 h ILE 63 Ca 0.34 -2.27 0.01 0.00 1.00 0.00 0.00 64.86 63.94 1tm9 h ILE 63 Cb 2.04 2.74 -0.03 0.00 -0.74 0.00 0.00 36.82 40.82 1tm9 h ILE 63 CO -0.00 0.66 -0.36 0.74 0.00 0.00 0.00 178.15 179.19 1tm9 h THR 64 N -0.06 0.00 -0.74 -0.27 2.02 0.57 0.86 112.91 115.28 1tm9 h THR 64 Ca -0.12 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.13 1tm9 h THR 64 Cb 1.53 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 1tm9 h THR 64 CO 0.16 0.00 0.49 0.07 0.37 0.00 0.00 175.52 176.60 1tm9 h LYS 65 N -0.50 0.77 -0.78 6.66 -0.00 -1.61 -0.16 116.57 120.95 1tm9 h LYS 65 Ca -0.00 -0.05 0.01 0.00 -0.00 0.00 0.00 60.65 60.61 1tm9 h LYS 65 Cb 0.51 -0.17 -0.04 0.00 -0.00 0.00 0.00 32.23 32.53 1tm9 h LYS 65 CO -0.20 0.51 0.52 0.82 -0.00 0.00 0.00 179.45 181.09 1tm9 h ILE 66 N 0.79 1.20 -0.79 0.07 2.04 -0.58 -1.47 117.51 118.77 1tm9 h ILE 66 Ca 0.32 -0.38 0.05 0.00 1.00 0.00 0.00 64.86 65.85 1tm9 h ILE 66 Cb 0.23 0.05 -0.05 0.00 -0.74 0.00 0.00 36.82 36.31 1tm9 h ILE 66 CO -0.11 0.20 0.49 0.00 0.00 0.00 0.00 178.15 178.73 1tm9 h ALA 67 N 1.28 1.06 -0.91 1.87 0.00 0.25 -0.50 119.26 122.32 1tm9 h ALA 67 Ca 0.29 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.20 1tm9 h ALA 67 Cb -0.12 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 1tm9 h ALA 67 CO -0.06 0.25 0.60 0.28 0.00 0.00 0.00 179.25 180.32 1tm9 h VAL 68 N 0.92 1.21 -0.25 0.00 2.07 -0.82 0.89 116.25 120.27 1tm9 h VAL 68 Ca 0.33 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.51 1tm9 h VAL 68 Cb 0.10 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 1tm9 h VAL 68 CO -0.15 0.22 0.52 -1.13 0.02 0.00 0.00 177.57 177.05 1tm9 h ASN 69 N 1.20 0.00 0.08 0.57 -1.24 -0.22 1.66 115.58 117.64 1tm9 h ASN 69 Ca 0.34 0.00 -0.37 0.00 0.71 0.00 0.00 56.30 56.98 1tm9 h ASN 69 Cb -0.10 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 38.92 1tm9 h ASN 69 CO -0.08 0.00 -2.12 0.59 -1.29 0.00 0.00 177.43 174.52 1tm9 n ASN 70 N -3.20 2.08 0.05 1.15 3.02 0.23 -3.28 115.26 115.32 1tm9 n ASN 70 Ca 0.04 0.12 -0.13 0.00 -0.03 0.00 0.00 54.58 54.58 1tm9 n ASN 70 Cb 0.63 -0.74 -0.09 0.00 -0.61 0.00 0.00 39.78 38.98 1tm9 n ASN 70 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1tm9 h ILE 71 N 0.01 1.07 -0.55 2.41 6.09 0.66 0.46 117.51 127.65 1tm9 h ILE 71 Ca -0.47 -0.74 0.07 0.00 -1.37 0.00 0.00 64.86 62.35 1tm9 h ILE 71 Cb 1.97 1.54 -0.06 0.00 0.47 0.00 0.00 36.82 40.74 1tm9 h ILE 71 CO 0.02 0.18 0.23 0.11 -3.07 0.00 0.00 178.15 175.62 1tm9 h LYS 72 N -0.49 0.43 -0.45 2.19 1.79 0.20 -0.79 116.57 119.45 1tm9 h LYS 72 Ca -0.01 -0.03 -0.09 0.00 -2.18 0.00 0.00 60.65 58.34 1tm9 h LYS 72 Cb 0.40 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 1tm9 h LYS 72 CO 0.02 0.28 -0.09 1.15 -1.08 0.00 0.00 179.45 179.74 1tm9 h THR 73 N 0.44 1.26 -0.99 -0.16 2.02 -1.52 -2.36 112.91 111.60 1tm9 h THR 73 Ca 0.26 -1.15 0.26 0.00 0.77 0.00 0.00 66.41 66.56 1tm9 h THR 73 Cb 0.26 1.01 -0.06 0.00 -1.74 0.00 0.00 68.15 67.61 1tm9 h THR 73 CO -0.24 0.40 0.67 -0.07 0.37 0.00 0.00 175.52 176.65 1tm9 h LEU 74 N 0.73 0.24 -5.73 2.58 3.38 0.14 -3.00 115.31 113.65 1tm9 h LEU 74 Ca 0.13 0.04 -0.37 0.00 0.09 0.00 0.00 57.88 57.76 1tm9 h LEU 74 Cb 0.57 -0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.34 1tm9 h LEU 74 CO 0.04 0.07 2.30 -1.20 0.09 0.00 0.00 178.44 179.73 1tm9 n SER 75 N -4.42 3.73 0.00 -0.43 7.64 -0.89 -1.95 113.62 117.29 1tm9 n SER 75 Ca 0.22 -2.34 0.00 0.00 1.01 0.00 0.00 58.87 57.76 1tm9 n SER 75 Cb 0.91 -1.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1tm9 n SER 75 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1tm9 n SER 76 N 4.97 0.00 -4.05 6.43 2.88 -1.13 -5.04 113.62 117.67 1tm9 n SER 76 Ca 0.39 0.00 -0.53 0.00 -1.33 0.00 0.00 58.87 57.40 1tm9 n SER 76 Cb 0.16 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.55 1tm9 n SER 76 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1tm9 n VAL 77 N -0.99 0.00 -4.24 2.46 0.31 -0.82 -4.41 118.33 110.64 1tm9 n VAL 77 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1tm9 n VAL 77 Cb 0.00 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 1tm9 n VAL 77 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tm9 n GLY 78 N 1.42 -1.03 0.10 2.92 0.00 -1.26 -2.55 105.19 104.80 1tm9 n GLY 78 Ca 0.18 -1.21 -0.18 0.00 0.00 0.00 0.00 46.02 44.81 1tm9 n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tm9 h ALA 79 N -0.24 0.20 -1.43 4.61 0.00 -2.00 -3.41 119.26 116.98 1tm9 h ALA 79 Ca 0.00 -1.03 -0.51 0.00 0.00 0.00 0.00 54.91 53.37 1tm9 h ALA 79 Cb 0.00 0.63 -0.41 0.00 0.00 0.00 0.00 17.79 18.01 1tm9 h ALA 79 CO 0.00 0.60 -0.90 0.25 0.00 0.00 0.00 179.25 179.21 1tm9 n THR 80 N -4.48 1.86 -3.45 0.00 -2.24 -1.26 -4.99 114.28 99.71 1tm9 n THR 80 Ca -0.26 -4.36 -0.26 0.00 -2.27 0.00 0.00 64.05 56.90 1tm9 n THR 80 Cb 0.59 -0.60 0.02 0.00 -2.10 0.00 0.00 70.33 68.24 1tm9 n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tm9 n GLY 81 N -0.29 -0.63 0.00 3.38 0.00 -1.06 -4.98 105.19 101.61 1tm9 n GLY 81 Ca 0.28 0.95 0.00 0.00 0.00 0.00 0.00 46.02 47.25 1tm9 n GLY 81 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tm9 n GLN 82 N -1.08 0.00 -4.74 1.61 6.02 -1.25 -5.01 117.38 112.93 1tm9 n GLN 82 Ca -0.12 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.54 1tm9 n GLN 82 Cb 0.64 -0.02 -0.13 0.00 1.02 0.00 0.00 30.24 31.74 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1tm9 s TYR 83 N 0.00 2.82 -0.12 1.08 2.02 -1.26 -4.95 117.35 116.94 1tm9 s TYR 83 Ca 0.00 -0.34 0.19 0.00 -0.37 0.00 0.00 57.07 56.55 1tm9 s TYR 83 Cb 0.00 -1.77 0.38 0.00 -0.40 0.00 0.00 41.96 40.17 1tm9 s TYR 83 CO 0.00 0.02 1.59 1.98 -1.57 0.00 0.00 175.55 177.58 1tm9 h MET 84 N 6.04 0.00 -0.68 -0.62 1.85 -1.94 -3.19 114.93 116.39 1tm9 h MET 84 Ca -0.37 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.71 1tm9 h MET 84 Cb 1.18 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.18 1tm9 h MET 84 CO 0.54 0.33 0.38 0.00 -0.40 0.00 0.00 176.91 177.76 1tm9 h ALA 85 N 1.67 0.87 -1.51 0.39 0.00 -1.96 -2.07 119.26 116.65 1tm9 h ALA 85 Ca -0.00 -0.10 0.46 0.00 0.00 0.00 0.00 54.91 55.26 1tm9 h ALA 85 Cb 1.12 -0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.55 1tm9 h ALA 85 CO 0.04 0.37 1.06 0.45 0.00 0.00 0.00 179.25 181.17 1tm9 n SER 86 N -4.53 0.05 0.00 0.00 2.88 -1.20 -3.83 113.62 107.00 1tm9 n SER 86 Ca 0.05 0.94 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 1tm9 n SER 86 Cb 0.08 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.07 1tm9 n SER 86 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1tm9 n PHE 87 N -3.85 0.00 0.00 0.66 7.35 -0.78 -4.63 117.46 116.22 1tm9 n PHE 87 Ca 0.36 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.05 1tm9 n PHE 87 Cb 1.58 0.00 0.00 0.00 0.35 0.00 0.00 39.48 41.41 1tm9 n PHE 87 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1tm9 n PHE 88 N 0.00 0.00 -0.31 -5.13 3.01 -1.25 -2.75 117.46 111.03 1tm9 n PHE 88 Ca 0.00 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.63 1tm9 n PHE 88 Cb 0.00 0.00 0.33 0.00 -0.01 0.00 0.00 39.48 39.80 1tm9 n PHE 88 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1tm9 n SER 89 N 1.20 -0.02 -0.05 4.37 2.88 -1.26 0.19 113.62 120.93 1tm9 n SER 89 Ca 0.00 1.55 -0.10 0.00 -1.33 0.00 0.00 58.87 58.99 1tm9 n SER 89 Cb 0.00 -0.60 -0.04 0.00 -0.75 0.00 0.00 64.21 62.82 1tm9 n SER 89 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1tm9 h THR 90 N 0.00 1.11 -3.09 2.46 1.35 -1.77 -3.38 112.91 109.58 1tm9 h THR 90 Ca 0.60 -0.29 -0.58 0.00 -0.55 0.00 0.00 66.41 65.59 1tm9 h THR 90 Cb 1.34 0.93 -0.40 0.00 -1.73 0.00 0.00 68.15 68.28 1tm9 h THR 90 CO -0.83 0.11 -0.76 0.21 -0.25 0.00 0.00 175.52 174.00 1tm9 s ASN 91 N -5.49 3.93 0.01 5.36 3.84 0.51 -4.97 114.94 118.13 1tm9 s ASN 91 Ca -0.13 -1.67 -0.11 0.00 0.21 0.00 0.00 52.86 51.15 1tm9 s ASN 91 Cb 0.08 -0.81 -0.32 0.00 -0.55 0.00 0.00 41.25 39.65 1tm9 s ASN 91 CO 0.70 -0.41 0.91 -1.28 -2.79 0.00 0.00 177.10 174.24 1tm9 h SER 92 N 8.02 0.68 -0.91 -4.21 0.87 -1.49 -3.04 113.55 113.47 1tm9 h SER 92 Ca -0.13 -0.81 0.16 0.00 -1.23 0.00 0.00 61.79 59.78 1tm9 h SER 92 Cb 1.01 -0.22 -0.16 0.00 -0.44 0.00 0.00 62.40 62.59 1tm9 h SER 92 CO 0.46 1.65 -0.30 -0.62 -0.53 0.00 0.00 176.83 177.50 1tm9 n GLU 93 N -3.63 -0.16 -0.04 2.24 -0.58 -1.26 0.19 120.64 117.41 1tm9 n GLU 93 Ca -0.18 1.41 -0.13 0.00 -0.42 0.00 0.00 57.16 57.84 1tm9 n GLU 93 Cb 1.08 -2.09 -0.11 0.00 -0.57 0.00 0.00 31.44 29.74 1tm9 n GLU 93 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1tm9 h PRO 94 N 0.00 -0.01 -0.40 3.49 0.13 -1.95 -2.81 132.00 130.46 1tm9 h PRO 94 Ca 0.37 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.61 1tm9 h PRO 94 Cb 0.60 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.71 1tm9 h PRO 94 CO -0.92 0.73 0.51 0.00 -0.23 0.00 0.00 178.00 178.10 1tm9 h ALA 95 N 0.23 2.07 0.18 -0.56 0.00 -0.86 0.70 119.26 121.02 1tm9 h ALA 95 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1tm9 h ALA 95 Cb 0.74 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1tm9 h ALA 95 CO 0.00 -0.72 -0.09 0.82 0.00 0.00 0.00 179.25 179.27 1tm9 h ILE 96 N 0.00 0.26 -0.90 0.00 2.04 0.22 -0.51 117.51 118.61 1tm9 h ILE 96 Ca 0.19 -0.96 0.07 0.00 1.00 0.00 0.00 64.86 65.16 1tm9 h ILE 96 Cb 1.21 0.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.68 1tm9 h ILE 96 CO -0.00 0.08 0.56 0.40 0.00 0.00 0.00 178.15 179.19 1tm9 h ILE 97 N -1.03 1.04 0.82 -0.67 5.03 -0.78 -1.45 117.51 120.46 1tm9 h ILE 97 Ca -0.02 -0.35 -0.04 0.00 -0.12 0.00 0.00 64.86 64.33 1tm9 h ILE 97 Cb 0.31 -0.06 0.01 0.00 -3.03 0.00 0.00 36.82 34.05 1tm9 h ILE 97 CO 0.04 0.18 -0.39 -0.26 -0.68 0.00 0.00 178.15 177.04 1tm9 h PHE 98 N 1.01 -1.02 -0.87 1.37 0.04 0.24 -2.20 116.94 115.51 1tm9 h PHE 98 Ca 0.40 -0.02 0.11 0.00 2.80 0.00 0.00 57.97 61.25 1tm9 h PHE 98 Cb 0.20 0.34 -0.13 0.00 2.20 0.00 0.00 35.95 38.56 1tm9 h PHE 98 CO -0.02 -0.63 -0.49 0.00 -0.60 0.00 0.00 178.31 176.56 1tm9 h VAL 100 N -0.08 0.33 -0.41 0.00 2.07 -1.23 1.65 116.25 118.58 1tm9 h VAL 100 Ca 0.22 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.61 1tm9 h VAL 100 Cb 0.52 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1tm9 h VAL 100 CO -0.88 0.04 0.02 0.40 0.02 0.00 0.00 177.57 177.17 1tm9 h ILE 101 N 0.21 1.26 0.53 4.57 1.08 0.25 -1.95 117.51 123.45 1tm9 h ILE 101 Ca 0.53 -0.98 -0.03 0.00 -0.39 0.00 0.00 64.86 64.00 1tm9 h ILE 101 Cb 1.04 1.07 0.01 0.00 -3.07 0.00 0.00 36.82 35.87 1tm9 h ILE 101 CO -0.64 0.33 -0.25 1.88 -0.69 0.00 0.00 178.15 178.78 1tm9 h TYR 102 N 0.56 -0.66 -1.02 1.37 -1.99 0.65 -0.83 116.97 115.06 1tm9 h TYR 102 Ca 0.12 -0.02 0.25 0.00 2.00 0.00 0.00 58.73 61.09 1tm9 h TYR 102 Cb 0.45 0.22 -0.11 0.00 2.00 0.00 0.00 36.73 39.28 1tm9 h TYR 102 CO 0.03 -0.34 0.62 0.35 -0.00 0.00 0.00 178.16 178.83 1tm9 h PHE 103 N -0.92 0.90 0.00 4.88 3.04 0.21 0.21 116.94 125.26 1tm9 h PHE 103 Ca -0.07 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.91 1tm9 h PHE 103 Cb 0.62 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.87 1tm9 h PHE 103 CO -0.00 0.07 0.00 1.28 -2.02 0.00 0.00 178.31 177.64 1tm9 n LEU 104 N -4.80 0.66 -0.27 0.59 4.77 -0.74 -2.39 117.00 114.82 1tm9 n LEU 104 Ca 0.26 0.53 0.24 0.00 -0.03 0.00 0.00 56.01 57.02 1tm9 n LEU 104 Cb 0.79 -0.25 0.45 0.00 -2.33 0.00 0.00 43.42 42.08 1tm9 n LEU 104 CO 0.19 -0.25 0.84 -1.22 -1.33 0.00 0.00 177.39 175.63 1tm9 n TYR 105 N -1.24 0.89 0.03 -1.77 4.01 -0.33 0.22 117.16 118.96 1tm9 n TYR 105 Ca 0.00 0.98 -0.10 0.00 -0.16 0.00 0.00 57.90 58.61 1tm9 n TYR 105 Cb 0.00 -1.35 -0.04 0.00 -0.31 0.00 0.00 39.34 37.64 1tm9 n TYR 105 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1tm9 h HIS 106 N 0.00 -0.27 0.00 -0.72 3.86 -0.62 -3.41 115.15 113.99 1tm9 h HIS 106 Ca 0.67 0.01 -0.13 0.00 -1.16 0.00 0.00 60.37 59.76 1tm9 h HIS 106 Cb 1.72 0.13 -0.13 0.00 1.06 0.00 0.00 27.41 30.19 1tm9 h HIS 106 CO -0.07 -0.16 -0.19 1.97 0.86 0.00 0.00 177.93 180.33 1tm9 n PHE 107 N -5.24 -1.53 0.00 2.45 -1.74 0.57 -5.07 117.46 106.89 1tm9 n PHE 107 Ca -0.04 -1.15 0.00 0.00 -0.56 0.00 0.00 57.45 55.70 1tm9 n PHE 107 Cb 0.17 1.30 0.00 0.00 1.52 0.00 0.00 39.48 42.46 1tm9 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1tm9 n GLY 108 N 1.25 2.63 0.00 4.97 0.00 0.59 -4.82 105.19 109.80 1tm9 n GLY 108 Ca 0.03 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1tm9 n GLY 108 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1tm9 n PHE 109 N 0.00 0.00 -1.45 1.61 3.01 -1.26 -4.99 117.46 114.38 1tm9 n PHE 109 Ca 0.00 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.08 1tm9 n PHE 109 Cb 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 1tm9 n PHE 109 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1tm9 n LEU 110 N -1.84 0.36 -3.66 4.37 4.77 -1.26 -4.98 117.00 114.75 1tm9 n LEU 110 Ca 0.00 0.74 -0.15 0.00 -0.03 0.00 0.00 56.01 56.57 1tm9 n LEU 110 Cb 0.26 -1.14 -0.07 0.00 -2.33 0.00 0.00 43.42 40.13 1tm9 n LEU 110 CO 0.00 -3.19 0.19 -1.59 -1.33 0.00 0.00 177.39 171.47 1tm9 s LYS 111 N -1.96 0.84 -0.43 3.23 0.00 -1.26 -4.41 119.74 115.75 1tm9 s LYS 111 Ca 0.67 -0.05 0.08 0.00 0.00 0.00 0.00 55.97 56.68 1tm9 s LYS 111 Cb -0.46 0.38 0.27 0.00 0.00 0.00 0.00 37.83 38.03 1tm9 s LYS 111 CO 0.55 -0.25 0.75 -0.25 0.00 0.00 0.00 175.35 176.15 1tm9 n ASP 112 N 1.06 -1.01 -1.12 0.03 8.00 -1.26 -4.91 116.55 117.34 1tm9 n ASP 112 Ca -0.20 -3.07 0.07 0.00 0.71 0.00 0.00 54.79 52.30 1tm9 n ASP 112 Cb 0.57 0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 42.13 1tm9 n ASP 112 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1tm9 n ASN 113 N 1.16 -6.69 -3.04 -2.24 2.85 -1.26 -4.67 115.26 101.37 1tm9 n ASN 113 Ca 0.16 0.55 0.03 0.00 -0.11 0.00 0.00 54.58 55.21 1tm9 n ASN 113 Cb 0.60 -1.55 0.00 0.00 1.24 0.00 0.00 39.78 40.08 1tm9 n ASN 113 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1tm9 s ASN 114 N -5.08 -0.78 0.20 1.20 2.20 -1.26 -5.03 114.94 106.38 1tm9 s ASN 114 Ca 0.00 -0.13 0.00 0.00 -0.94 0.00 0.00 52.86 51.79 1tm9 s ASN 114 Cb 0.00 1.25 0.00 0.00 -2.00 0.00 0.00 41.25 40.50 1tm9 s ASN 114 CO 0.00 -0.12 0.00 1.17 -2.94 0.00 0.00 177.10 175.21 1tm9 n LYS 115 N 4.61 0.00 -2.22 3.55 0.00 -1.26 -5.15 118.16 117.68 1tm9 n LYS 115 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 58.31 58.33 1tm9 n LYS 115 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.61 1tm9 n LYS 115 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1tm9 n LYS 116 N -3.04 1.50 -1.73 1.64 5.02 -1.26 -5.07 118.16 115.23 1tm9 n LYS 116 Ca 0.00 -0.74 -0.42 0.00 -2.02 0.00 0.00 58.31 55.13 1tm9 n LYS 116 Cb 0.00 0.13 -0.03 0.00 -0.02 0.00 0.00 35.03 35.11 1tm9 n LYS 116 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1tm9 s GLN 117 N -2.43 4.13 0.00 1.97 -0.21 -1.26 -4.95 119.66 116.91 1tm9 s GLN 117 Ca 0.04 2.60 0.00 0.00 0.02 0.00 0.00 55.36 58.02 1tm9 s GLN 117 Cb -0.00 -3.23 0.00 0.00 1.00 0.00 0.00 33.01 30.77 1tm9 s GLN 117 CO 0.02 -0.78 0.00 1.51 -2.12 0.00 0.00 175.29 173.93 1tm9 n ILE 118 N 4.21 0.00 0.00 1.08 0.13 -1.26 -5.02 119.36 118.50 1tm9 n ILE 118 Ca 0.16 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.81 1tm9 n ILE 118 Cb 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.16 1tm9 n ILE 118 CO 0.00 0.00 0.00 -0.38 2.80 0.00 0.00 176.55 178.97 1tm9 n ILE 119 N 0.00 0.00 -0.50 9.51 2.08 -1.26 -0.91 119.36 128.28 1tm9 n ILE 119 Ca 0.00 1.07 0.40 0.00 0.56 0.00 0.00 62.75 64.78 1tm9 n ILE 119 Cb 0.00 -1.98 0.64 0.00 -0.75 0.00 0.00 39.64 37.55 1tm9 n ILE 119 CO 0.00 0.00 0.00 2.29 0.56 0.00 0.00 176.55 179.40 1tm9 n LYS 120 N -1.43 -0.02 0.24 0.38 2.85 -1.26 0.11 118.16 119.04 1tm9 n LYS 120 Ca 0.00 1.02 -0.10 0.00 -1.05 0.00 0.00 58.31 58.18 1tm9 n LYS 120 Cb 0.00 -2.15 -0.05 0.00 -0.65 0.00 0.00 35.03 32.19 1tm9 n LYS 120 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 1tm9 h LYS 121 N 0.00 -0.63 0.40 -1.58 1.63 -1.89 -2.45 116.57 112.05 1tm9 h LYS 121 Ca 0.78 0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 60.62 1tm9 h LYS 121 Cb 2.81 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 34.57 1tm9 h LYS 121 CO -0.23 -0.42 -0.44 0.00 -3.45 0.00 0.00 179.45 174.91 1tm9 h ALA 122 N -1.45 -1.08 -0.82 5.00 0.00 0.28 0.25 119.26 121.43 1tm9 h ALA 122 Ca -0.07 -0.16 0.28 0.00 0.00 0.00 0.00 54.91 54.96 1tm9 h ALA 122 Cb 0.50 0.68 -0.15 0.00 0.00 0.00 0.00 17.79 18.82 1tm9 h ALA 122 CO 0.11 -1.12 0.19 0.66 0.00 0.00 0.00 179.25 179.09 1tm9 n TYR 123 N -5.06 0.71 -0.02 0.00 4.02 0.10 0.22 117.16 117.13 1tm9 n TYR 123 Ca -0.10 0.98 -0.16 0.00 -0.01 0.00 0.00 57.90 58.61 1tm9 n TYR 123 Cb 0.39 -1.23 -0.09 0.00 -0.02 0.00 0.00 39.34 38.40 1tm9 n TYR 123 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1tm9 h GLU 124 N 0.00 0.57 -1.45 -0.72 4.39 -0.83 -1.83 114.58 114.71 1tm9 h GLU 124 Ca 0.58 -0.48 0.42 0.00 0.34 0.00 0.00 59.36 60.23 1tm9 h GLU 124 Cb 1.37 0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 30.07 1tm9 h GLU 124 CO -0.72 1.10 1.10 0.00 -1.16 0.00 0.00 179.01 179.33 1tm9 h THR 125 N 0.19 0.21 0.00 1.13 1.03 0.61 0.69 112.91 116.77 1tm9 h THR 125 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.36 1tm9 h THR 125 Cb 1.22 0.22 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 1tm9 h THR 125 CO 0.12 0.00 -0.44 -0.38 -0.01 0.00 0.00 175.52 174.81 1tm9 n ILE 126 N -3.97 0.94 -0.70 0.00 5.41 -0.81 -2.04 119.36 118.20 1tm9 n ILE 126 Ca 0.32 0.30 0.53 0.00 1.00 0.00 0.00 62.75 64.90 1tm9 n ILE 126 Cb 1.55 -2.07 0.81 0.00 -0.71 0.00 0.00 39.64 39.22 1tm9 n ILE 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1tm9 h ALA 127 N -1.35 3.86 0.00 -1.39 0.00 -0.53 1.67 119.26 121.52 1tm9 h ALA 127 Ca 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1tm9 h ALA 127 Cb 0.44 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1tm9 h ALA 127 CO 0.00 -2.44 -0.52 0.22 0.00 0.00 0.00 179.25 176.51 1tm9 h ASP 128 N 0.00 0.00 -0.75 0.00 3.58 0.19 -3.28 116.42 116.16 1tm9 h ASP 128 Ca 0.93 -0.11 0.17 0.00 0.42 0.00 0.00 57.03 58.43 1tm9 h ASP 128 Cb 3.78 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 44.72 1tm9 h ASP 128 CO -0.01 0.83 0.17 0.78 -2.88 0.00 0.00 179.24 178.14 1tm9 h ASN 129 N -1.00 -0.01 -0.28 2.28 2.35 0.27 1.44 115.58 120.63 1tm9 h ASN 129 Ca -0.05 0.15 0.08 0.00 -0.55 0.00 0.00 56.30 55.93 1tm9 h ASN 129 Cb 0.56 0.21 -0.01 0.00 0.05 0.00 0.00 38.32 39.13 1tm9 h ASN 129 CO -0.03 -0.05 0.24 -0.29 -1.65 0.00 0.00 177.43 175.64 1tm9 h ILE 130 N 0.26 0.67 0.00 2.81 2.10 0.21 1.14 117.51 124.69 1tm9 h ILE 130 Ca 0.43 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.37 1tm9 h ILE 130 Cb 0.74 0.83 0.00 0.00 -1.09 0.00 0.00 36.82 37.29 1tm9 h ILE 130 CO -0.53 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 176.54 1tm9 n ALA 131 N -2.49 2.22 0.06 0.18 0.00 0.49 -2.00 120.51 118.97 1tm9 n ALA 131 Ca 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 53.44 53.35 1tm9 n ALA 131 Cb 0.39 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 1tm9 n ALA 131 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1tm9 h ASP 132 N 0.00 0.00 0.32 0.00 5.19 0.15 -2.31 116.42 119.78 1tm9 h ASP 132 Ca 0.00 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.26 1tm9 h ASP 132 Cb 0.10 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 1tm9 h ASP 132 CO 0.00 0.61 -1.82 -1.22 -3.12 0.00 0.00 179.24 173.69 1tm9 n TYR 133 N -3.02 0.41 0.04 4.55 4.01 -0.85 -4.52 117.16 117.79 1tm9 n TYR 133 Ca -0.06 0.13 -0.02 0.00 -0.16 0.00 0.00 57.90 57.79 1tm9 n TYR 133 Cb 0.83 -0.86 -0.01 0.00 -0.31 0.00 0.00 39.34 38.99 1tm9 n TYR 133 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1tm9 h LEU 134 N 0.00 -0.09 0.00 7.72 3.38 -1.53 -3.47 115.31 121.32 1tm9 h LEU 134 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1tm9 h LEU 134 Cb 1.52 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.29 1tm9 h LEU 134 CO 0.02 -0.05 0.00 0.59 0.09 0.00 0.00 178.44 179.09 1tm9 n ASN 135 N -2.34 -1.56 -2.07 -0.43 4.13 -1.23 -5.11 115.26 106.64 1tm9 n ASN 135 Ca -0.01 0.63 -0.02 0.00 1.68 0.00 0.00 54.58 56.85 1tm9 n ASN 135 Cb 0.04 1.61 0.00 0.00 -1.54 0.00 0.00 39.78 39.89 1tm9 n ASN 135 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1tm9 n GLU 136 N -3.44 -1.25 -0.61 3.52 2.13 -0.87 -4.93 120.64 115.19 1tm9 n GLU 136 Ca 0.00 1.33 0.00 0.00 0.66 0.00 0.00 57.16 59.15 1tm9 n GLU 136 Cb 0.00 -3.20 0.00 0.00 0.27 0.00 0.00 31.44 28.51 1tm9 n GLU 136 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01