#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 0.54 -0.21 2.12 2.13 -1.26 -5.10 120.64 118.85 1tm9 n GLU 2 Ca 0.00 -1.47 0.00 0.00 0.66 0.00 0.00 57.16 56.35 1tm9 n GLU 2 Cb 0.00 -1.06 0.00 0.00 0.27 0.00 0.00 31.44 30.65 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 1.91 0.00 -3.60 5.31 0.00 -1.26 -4.94 117.38 114.80 1tm9 n GLN 3 Ca 0.09 0.00 -0.11 0.00 -0.00 0.00 0.00 57.00 56.98 1tm9 n GLN 3 Cb 0.64 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.82 1tm9 n GLN 3 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 1tm9 s ASN 4 N 1.61 -0.43 0.00 1.69 -0.87 -1.26 -4.79 114.94 110.89 1tm9 s ASN 4 Ca 0.00 0.64 0.00 0.00 -1.57 0.00 0.00 52.86 51.93 1tm9 s ASN 4 Cb 0.00 0.58 0.00 0.00 -0.02 0.00 0.00 41.25 41.81 1tm9 s ASN 4 CO 0.00 -0.29 0.00 0.59 -2.57 0.00 0.00 177.10 174.83 1tm9 n ASN 5 N 1.38 0.00 -0.06 -1.22 3.02 -1.26 -4.07 115.26 113.05 1tm9 n ASN 5 Ca -0.12 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.42 1tm9 n ASN 5 Cb 0.57 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.72 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 0.00 -0.10 -0.31 2.41 -0.00 -1.26 0.82 119.36 120.92 1tm9 n ILE 6 Ca 0.00 1.38 -0.01 0.00 -0.00 0.00 0.00 62.75 64.12 1tm9 n ILE 6 Cb 0.00 -1.80 0.04 0.00 -0.00 0.00 0.00 39.64 37.87 1tm9 n ILE 6 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1tm9 n LYS 7 N -3.21 -0.19 -0.04 0.38 0.00 -1.26 0.17 118.16 114.02 1tm9 n LYS 7 Ca 0.00 1.26 -0.09 0.00 0.00 0.00 0.00 58.31 59.49 1tm9 n LYS 7 Cb 0.04 -1.88 -0.03 0.00 0.00 0.00 0.00 35.03 33.16 1tm9 n LYS 7 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1tm9 h GLU 8 N 0.00 0.06 -0.54 1.64 4.81 0.28 -2.06 114.58 118.78 1tm9 h GLU 8 Ca 0.29 -0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.60 1tm9 h GLU 8 Cb 0.49 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.79 1tm9 h GLU 8 CO -0.82 0.04 0.16 1.96 -0.73 0.00 0.00 179.01 179.63 1tm9 h GLN 9 N 0.07 0.31 -0.88 1.92 4.20 0.69 0.44 115.11 121.87 1tm9 h GLN 9 Ca 0.09 -0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.92 1tm9 h GLN 9 Cb 0.11 -0.07 -0.09 0.00 0.30 0.00 0.00 27.48 27.73 1tm9 h GLN 9 CO -0.15 0.21 0.48 -0.07 -0.67 0.00 0.00 178.83 178.63 1tm9 h LEU 10 N 0.32 0.62 0.54 1.46 3.38 0.57 -0.80 115.31 121.40 1tm9 h LEU 10 Ca 0.27 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.30 1tm9 h LEU 10 Cb 0.34 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1tm9 h LEU 10 CO -0.30 0.27 -0.26 0.40 0.09 0.00 0.00 178.44 178.64 1tm9 h ILE 11 N 0.70 0.00 -0.90 1.22 5.03 -0.31 -2.33 117.51 120.92 1tm9 h ILE 11 Ca 0.47 -0.06 0.21 0.00 -0.12 0.00 0.00 64.86 65.36 1tm9 h ILE 11 Cb 0.63 0.00 -0.17 0.00 -3.03 0.00 0.00 36.82 34.25 1tm9 h ILE 11 CO -0.34 0.00 -0.12 -0.24 -0.68 0.00 0.00 178.15 176.77 1tm9 n SER 12 N -4.12 -0.23 0.00 1.72 2.88 -0.42 0.23 113.62 113.68 1tm9 n SER 12 Ca -0.09 1.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.99 1tm9 n SER 12 Cb 0.29 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.24 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 -5.40 0.00 -0.46 0.66 3.72 -0.35 -1.62 117.46 114.00 1tm9 n PHE 13 Ca 0.17 0.00 0.42 0.00 -0.05 0.00 0.00 57.45 57.99 1tm9 n PHE 13 Cb 0.55 0.00 0.75 0.00 -0.94 0.00 0.00 39.48 39.85 1tm9 n PHE 13 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 1tm9 h PHE 14 N 0.00 0.00 -0.47 1.38 3.04 -1.14 1.93 116.94 121.68 1tm9 h PHE 14 Ca 0.00 0.00 0.01 0.00 3.98 0.00 0.00 57.97 61.96 1tm9 h PHE 14 Cb 0.00 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1tm9 h PHE 14 CO 0.00 0.00 0.31 -0.97 -2.02 0.00 0.00 178.31 175.63 1tm9 h ASN 15 N 0.00 0.54 0.44 0.41 -1.24 0.30 0.34 115.58 116.38 1tm9 h ASN 15 Ca 0.70 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.70 1tm9 h ASN 15 Cb 2.92 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 41.83 1tm9 h ASN 15 CO -0.01 0.39 0.00 0.00 -1.29 0.00 0.00 177.43 176.52 1tm9 n GLN 16 N -4.47 0.15 0.00 6.67 1.13 0.65 -4.03 117.38 117.49 1tm9 n GLN 16 Ca 0.04 0.15 0.00 0.00 -1.94 0.00 0.00 57.00 55.25 1tm9 n GLN 16 Cb 0.05 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.90 1tm9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1tm9 n ALA 17 N -1.37 0.00 -2.71 -1.58 0.00 0.11 -4.87 120.51 110.10 1tm9 n ALA 17 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.17 1tm9 n ALA 17 Cb 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.57 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 0.89 0.68 -3.61 0.00 3.41 -1.26 -4.38 113.62 109.35 1tm9 n SER 19 Ca -0.09 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.19 1tm9 n SER 19 Cb 0.52 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.49 1tm9 n SER 19 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1tm9 n THR 20 N -2.29 0.00 0.00 6.66 -2.24 -1.26 -4.84 114.28 110.31 1tm9 n THR 20 Ca 0.00 -0.43 -0.18 0.00 -2.27 0.00 0.00 64.05 61.17 1tm9 n THR 20 Cb 0.18 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.32 1tm9 n THR 20 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1tm9 h HIS 21 N -0.19 0.99 0.00 4.78 3.86 -2.05 -2.88 115.15 119.66 1tm9 h HIS 21 Ca -0.36 -0.48 0.00 0.00 -1.16 0.00 0.00 60.37 58.37 1tm9 h HIS 21 Cb 1.22 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.55 1tm9 h HIS 21 CO 0.19 1.31 0.00 1.04 0.86 0.00 0.00 177.93 181.34 1tm9 n GLN 22 N -3.96 0.94 -0.18 2.45 1.13 -1.26 -3.87 117.38 112.63 1tm9 n GLN 22 Ca -0.09 0.00 0.29 0.00 -1.94 0.00 0.00 57.00 55.26 1tm9 n GLN 22 Cb 0.78 -1.34 0.60 0.00 0.11 0.00 0.00 30.24 30.39 1tm9 n GLN 22 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 1tm9 h GLU 23 N 0.00 0.00 0.00 -1.09 -0.00 -1.83 1.57 114.58 113.23 1tm9 h GLU 23 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1tm9 h GLU 23 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1tm9 h GLU 23 CO 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 179.01 178.90 1tm9 h ARG 24 N 0.00 0.00 -0.12 1.06 -0.00 -1.83 -2.52 114.38 110.97 1tm9 h ARG 24 Ca 0.45 0.00 0.04 0.00 -0.50 0.00 0.00 59.98 59.96 1tm9 h ARG 24 Cb 2.37 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 32.33 1tm9 h ARG 24 CO -0.00 0.00 0.28 -0.07 0.00 0.00 0.00 179.97 180.18 1tm9 h LEU 25 N -0.55 0.00 0.00 3.04 3.38 -1.46 1.36 115.31 121.08 1tm9 h LEU 25 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1tm9 h LEU 25 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1tm9 h LEU 25 CO 0.00 0.00 -0.78 0.44 0.09 0.00 0.00 178.44 178.19 1tm9 h ASP 26 N 0.00 0.00 0.01 -0.43 5.19 0.21 -3.31 116.42 118.08 1tm9 h ASP 26 Ca 0.06 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.41 1tm9 h ASP 26 Cb 0.62 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1tm9 h ASP 26 CO -0.00 0.27 -0.22 2.19 -3.12 0.00 0.00 179.24 178.36 1tm9 h PHE 27 N 0.00 0.21 -0.82 4.55 -5.15 0.22 1.18 116.94 117.13 1tm9 h PHE 27 Ca -0.04 -0.12 0.22 0.00 -0.20 0.00 0.00 57.97 57.83 1tm9 h PHE 27 Cb 1.24 -0.02 -0.04 0.00 0.22 0.00 0.00 35.95 37.35 1tm9 h PHE 27 CO 0.00 0.94 0.57 -0.84 -2.00 0.00 0.00 178.31 176.98 1tm9 h ILE 28 N -0.59 0.64 0.00 0.88 3.07 -1.35 2.00 117.51 122.16 1tm9 h ILE 28 Ca -0.03 -0.05 -0.03 0.00 1.55 0.00 0.00 64.86 66.30 1tm9 h ILE 28 Cb 1.01 0.48 -0.00 0.00 -0.27 0.00 0.00 36.82 38.03 1tm9 h ILE 28 CO 0.04 0.03 -0.72 0.00 -1.05 0.00 0.00 178.15 176.45 1tm9 h SER 30 N -1.00 -0.63 0.14 0.00 0.02 0.18 2.28 113.55 114.53 1tm9 h SER 30 Ca -0.04 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1tm9 h SER 30 Cb 0.70 0.39 0.00 0.00 0.14 0.00 0.00 62.40 63.63 1tm9 h SER 30 CO -0.03 -0.21 0.00 0.41 -1.14 0.00 0.00 176.83 175.86 1tm9 n THR 31 N -5.41 1.40 -2.46 -2.27 -1.04 0.68 -1.42 114.28 103.75 1tm9 n THR 31 Ca 0.06 0.35 0.04 0.00 -2.04 0.00 0.00 64.05 62.45 1tm9 n THR 31 Cb 0.31 -1.27 0.04 0.00 -1.82 0.00 0.00 70.33 67.59 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 -1.42 0.30 -2.70 -2.82 3.00 0.60 -4.93 116.66 108.70 1tm9 n ARG 32 Ca 0.02 -2.25 -0.05 0.00 -0.00 0.00 0.00 57.85 55.57 1tm9 n ARG 32 Cb 0.05 -0.28 0.05 0.00 0.00 0.00 0.00 32.46 32.27 1tm9 n ARG 32 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1tm9 n GLU 33 N 0.27 0.29 0.00 -0.14 2.13 0.63 -4.89 120.64 118.93 1tm9 n GLU 33 Ca 0.07 -1.09 0.00 0.00 0.66 0.00 0.00 57.16 56.80 1tm9 n GLU 33 Cb 1.08 -0.52 0.00 0.00 0.27 0.00 0.00 31.44 32.27 1tm9 n GLU 33 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1tm9 n SER 34 N 2.06 0.00 0.04 4.31 2.88 -1.24 -4.47 113.62 117.20 1tm9 n SER 34 Ca 0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1tm9 n SER 34 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1tm9 n SER 34 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1tm9 n ASP 35 N 0.00 -0.74 -0.63 -3.46 -0.08 -1.26 -5.14 116.55 105.24 1tm9 n ASP 35 Ca 0.00 0.29 0.00 0.00 -1.51 0.00 0.00 54.79 53.57 1tm9 n ASP 35 Cb 0.00 0.92 0.00 0.00 2.34 0.00 0.00 41.12 44.38 1tm9 n ASP 35 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1tm9 n THR 36 N -2.62 0.00 -0.04 5.18 5.66 -1.26 -5.06 114.28 116.14 1tm9 n THR 36 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 1tm9 n THR 36 Cb 0.00 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.62 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 0.00 0.06 1.36 1.09 3.72 -1.26 -4.09 117.46 118.34 1tm9 n PHE 37 Ca 0.00 0.02 0.08 0.00 -0.05 0.00 0.00 57.45 57.50 1tm9 n PHE 37 Cb 0.00 -0.70 0.33 0.00 -0.94 0.00 0.00 39.48 38.17 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 -2.45 1.26 -0.10 4.37 2.88 -1.26 -3.49 113.62 114.83 1tm9 n SER 38 Ca -0.14 -1.74 -0.11 0.00 -1.33 0.00 0.00 58.87 55.55 1tm9 n SER 38 Cb 0.77 -0.11 -0.13 0.00 -0.75 0.00 0.00 64.21 64.00 1tm9 n SER 38 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1tm9 n SER 39 N 0.09 1.04 -4.13 -3.46 7.64 -1.26 -4.95 113.62 108.58 1tm9 n SER 39 Ca 0.13 -0.04 -0.36 0.00 1.01 0.00 0.00 58.87 59.62 1tm9 n SER 39 Cb 0.24 0.55 0.08 0.00 -1.01 0.00 0.00 64.21 64.07 1tm9 n SER 39 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1tm9 n VAL 40 N -2.83 0.00 -1.46 0.44 0.31 -1.23 -4.69 118.33 108.88 1tm9 n VAL 40 Ca -0.33 -0.24 -0.40 0.00 -0.01 0.00 0.00 64.34 63.36 1tm9 n VAL 40 Cb 1.04 -0.24 -0.02 0.00 -0.91 0.00 0.00 33.84 33.72 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 1.55 6.94 -3.65 4.52 -0.08 -1.26 -4.72 116.55 119.85 1tm9 n ASP 41 Ca 0.00 -2.67 -0.01 0.00 -1.51 0.00 0.00 54.79 50.60 1tm9 n ASP 41 Cb 0.64 -1.59 -0.06 0.00 2.34 0.00 0.00 41.12 42.44 1tm9 n ASP 41 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1tm9 s VAL 42 N 2.56 0.00 0.34 5.18 0.11 -1.26 -4.68 120.40 122.65 1tm9 s VAL 42 Ca 0.61 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.40 1tm9 s VAL 42 Cb 0.16 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.92 1tm9 s VAL 42 CO -0.07 0.00 1.07 -2.16 -3.33 0.00 0.00 175.10 170.61 1tm9 s PRO 43 N 0.88 4.40 0.20 1.54 0.04 -1.26 -4.81 135.00 135.99 1tm9 s PRO 43 Ca -0.05 1.64 0.25 0.00 0.04 0.00 0.00 61.00 62.89 1tm9 s PRO 43 Cb -0.03 -2.86 0.67 0.00 0.04 0.00 0.00 34.50 32.31 1tm9 s PRO 43 CO -0.12 0.04 1.65 -0.07 0.04 0.00 0.00 177.00 178.54 1tm9 h LEU 44 N 3.15 0.00 0.74 -3.56 3.38 -1.92 -2.92 115.31 114.18 1tm9 h LEU 44 Ca -0.47 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 1tm9 h LEU 44 Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1tm9 h LEU 44 CO 0.65 0.03 -0.45 -0.33 0.09 0.00 0.00 178.44 178.42 1tm9 h GLU 45 N 0.00 -1.08 -0.04 1.13 5.08 -1.99 0.16 114.58 117.85 1tm9 h GLU 45 Ca 0.00 0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.28 1tm9 h GLU 45 Cb 0.76 0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.26 1tm9 h GLU 45 CO 0.00 -0.72 -0.59 -1.00 -1.00 0.00 0.00 179.01 175.70 1tm9 h PRO 46 N -1.12 0.47 -0.97 2.33 0.13 -1.90 -3.22 132.00 127.73 1tm9 h PRO 46 Ca -0.10 -0.45 0.18 0.00 -0.87 0.00 0.00 66.00 64.76 1tm9 h PRO 46 Cb 0.89 0.12 -0.10 0.00 0.13 0.00 0.00 31.00 32.04 1tm9 h PRO 46 CO 0.10 1.10 0.57 0.82 -0.23 0.00 0.00 178.00 180.36 1tm9 h ILE 47 N 0.00 0.71 0.00 -3.56 1.08 -1.54 1.57 117.51 115.77 1tm9 h ILE 47 Ca -0.06 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.16 1tm9 h ILE 47 Cb 1.27 -0.09 0.00 0.00 -3.07 0.00 0.00 36.82 34.94 1tm9 h ILE 47 CO 0.12 0.13 0.01 0.11 -0.69 0.00 0.00 178.15 177.83 1tm9 h LYS 48 N 0.73 0.00 0.06 2.37 1.57 -0.68 0.72 116.57 121.33 1tm9 h LYS 48 Ca 0.55 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 59.02 1tm9 h LYS 48 Cb 0.84 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.12 1tm9 h LYS 48 CO -0.38 0.00 -1.71 -0.97 -0.57 0.00 0.00 179.45 175.82 1tm9 h ASN 49 N 0.00 0.19 1.14 0.86 -1.24 0.22 -3.27 115.58 113.47 1tm9 h ASN 49 Ca 0.00 -0.37 0.00 0.00 0.71 0.00 0.00 56.30 56.64 1tm9 h ASN 49 Cb 0.02 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.00 1tm9 h ASN 49 CO 0.00 1.33 -0.33 2.30 -1.29 0.00 0.00 177.43 179.43 1tm9 n ILE 50 N -3.26 0.46 0.18 2.57 -5.35 0.67 -3.20 119.36 111.42 1tm9 n ILE 50 Ca -0.20 -0.27 0.07 0.00 -0.27 0.00 0.00 62.75 62.07 1tm9 n ILE 50 Cb 1.04 -0.33 0.12 0.00 -1.74 0.00 0.00 39.64 38.73 1tm9 n ILE 50 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1tm9 h ILE 51 N 0.00 0.52 0.00 7.28 2.04 0.17 -3.03 117.51 124.49 1tm9 h ILE 51 Ca 0.00 -1.67 0.00 0.00 1.00 0.00 0.00 64.86 64.19 1tm9 h ILE 51 Cb 0.74 2.20 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 1tm9 h ILE 51 CO 0.00 0.29 0.00 1.05 0.00 0.00 0.00 178.15 179.49 1tm9 h GLU 52 N 0.00 0.00 -0.81 2.37 4.11 -1.60 -2.43 114.58 116.22 1tm9 h GLU 52 Ca -0.00 0.00 0.23 0.00 0.07 0.00 0.00 59.36 59.66 1tm9 h GLU 52 Cb 1.18 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 1tm9 h GLU 52 CO 0.04 0.00 0.63 0.97 0.07 0.00 0.00 179.01 180.71 1tm9 h ILE 53 N 0.00 0.50 -0.53 -1.06 6.09 -1.71 1.52 117.51 122.32 1tm9 h ILE 53 Ca 0.00 0.00 -0.13 0.00 -1.37 0.00 0.00 64.86 63.36 1tm9 h ILE 53 Cb 0.30 0.55 -0.08 0.00 0.47 0.00 0.00 36.82 38.07 1tm9 h ILE 53 CO 0.00 0.00 0.12 0.35 -3.07 0.00 0.00 178.15 175.55 1tm9 n THR 54 N -4.12 2.68 0.35 2.19 -2.24 -0.92 -4.61 114.28 107.61 1tm9 n THR 54 Ca 0.16 -1.86 -0.18 0.00 -2.27 0.00 0.00 64.05 59.91 1tm9 n THR 54 Cb 0.92 -0.32 -0.09 0.00 -2.10 0.00 0.00 70.33 68.74 1tm9 n THR 54 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1tm9 h LYS 55 N 2.28 -0.90 -7.20 -0.78 2.10 0.20 -3.42 116.57 108.86 1tm9 h LYS 55 Ca 0.16 0.06 -0.48 0.00 -2.00 0.00 0.00 60.65 58.39 1tm9 h LYS 55 Cb 1.95 0.20 0.03 0.00 -0.90 0.00 0.00 32.23 33.52 1tm9 h LYS 55 CO 0.52 -0.60 0.38 -0.51 -2.00 0.00 0.00 179.45 177.24 1tm9 s ASP 56 N -4.39 6.32 0.32 7.07 1.11 -1.26 -4.96 116.67 120.88 1tm9 s ASP 56 Ca -0.18 1.65 0.06 0.00 0.18 0.00 0.00 52.55 54.26 1tm9 s ASP 56 Cb 0.04 -2.52 0.53 0.00 1.07 0.00 0.00 42.92 42.04 1tm9 s ASP 56 CO 0.62 -0.79 1.76 1.05 1.18 0.00 0.00 175.17 178.99 1tm9 h GLU 57 N 0.72 0.30 -0.41 8.23 4.11 -1.97 -2.29 114.58 123.26 1tm9 h GLU 57 Ca -0.47 -0.11 0.04 0.00 0.07 0.00 0.00 59.36 58.89 1tm9 h GLU 57 Cb 1.20 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1tm9 h GLU 57 CO 0.60 0.57 0.28 -0.91 0.07 0.00 0.00 179.01 179.62 1tm9 h ASN 58 N 0.27 0.35 0.43 3.06 4.21 -1.94 -2.33 115.58 119.63 1tm9 h ASN 58 Ca 0.04 -0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.52 1tm9 h ASN 58 Cb 0.66 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.78 1tm9 h ASN 58 CO 0.05 0.24 -0.21 1.56 -1.29 0.00 0.00 177.43 177.78 1tm9 h GLN 59 N 0.40 -0.56 -0.85 0.81 1.08 -1.69 -2.50 115.11 111.80 1tm9 h GLN 59 Ca 0.17 0.04 0.20 0.00 -1.45 0.00 0.00 58.65 57.61 1tm9 h GLN 59 Cb 0.19 0.13 -0.16 0.00 -0.05 0.00 0.00 27.48 27.59 1tm9 h GLN 59 CO -0.04 -0.27 -0.07 1.96 -0.95 0.00 0.00 178.83 179.46 1tm9 h GLN 60 N -0.83 0.04 0.00 1.46 4.20 -1.39 0.32 115.11 118.92 1tm9 h GLN 60 Ca -0.06 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1tm9 h GLN 60 Cb 0.55 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1tm9 h GLN 60 CO 0.10 0.03 0.00 -0.89 -0.67 0.00 0.00 178.83 177.40 1tm9 n ILE 61 N -5.45 0.00 -0.36 2.54 5.41 -1.03 -1.41 119.36 119.06 1tm9 n ILE 61 Ca 0.16 1.27 -0.06 0.00 1.00 0.00 0.00 62.75 65.12 1tm9 n ILE 61 Cb 0.53 -2.18 -0.04 0.00 -0.71 0.00 0.00 39.64 37.24 1tm9 n ILE 61 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1tm9 n GLU 62 N -1.47 -0.32 -0.25 0.38 -0.58 -0.86 -0.28 120.64 117.25 1tm9 n GLU 62 Ca 0.00 1.35 -0.07 0.00 -0.42 0.00 0.00 57.16 58.02 1tm9 n GLU 62 Cb 0.00 -1.99 -0.06 0.00 -0.57 0.00 0.00 31.44 28.82 1tm9 n GLU 62 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1tm9 h ILE 63 N 0.00 0.00 -1.02 -3.67 2.04 -0.33 1.40 117.51 115.94 1tm9 h ILE 63 Ca 0.20 0.00 0.36 0.00 1.00 0.00 0.00 64.86 66.42 1tm9 h ILE 63 Cb 0.43 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.40 1tm9 h ILE 63 CO -0.85 0.00 0.65 1.07 0.00 0.00 0.00 178.15 179.02 1tm9 n THR 64 N -4.37 -0.20 -0.02 -0.27 5.66 0.61 0.26 114.28 115.94 1tm9 n THR 64 Ca 0.01 1.39 -0.18 0.00 -3.05 0.00 0.00 64.05 62.21 1tm9 n THR 64 Cb 0.16 -2.27 -0.13 0.00 -1.55 0.00 0.00 70.33 66.54 1tm9 n THR 64 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 1tm9 h LYS 65 N 0.00 0.14 -0.37 1.09 6.56 0.18 -2.86 116.57 121.32 1tm9 h LYS 65 Ca 0.67 -0.24 0.11 0.00 -1.06 0.00 0.00 60.65 60.12 1tm9 h LYS 65 Cb 2.11 0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 33.85 1tm9 h LYS 65 CO -0.38 1.12 0.40 -0.84 -2.06 0.00 0.00 179.45 177.69 1tm9 h ILE 66 N -0.67 0.39 0.04 1.86 3.07 0.77 0.50 117.51 123.47 1tm9 h ILE 66 Ca -0.15 0.00 -0.06 0.00 1.55 0.00 0.00 64.86 66.20 1tm9 h ILE 66 Cb 1.39 0.68 0.01 0.00 -0.27 0.00 0.00 36.82 38.63 1tm9 h ILE 66 CO 0.03 0.00 -0.26 0.00 -1.05 0.00 0.00 178.15 176.87 1tm9 h ALA 67 N 1.54 -0.02 -0.19 0.16 0.00 0.13 -3.31 119.26 117.58 1tm9 h ALA 67 Ca 0.18 -0.55 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1tm9 h ALA 67 Cb 0.98 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1tm9 h ALA 67 CO -0.00 0.11 0.09 0.28 0.00 0.00 0.00 179.25 179.73 1tm9 h VAL 68 N -0.76 1.00 -0.96 0.00 2.07 -0.57 0.28 116.25 117.31 1tm9 h VAL 68 Ca -0.04 -0.07 0.35 0.00 0.82 0.00 0.00 66.70 67.76 1tm9 h VAL 68 Cb 1.17 0.78 -0.18 0.00 -1.52 0.00 0.00 31.29 31.55 1tm9 h VAL 68 CO 0.05 0.04 0.31 -3.20 0.02 0.00 0.00 177.57 174.79 1tm9 n ASN 69 N -5.01 0.15 -0.06 0.57 2.85 0.15 0.21 115.26 114.13 1tm9 n ASN 69 Ca -0.03 1.61 -0.05 0.00 -0.11 0.00 0.00 54.58 56.01 1tm9 n ASN 69 Cb 0.05 -0.70 -0.03 0.00 1.24 0.00 0.00 39.78 40.33 1tm9 n ASN 69 CO 0.00 0.00 0.00 -1.13 -2.11 0.00 0.00 177.26 174.02 1tm9 h ASN 70 N 0.00 0.00 -0.78 1.20 -1.24 -1.42 -3.25 115.58 110.09 1tm9 h ASN 70 Ca 0.72 -0.23 0.12 0.00 0.71 0.00 0.00 56.30 57.63 1tm9 h ASN 70 Cb 1.77 0.00 -0.13 0.00 0.73 0.00 0.00 38.32 40.68 1tm9 h ASN 70 CO -0.81 0.68 -0.38 0.40 -1.29 0.00 0.00 177.43 176.04 1tm9 h ILE 71 N -1.00 0.08 -0.89 2.57 1.08 0.18 1.19 117.51 120.71 1tm9 h ILE 71 Ca -0.02 0.00 0.23 0.00 -0.39 0.00 0.00 64.86 64.69 1tm9 h ILE 71 Cb 0.34 0.08 -0.13 0.00 -3.07 0.00 0.00 36.82 34.03 1tm9 h ILE 71 CO -0.01 0.00 0.33 0.11 -0.69 0.00 0.00 178.15 177.89 1tm9 h LYS 72 N -0.09 0.29 -0.17 2.37 1.79 0.24 1.14 116.57 122.13 1tm9 h LYS 72 Ca 0.28 -0.02 -0.10 0.00 -2.18 0.00 0.00 60.65 58.62 1tm9 h LYS 72 Cb 0.57 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.14 1tm9 h LYS 72 CO -0.83 0.19 -0.35 1.15 -1.08 0.00 0.00 179.45 178.54 1tm9 h THR 73 N 0.30 1.29 0.00 -0.16 2.02 0.12 -2.01 112.91 114.47 1tm9 h THR 73 Ca 0.57 -1.42 0.00 0.00 0.77 0.00 0.00 66.41 66.33 1tm9 h THR 73 Cb 1.13 1.54 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1tm9 h THR 73 CO -0.59 0.43 0.07 -0.07 0.37 0.00 0.00 175.52 175.73 1tm9 h LEU 74 N 0.31 0.00 -3.92 2.58 3.38 0.47 -2.33 115.31 115.79 1tm9 h LEU 74 Ca 0.04 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.70 1tm9 h LEU 74 Cb 0.76 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.40 1tm9 h LEU 74 CO 0.06 0.00 0.13 -1.20 0.09 0.00 0.00 178.44 177.52 1tm9 n SER 75 N -2.64 5.99 0.03 -0.43 7.64 -0.76 -4.19 113.62 119.25 1tm9 n SER 75 Ca -0.02 -2.87 0.00 0.00 1.01 0.00 0.00 58.87 56.99 1tm9 n SER 75 Cb 0.12 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 1tm9 n SER 75 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1tm9 n SER 76 N 1.27 -0.53 -3.30 6.43 7.64 -0.89 -5.09 113.62 119.16 1tm9 n SER 76 Ca 0.36 0.17 -0.17 0.00 1.01 0.00 0.00 58.87 60.25 1tm9 n SER 76 Cb 0.65 0.74 0.02 0.00 -1.01 0.00 0.00 64.21 64.60 1tm9 n SER 76 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1tm9 n VAL 77 N -2.29 -3.32 0.00 0.44 0.31 -1.17 -3.60 118.33 108.69 1tm9 n VAL 77 Ca 0.00 0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.71 1tm9 n VAL 77 Cb 0.00 -3.45 0.00 0.00 -0.91 0.00 0.00 33.84 29.48 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 0.63 0.92 2.10 2.92 0.00 -1.26 -4.28 105.19 106.23 1tm9 n GLY 78 Ca -0.03 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1tm9 n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tm9 n ALA 79 N 5.74 0.41 -3.45 4.61 0.00 -1.24 -5.16 120.51 121.43 1tm9 n ALA 79 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1tm9 n ALA 79 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1tm9 n ALA 79 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1tm9 s THR 80 N -1.48 0.00 -0.64 0.00 -1.32 -1.26 -5.00 115.64 105.94 1tm9 s THR 80 Ca 0.00 -0.18 -0.10 0.00 -1.21 0.00 0.00 61.69 60.20 1tm9 s THR 80 Cb 0.00 -1.15 0.01 0.00 -1.51 0.00 0.00 72.50 69.85 1tm9 s THR 80 CO 0.00 -0.02 0.65 0.61 -2.21 0.00 0.00 174.62 173.65 1tm9 n GLY 81 N -0.38 -1.06 2.78 6.08 0.00 -1.26 -5.00 105.19 106.34 1tm9 n GLY 81 Ca -0.15 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.67 1tm9 n GLY 81 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tm9 s GLN 82 N -3.30 0.25 0.42 1.61 -1.52 -1.26 -5.15 119.66 110.72 1tm9 s GLN 82 Ca 0.12 -0.13 -0.18 0.00 -1.95 0.00 0.00 55.36 53.22 1tm9 s GLN 82 Cb -0.02 0.02 -0.14 0.00 -0.22 0.00 0.00 33.01 32.64 1tm9 s GLN 82 CO 0.81 -0.35 -0.03 0.66 -0.25 0.00 0.00 175.29 176.13 1tm9 n TYR 83 N 3.48 -2.36 1.08 0.91 4.01 -1.26 -4.77 117.16 118.25 1tm9 n TYR 83 Ca 0.08 0.49 0.10 0.00 -0.16 0.00 0.00 57.90 58.41 1tm9 n TYR 83 Cb 0.63 -1.59 0.55 0.00 -0.31 0.00 0.00 39.34 38.62 1tm9 n TYR 83 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1tm9 n MET 84 N 1.32 0.41 -0.03 -0.72 2.81 -1.26 -2.85 117.12 116.80 1tm9 n MET 84 Ca 0.09 0.06 -0.16 0.00 -1.81 0.00 0.00 57.70 55.89 1tm9 n MET 84 Cb 0.41 -1.50 -0.09 0.00 -0.71 0.00 0.00 33.22 31.32 1tm9 n MET 84 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1tm9 h ALA 85 N 3.08 0.14 0.23 3.04 0.00 -1.97 -3.05 119.26 120.73 1tm9 h ALA 85 Ca 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1tm9 h ALA 85 Cb 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1tm9 h ALA 85 CO 0.00 0.26 -0.11 1.03 0.00 0.00 0.00 179.25 180.43 1tm9 h SER 86 N -0.08 -0.26 -0.87 0.00 0.87 -1.86 -2.42 113.55 108.93 1tm9 h SER 86 Ca -0.03 -0.02 0.23 0.00 -1.23 0.00 0.00 61.79 60.74 1tm9 h SER 86 Cb 1.06 0.07 -0.14 0.00 -0.44 0.00 0.00 62.40 62.95 1tm9 h SER 86 CO 0.08 -0.16 0.18 0.15 -0.53 0.00 0.00 176.83 176.56 1tm9 h PHE 87 N -0.34 0.26 0.00 2.24 3.57 -1.64 1.58 116.94 122.60 1tm9 h PHE 87 Ca -0.03 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1tm9 h PHE 87 Cb 0.26 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.02 1tm9 h PHE 87 CO -0.05 -0.23 -0.16 0.74 -2.23 0.00 0.00 178.31 176.37 1tm9 h PHE 88 N 0.17 0.00 0.02 0.41 0.04 -1.36 -2.44 116.94 113.79 1tm9 h PHE 88 Ca 0.53 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.30 1tm9 h PHE 88 Cb 1.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.22 1tm9 h PHE 88 CO -0.31 0.16 -0.01 1.03 -0.60 0.00 0.00 178.31 178.59 1tm9 h SER 89 N 0.00 -0.02 -0.79 2.17 0.87 0.26 -3.24 113.55 112.80 1tm9 h SER 89 Ca -0.00 -0.73 0.16 0.00 -1.23 0.00 0.00 61.79 59.99 1tm9 h SER 89 Cb 0.41 0.01 -0.10 0.00 -0.44 0.00 0.00 62.40 62.27 1tm9 h SER 89 CO 0.02 0.77 0.32 0.71 -0.53 0.00 0.00 176.83 178.12 1tm9 h THR 90 N -0.87 0.62 -3.65 2.23 1.35 -0.61 -3.31 112.91 108.68 1tm9 h THR 90 Ca -0.00 -0.15 -0.65 0.00 -0.55 0.00 0.00 66.41 65.05 1tm9 h THR 90 Cb 0.75 0.14 -0.40 0.00 -1.73 0.00 0.00 68.15 66.92 1tm9 h THR 90 CO 0.00 0.08 -0.73 0.20 -0.25 0.00 0.00 175.52 174.82 1tm9 s ASN 91 N -5.32 4.65 0.09 5.36 0.01 -0.94 -4.92 114.94 113.88 1tm9 s ASN 91 Ca -0.12 -2.03 0.25 0.00 -0.71 0.00 0.00 52.86 50.24 1tm9 s ASN 91 Cb 0.21 -1.54 0.48 0.00 0.41 0.00 0.00 41.25 40.82 1tm9 s ASN 91 CO 0.77 -0.37 1.42 -1.20 -1.51 0.00 0.00 177.10 176.21 1tm9 n SER 92 N 4.33 0.61 0.04 -1.22 7.64 -1.22 -2.81 113.62 120.99 1tm9 n SER 92 Ca 0.02 0.10 -0.13 0.00 1.01 0.00 0.00 58.87 59.87 1tm9 n SER 92 Cb 0.42 0.06 -0.09 0.00 -1.01 0.00 0.00 64.21 63.59 1tm9 n SER 92 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1tm9 h GLU 93 N 0.00 -0.13 -0.05 1.43 3.07 -1.91 -1.22 114.58 115.77 1tm9 h GLU 93 Ca 0.00 0.01 -0.25 0.00 -0.50 0.00 0.00 59.36 58.62 1tm9 h GLU 93 Cb 0.67 0.03 0.01 0.00 -0.84 0.00 0.00 28.75 28.63 1tm9 h GLU 93 CO 0.00 0.29 -0.94 -1.00 -1.40 0.00 0.00 179.01 175.96 1tm9 h PRO 94 N -0.58 0.69 -0.07 2.33 0.13 -1.95 -2.92 132.00 129.64 1tm9 h PRO 94 Ca -0.01 -0.67 -0.01 0.00 -0.87 0.00 0.00 66.00 64.43 1tm9 h PRO 94 Cb 0.47 0.17 -0.00 0.00 0.13 0.00 0.00 31.00 31.77 1tm9 h PRO 94 CO 0.02 1.27 -0.01 0.00 -0.23 0.00 0.00 178.00 179.05 1tm9 h ALA 95 N 0.51 1.86 0.47 -0.56 0.00 -1.60 -0.84 119.26 119.10 1tm9 h ALA 95 Ca -0.10 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1tm9 h ALA 95 Cb 1.58 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1tm9 h ALA 95 CO 0.18 0.11 -0.23 0.82 0.00 0.00 0.00 179.25 180.14 1tm9 h ILE 96 N 0.09 0.00 -0.66 0.00 2.04 -1.14 0.20 117.51 118.05 1tm9 h ILE 96 Ca 0.02 -0.28 0.13 0.00 1.00 0.00 0.00 64.86 65.74 1tm9 h ILE 96 Cb 0.09 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.04 1tm9 h ILE 96 CO 0.00 0.00 -0.21 0.40 0.00 0.00 0.00 178.15 178.35 1tm9 h ILE 97 N -0.91 0.29 0.00 -0.67 5.03 -1.32 1.33 117.51 121.26 1tm9 h ILE 97 Ca -0.06 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.66 1tm9 h ILE 97 Cb 0.48 0.29 -0.00 0.00 -3.03 0.00 0.00 36.82 34.56 1tm9 h ILE 97 CO 0.11 0.00 -0.10 0.15 -0.68 0.00 0.00 178.15 177.63 1tm9 h PHE 98 N -0.04 0.00 -0.85 1.37 3.57 -1.18 -1.96 116.94 117.85 1tm9 h PHE 98 Ca 0.31 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 1tm9 h PHE 98 Cb 0.51 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.21 1tm9 h PHE 98 CO -0.57 0.10 0.51 0.00 -2.23 0.00 0.00 178.31 176.12 1tm9 h VAL 100 N 1.18 1.33 0.04 0.00 2.07 -0.77 -2.84 116.25 117.26 1tm9 h VAL 100 Ca 0.31 -1.94 -0.00 0.00 0.82 0.00 0.00 66.70 65.88 1tm9 h VAL 100 Cb -0.04 1.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1tm9 h VAL 100 CO -0.06 0.60 -0.05 0.40 0.02 0.00 0.00 177.57 178.49 1tm9 h ILE 101 N 0.40 0.00 -0.79 4.57 1.08 -0.95 -1.80 117.51 120.02 1tm9 h ILE 101 Ca -0.01 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.61 1tm9 h ILE 101 Cb 1.22 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.82 1tm9 h ILE 101 CO 0.12 0.00 -0.19 0.10 -0.69 0.00 0.00 178.15 177.49 1tm9 h TYR 102 N -0.09 -0.41 -0.25 1.37 -0.00 -1.33 -1.60 116.97 114.65 1tm9 h TYR 102 Ca -0.00 0.07 0.03 0.00 0.00 0.00 0.00 58.73 58.82 1tm9 h TYR 102 Cb 0.08 0.30 -0.04 0.00 0.00 0.00 0.00 36.73 37.07 1tm9 h TYR 102 CO -0.12 -0.34 -0.24 0.35 -0.00 0.00 0.00 178.16 177.82 1tm9 h PHE 103 N 0.00 -0.75 -0.66 0.10 3.04 -1.24 1.41 116.94 118.85 1tm9 h PHE 103 Ca 0.38 0.04 0.09 0.00 3.98 0.00 0.00 57.97 62.46 1tm9 h PHE 103 Cb 0.58 0.36 -0.11 0.00 2.56 0.00 0.00 35.95 39.33 1tm9 h PHE 103 CO -0.62 -0.19 -0.45 -0.07 -2.02 0.00 0.00 178.31 174.96 1tm9 h LEU 104 N -0.12 -1.57 0.25 0.59 3.38 -0.43 1.67 115.31 119.08 1tm9 h LEU 104 Ca 0.04 0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 1tm9 h LEU 104 Cb 0.23 0.72 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1tm9 h LEU 104 CO -0.30 -0.32 -0.26 1.88 0.09 0.00 0.00 178.44 179.53 1tm9 h TYR 105 N -0.18 -0.72 -0.86 1.13 0.05 -0.62 1.82 116.97 117.59 1tm9 h TYR 105 Ca 0.19 0.01 0.21 0.00 0.05 0.00 0.00 58.73 59.19 1tm9 h TYR 105 Cb 0.55 0.28 -0.13 0.00 1.01 0.00 0.00 36.73 38.45 1tm9 h TYR 105 CO -0.76 -0.34 0.32 0.45 -1.05 0.00 0.00 178.16 176.78 1tm9 h HIS 106 N -0.51 0.52 -0.26 4.88 3.86 0.26 1.48 115.15 125.38 1tm9 h HIS 106 Ca -0.03 0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.14 1tm9 h HIS 106 Cb 0.44 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.77 1tm9 h HIS 106 CO -0.17 -0.09 0.11 1.19 0.86 0.00 0.00 177.93 179.83 1tm9 n PHE 107 N -5.10 0.86 -3.68 2.45 3.01 0.56 -4.90 117.46 110.65 1tm9 n PHE 107 Ca 0.21 -0.58 -0.29 0.00 1.01 0.00 0.00 57.45 57.79 1tm9 n PHE 107 Cb 0.63 -0.36 0.01 0.00 -0.01 0.00 0.00 39.48 39.75 1tm9 n PHE 107 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1tm9 n GLY 108 N 0.08 -0.80 1.52 1.37 0.00 0.51 -4.88 105.19 102.98 1tm9 n GLY 108 Ca 0.14 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.94 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 -1.81 0.00 -2.22 1.61 3.72 0.60 -4.95 117.46 114.41 1tm9 n PHE 109 Ca -0.25 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.74 1tm9 n PHE 109 Cb 0.68 0.36 -0.03 0.00 -0.94 0.00 0.00 39.48 39.56 1tm9 n PHE 109 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1tm9 s LEU 110 N -4.68 4.40 0.58 4.37 0.20 -1.16 -4.90 118.68 117.47 1tm9 s LEU 110 Ca 0.00 2.34 -0.15 0.00 0.69 0.00 0.00 54.13 57.01 1tm9 s LEU 110 Cb 0.00 -3.60 -0.05 0.00 -0.43 0.00 0.00 46.19 42.11 1tm9 s LEU 110 CO 0.00 -0.57 1.02 -0.54 -0.29 0.00 0.00 176.35 175.97 1tm9 s LYS 111 N 0.45 3.59 -0.29 1.98 1.02 -1.26 -4.67 119.74 120.55 1tm9 s LYS 111 Ca 0.60 0.99 -0.16 0.00 0.02 0.00 0.00 55.97 57.42 1tm9 s LYS 111 Cb -0.36 -2.08 0.16 0.00 -0.52 0.00 0.00 37.83 35.03 1tm9 s LYS 111 CO 0.34 -0.57 0.99 0.16 -0.92 0.00 0.00 175.35 175.36 1tm9 s ASP 112 N -3.27 -0.52 0.65 2.83 1.47 -1.26 -4.82 116.67 111.75 1tm9 s ASP 112 Ca 0.59 0.77 -0.06 0.00 1.18 0.00 0.00 52.55 55.03 1tm9 s ASP 112 Cb -0.12 1.39 0.04 0.00 -0.34 0.00 0.00 42.92 43.89 1tm9 s ASP 112 CO 0.40 -0.12 0.96 0.21 0.68 0.00 0.00 175.17 177.30 1tm9 s ASN 113 N 1.80 5.15 0.00 2.11 2.47 -1.26 -4.31 114.94 120.90 1tm9 s ASN 113 Ca -0.06 0.53 0.00 0.00 0.42 0.00 0.00 52.86 53.75 1tm9 s ASN 113 Cb -0.05 -1.33 0.00 0.00 -1.45 0.00 0.00 41.25 38.42 1tm9 s ASN 113 CO -0.16 -1.36 0.00 -3.20 -3.72 0.00 0.00 177.10 168.66 1tm9 n ASN 114 N -2.76 0.00 -2.63 -4.21 2.85 -1.26 -4.61 115.26 102.64 1tm9 n ASN 114 Ca 0.07 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.45 1tm9 n ASN 114 Cb 0.59 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.65 1tm9 n ASN 114 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1tm9 n LYS 115 N 0.00 -1.42 -3.65 1.20 4.81 -1.26 -5.05 118.16 112.79 1tm9 n LYS 115 Ca 0.00 0.61 -0.01 0.00 -0.87 0.00 0.00 58.31 58.05 1tm9 n LYS 115 Cb 0.00 -4.33 -0.06 0.00 0.02 0.00 0.00 35.03 30.65 1tm9 n LYS 115 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1tm9 s LYS 116 N -3.84 0.17 -0.29 1.64 2.20 -1.26 -4.94 119.74 113.43 1tm9 s LYS 116 Ca 0.28 0.28 -0.04 0.00 -0.36 0.00 0.00 55.97 56.13 1tm9 s LYS 116 Cb -0.04 0.05 0.04 0.00 -1.51 0.00 0.00 37.83 36.37 1tm9 s LYS 116 CO 0.48 -0.03 0.09 0.00 -0.36 0.00 0.00 175.35 175.53 1tm9 n GLN 117 N 2.96 -2.41 -0.24 4.03 10.64 -1.26 -4.85 117.38 126.25 1tm9 n GLN 117 Ca -0.16 0.02 0.00 0.00 -1.83 0.00 0.00 57.00 55.03 1tm9 n GLN 117 Cb 0.57 -3.98 0.00 0.00 -0.86 0.00 0.00 30.24 25.97 1tm9 n GLN 117 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.06 176.74 1tm9 n ILE 118 N -2.44 0.00 0.00 -0.39 3.06 -1.26 -4.63 119.36 113.69 1tm9 n ILE 118 Ca 0.02 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.27 1tm9 n ILE 118 Cb 0.43 -1.53 0.00 0.00 0.54 0.00 0.00 39.64 39.08 1tm9 n ILE 118 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 1tm9 n ILE 119 N -0.79 0.00 -0.53 9.51 2.08 -1.26 0.15 119.36 128.52 1tm9 n ILE 119 Ca 0.00 1.41 0.43 0.00 0.56 0.00 0.00 62.75 65.15 1tm9 n ILE 119 Cb 0.00 -2.22 0.71 0.00 -0.75 0.00 0.00 39.64 37.39 1tm9 n ILE 119 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 1tm9 h LYS 120 N 0.00 0.01 0.06 0.38 3.64 -1.98 1.61 116.57 120.28 1tm9 h LYS 120 Ca 0.00 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1tm9 h LYS 120 Cb 0.00 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1tm9 h LYS 120 CO 0.00 0.00 -0.03 -0.22 -2.27 0.00 0.00 179.45 176.94 1tm9 h LYS 121 N 0.01 -0.07 0.14 1.90 1.63 -1.44 -2.24 116.57 116.50 1tm9 h LYS 121 Ca 0.90 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.70 1tm9 h LYS 121 Cb 3.05 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 34.69 1tm9 h LYS 121 CO -0.36 0.43 -0.14 0.00 -3.45 0.00 0.00 179.45 175.93 1tm9 h ALA 122 N 0.25 -0.87 -0.97 5.00 0.00 1.15 0.57 119.26 124.40 1tm9 h ALA 122 Ca -0.01 -0.05 0.29 0.00 0.00 0.00 0.00 54.91 55.14 1tm9 h ALA 122 Cb 0.54 0.37 -0.18 0.00 0.00 0.00 0.00 17.79 18.53 1tm9 h ALA 122 CO 0.01 -0.87 0.16 1.88 0.00 0.00 0.00 179.25 180.43 1tm9 h TYR 123 N -0.28 0.18 -0.43 0.00 0.05 -0.89 1.62 116.97 117.22 1tm9 h TYR 123 Ca -0.02 0.06 -0.10 0.00 0.05 0.00 0.00 58.73 58.73 1tm9 h TYR 123 Cb 0.24 0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.04 1tm9 h TYR 123 CO -0.11 -0.40 -0.12 1.49 -1.05 0.00 0.00 178.16 177.97 1tm9 h GLU 124 N 0.04 0.78 -0.60 4.88 4.81 -0.91 0.23 114.58 123.82 1tm9 h GLU 124 Ca 0.64 -0.27 0.14 0.00 -0.13 0.00 0.00 59.36 59.74 1tm9 h GLU 124 Cb 1.40 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.69 1tm9 h GLU 124 CO -0.85 0.87 0.41 0.00 -0.73 0.00 0.00 179.01 178.72 1tm9 h THR 125 N 0.71 0.79 0.00 0.32 1.03 0.79 0.11 112.91 116.65 1tm9 h THR 125 Ca 0.12 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.45 1tm9 h THR 125 Cb 0.61 0.57 0.00 0.00 -1.07 0.00 0.00 68.15 68.26 1tm9 h THR 125 CO 0.04 0.04 -0.36 0.40 -0.01 0.00 0.00 175.52 175.63 1tm9 h ILE 126 N 0.20 0.00 -1.74 0.00 2.04 -0.88 -2.72 117.51 114.41 1tm9 h ILE 126 Ca 0.28 -0.95 0.50 0.00 1.00 0.00 0.00 64.86 65.70 1tm9 h ILE 126 Cb 0.84 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.85 1tm9 h ILE 126 CO -0.05 0.00 1.33 0.00 0.00 0.00 0.00 178.15 179.43 1tm9 h ALA 127 N -1.05 3.65 0.01 1.87 0.00 -0.78 1.90 119.26 124.86 1tm9 h ALA 127 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1tm9 h ALA 127 Cb 0.36 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1tm9 h ALA 127 CO 0.00 -2.23 -0.31 0.22 0.00 0.00 0.00 179.25 176.93 1tm9 h ASP 128 N 0.00 0.03 0.29 0.00 3.58 -0.92 -2.49 116.42 116.91 1tm9 h ASP 128 Ca 0.83 -0.90 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 1tm9 h ASP 128 Cb 3.48 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 44.52 1tm9 h ASP 128 CO -0.01 1.13 -0.14 -1.13 -2.88 0.00 0.00 179.24 176.21 1tm9 h ASN 129 N -0.96 -0.33 -0.52 2.28 -0.73 0.22 -2.13 115.58 113.42 1tm9 h ASN 129 Ca -0.08 -0.07 0.09 0.00 1.87 0.00 0.00 56.30 58.11 1tm9 h ASN 129 Cb 1.10 0.09 -0.03 0.00 0.27 0.00 0.00 38.32 39.75 1tm9 h ASN 129 CO -0.03 -0.13 0.35 -0.29 -0.37 0.00 0.00 177.43 176.96 1tm9 h ILE 130 N -0.51 0.89 0.00 2.57 2.10 0.21 1.07 117.51 123.83 1tm9 h ILE 130 Ca -0.04 -0.10 0.00 0.00 1.08 0.00 0.00 64.86 65.80 1tm9 h ILE 130 Cb 0.38 0.55 0.00 0.00 -1.09 0.00 0.00 36.82 36.67 1tm9 h ILE 130 CO 0.07 0.06 0.00 0.00 -1.08 0.00 0.00 178.15 177.19 1tm9 n ALA 131 N -2.54 2.12 0.07 0.18 0.00 -0.85 -2.06 120.51 117.43 1tm9 n ALA 131 Ca 0.08 -0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.24 1tm9 n ALA 131 Cb 0.37 -1.33 -0.14 0.00 0.00 0.00 0.00 19.45 18.35 1tm9 n ALA 131 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1tm9 h ASP 132 N 0.00 0.42 1.19 0.00 3.58 0.17 -3.33 116.42 118.46 1tm9 h ASP 132 Ca 0.00 -0.58 -0.09 0.00 0.42 0.00 0.00 57.03 56.78 1tm9 h ASP 132 Cb 0.14 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1tm9 h ASP 132 CO 0.00 1.49 -0.84 0.10 -2.88 0.00 0.00 179.24 177.10 1tm9 h TYR 133 N 0.07 0.00 0.00 0.28 -0.00 -1.41 -3.39 116.97 112.53 1tm9 h TYR 133 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.48 1tm9 h TYR 133 Cb 2.03 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.76 1tm9 h TYR 133 CO 0.07 0.34 0.00 1.28 -0.00 0.00 0.00 178.16 179.85 1tm9 n LEU 134 N -2.97 0.00 -3.06 0.10 4.77 -0.87 -4.92 117.00 110.04 1tm9 n LEU 134 Ca -0.02 0.52 -0.15 0.00 -0.03 0.00 0.00 56.01 56.33 1tm9 n LEU 134 Cb 0.70 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.78 1tm9 n LEU 134 CO 0.40 -0.02 -0.21 0.59 -1.33 0.00 0.00 177.39 176.83 1tm9 n ASN 135 N -0.88 -7.09 0.00 -1.43 3.02 -1.26 -5.01 115.26 102.61 1tm9 n ASN 135 Ca 0.00 0.47 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 1tm9 n ASN 135 Cb 0.00 -3.84 0.00 0.00 -0.61 0.00 0.00 39.78 35.33 1tm9 n ASN 135 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1tm9 n GLU 136 N 0.10 0.00 0.00 3.52 2.13 -1.26 -5.20 120.64 119.93 1tm9 n GLU 136 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1tm9 n GLU 136 Cb 0.45 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.16 1tm9 n GLU 136 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01