#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 -2.19 -4.03 0.03 -0.58 -1.26 -4.87 120.64 107.74 1tm9 n GLU 2 Ca 0.00 1.60 -0.42 0.00 -0.42 0.00 0.00 57.16 57.91 1tm9 n GLU 2 Cb 0.00 -2.63 0.02 0.00 -0.57 0.00 0.00 31.44 28.26 1tm9 n GLU 2 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1tm9 n GLN 3 N -3.67 -0.41 -4.28 3.49 6.02 -1.26 -4.94 117.38 112.34 1tm9 n GLN 3 Ca -0.02 0.12 -0.27 0.00 -0.01 0.00 0.00 57.00 56.82 1tm9 n GLN 3 Cb 0.48 -2.22 -0.09 0.00 1.02 0.00 0.00 30.24 29.43 1tm9 n GLN 3 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1tm9 s ASN 4 N -3.52 4.32 0.00 1.08 4.22 -1.26 -4.95 114.94 114.83 1tm9 s ASN 4 Ca 0.40 -0.55 0.00 0.00 -2.14 0.00 0.00 52.86 50.57 1tm9 s ASN 4 Cb -0.23 -0.76 0.00 0.00 1.28 0.00 0.00 41.25 41.55 1tm9 s ASN 4 CO 0.91 0.10 0.00 -0.46 -2.04 0.00 0.00 177.10 175.62 1tm9 n ASN 5 N 0.03 0.00 -0.39 3.54 6.94 -1.26 -4.94 115.26 119.18 1tm9 n ASN 5 Ca -0.11 0.00 -0.11 0.00 -0.02 0.00 0.00 54.58 54.34 1tm9 n ASN 5 Cb 0.55 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.87 1tm9 n ASN 5 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 1tm9 h ILE 6 N 0.00 0.00 -0.50 1.53 1.08 -1.99 1.02 117.51 118.65 1tm9 h ILE 6 Ca 0.00 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.55 1tm9 h ILE 6 Cb 0.00 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 33.65 1tm9 h ILE 6 CO 0.00 0.00 -0.40 0.11 -0.69 0.00 0.00 178.15 177.17 1tm9 h LYS 7 N -0.03 -0.25 -0.56 2.37 1.79 -2.00 0.19 116.57 118.08 1tm9 h LYS 7 Ca 0.15 0.02 0.09 0.00 -2.18 0.00 0.00 60.65 58.73 1tm9 h LYS 7 Cb 0.42 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 31.05 1tm9 h LYS 7 CO -0.90 -0.16 0.18 1.49 -1.08 0.00 0.00 179.45 178.98 1tm9 h GLU 8 N -0.26 0.33 -0.55 3.15 4.22 -0.74 0.25 114.58 120.98 1tm9 h GLU 8 Ca 0.17 -0.02 0.16 0.00 0.08 0.00 0.00 59.36 59.75 1tm9 h GLU 8 Cb 0.57 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1tm9 h GLU 8 CO -0.63 0.22 0.45 1.96 -2.18 0.00 0.00 179.01 178.83 1tm9 h GLN 9 N 0.34 0.00 0.43 1.92 4.20 0.38 -1.12 115.11 121.27 1tm9 h GLN 9 Ca 0.28 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.97 1tm9 h GLN 9 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1tm9 h GLN 9 CO -0.31 0.00 -0.21 -0.07 -0.67 0.00 0.00 178.83 177.57 1tm9 h LEU 10 N 0.00 -0.49 -0.90 1.46 3.38 0.10 -2.86 115.31 115.99 1tm9 h LEU 10 Ca 0.26 -0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.23 1tm9 h LEU 10 Cb 1.16 0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.91 1tm9 h LEU 10 CO -0.00 -0.09 -0.54 0.40 0.09 0.00 0.00 178.44 178.31 1tm9 h ILE 11 N -1.01 0.01 -0.37 1.22 5.03 -0.91 0.07 117.51 121.55 1tm9 h ILE 11 Ca -0.06 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.72 1tm9 h ILE 11 Cb 0.56 0.01 -0.06 0.00 -3.03 0.00 0.00 36.82 34.30 1tm9 h ILE 11 CO 0.10 0.00 -0.33 0.77 -0.68 0.00 0.00 178.15 178.01 1tm9 h SER 12 N -0.06 -1.15 0.00 1.72 4.64 -1.52 0.98 113.55 118.16 1tm9 h SER 12 Ca 0.19 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1tm9 h SER 12 Cb 0.48 0.49 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1tm9 h SER 12 CO -0.89 -0.19 0.00 0.49 -0.87 0.00 0.00 176.83 175.36 1tm9 n PHE 13 N -4.27 0.00 -0.29 4.77 3.72 -0.12 0.21 117.46 121.47 1tm9 n PHE 13 Ca -0.01 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 1tm9 n PHE 13 Cb 0.18 -0.37 0.28 0.00 -0.94 0.00 0.00 39.48 38.63 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 0.39 -0.15 1.38 3.04 -0.89 1.43 116.94 122.13 1tm9 h PHE 14 Ca 0.00 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 61.96 1tm9 h PHE 14 Cb 0.00 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 1tm9 h PHE 14 CO -0.59 -0.18 -0.09 -0.97 -2.02 0.00 0.00 178.31 174.47 1tm9 h ASN 15 N 0.24 0.21 0.73 0.41 -0.73 0.28 0.67 115.58 117.39 1tm9 h ASN 15 Ca 0.54 -0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.68 1tm9 h ASN 15 Cb 1.08 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.61 1tm9 h ASN 15 CO -0.63 0.33 0.00 0.00 -0.37 0.00 0.00 177.43 176.76 1tm9 n GLN 16 N -4.32 0.02 0.00 6.67 6.02 0.55 -3.92 117.38 122.41 1tm9 n GLN 16 Ca -0.01 0.17 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1tm9 n GLN 16 Cb 0.23 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1tm9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1tm9 n ALA 17 N -1.53 0.00 -1.43 -1.58 0.00 0.19 -4.93 120.51 111.22 1tm9 n ALA 17 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1tm9 n ALA 17 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 -2.23 -0.69 -4.07 0.00 3.41 -1.26 -4.76 113.62 104.02 1tm9 n SER 19 Ca 0.00 0.21 -0.35 0.00 -0.26 0.00 0.00 58.87 58.48 1tm9 n SER 19 Cb 0.00 0.86 0.08 0.00 -0.26 0.00 0.00 64.21 64.89 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 -2.78 0.00 -0.06 6.66 -2.24 -1.26 -4.92 114.28 109.67 1tm9 n THR 20 Ca 0.00 -0.10 -0.01 0.00 -2.27 0.00 0.00 64.05 61.67 1tm9 n THR 20 Cb 0.00 -0.22 -0.16 0.00 -2.10 0.00 0.00 70.33 67.85 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 -3.83 0.00 1.68 4.78 8.25 -1.26 -4.10 115.22 120.73 1tm9 n HIS 21 Ca -0.01 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.56 1tm9 n HIS 21 Cb 0.67 -0.77 0.67 0.00 1.12 0.00 0.00 29.99 31.68 1tm9 n HIS 21 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1tm9 n GLN 22 N -2.53 0.84 -0.24 -0.41 6.02 -1.26 -4.07 117.38 115.73 1tm9 n GLN 22 Ca -0.20 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 56.89 1tm9 n GLN 22 Cb 0.90 -1.42 0.20 0.00 1.02 0.00 0.00 30.24 30.93 1tm9 n GLN 22 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1tm9 n GLU 23 N -0.92 -0.06 0.29 -1.09 1.02 -1.26 0.26 120.64 118.88 1tm9 n GLU 23 Ca 0.17 1.04 -0.16 0.00 -0.02 0.00 0.00 57.16 58.18 1tm9 n GLU 23 Cb 0.08 -1.64 -0.08 0.00 -0.02 0.00 0.00 31.44 29.78 1tm9 n GLU 23 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1tm9 h ARG 24 N 0.00 -0.70 0.00 3.49 -0.00 -1.93 0.71 114.38 115.96 1tm9 h ARG 24 Ca 0.41 0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.94 1tm9 h ARG 24 Cb 0.84 0.16 0.00 0.00 0.00 0.00 0.00 29.97 30.96 1tm9 h ARG 24 CO -0.65 -0.42 0.00 1.28 0.00 0.00 0.00 179.97 180.18 1tm9 n LEU 25 N -5.36 0.12 -0.01 3.04 4.77 0.40 -1.53 117.00 118.43 1tm9 n LEU 25 Ca -0.12 0.53 -0.14 0.00 -0.03 0.00 0.00 56.01 56.26 1tm9 n LEU 25 Cb 0.32 -0.53 -0.14 0.00 -2.33 0.00 0.00 43.42 40.74 1tm9 n LEU 25 CO 0.35 -0.38 -0.67 0.47 -1.33 0.00 0.00 177.39 175.83 1tm9 n ASP 26 N -1.64 1.39 0.11 -1.43 9.92 0.71 -4.00 116.55 121.62 1tm9 n ASP 26 Ca 0.02 0.31 -0.05 0.00 -0.53 0.00 0.00 54.79 54.55 1tm9 n ASP 26 Cb 0.14 -0.37 -0.02 0.00 -0.64 0.00 0.00 41.12 40.22 1tm9 n ASP 26 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 1tm9 h PHE 27 N 0.03 -0.28 -1.74 1.24 -1.00 0.15 1.63 116.94 116.97 1tm9 h PHE 27 Ca -0.35 -0.01 0.52 0.00 2.81 0.00 0.00 57.97 60.94 1tm9 h PHE 27 Cb 2.03 0.09 -0.09 0.00 3.61 0.00 0.00 35.95 41.59 1tm9 h PHE 27 CO 0.03 -0.18 1.23 0.44 -1.61 0.00 0.00 178.31 178.22 1tm9 n ILE 28 N -3.18 -0.06 0.00 -0.55 -5.35 -0.99 0.20 119.36 109.43 1tm9 n ILE 28 Ca -0.04 1.48 0.00 0.00 -0.27 0.00 0.00 62.75 63.92 1tm9 n ILE 28 Cb 0.12 -2.45 0.00 0.00 -1.74 0.00 0.00 39.64 35.57 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 -1.06 -0.83 -0.28 0.00 7.64 0.55 0.19 113.62 119.83 1tm9 n SER 30 Ca 0.00 1.62 0.20 0.00 1.01 0.00 0.00 58.87 61.70 1tm9 n SER 30 Cb 0.00 -0.27 0.37 0.00 -1.01 0.00 0.00 64.21 63.30 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 -5.22 -0.35 -1.76 0.44 -1.04 0.52 0.18 114.28 107.05 1tm9 n THR 31 Ca 0.05 1.76 0.00 0.00 -2.04 0.00 0.00 64.05 63.82 1tm9 n THR 31 Cb 0.29 -2.72 0.16 0.00 -1.82 0.00 0.00 70.33 66.24 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 -5.04 1.85 -1.96 -2.82 0.00 0.40 -4.63 116.66 104.47 1tm9 n ARG 32 Ca 0.26 -3.38 0.02 0.00 -0.00 0.00 0.00 57.85 54.75 1tm9 n ARG 32 Cb 0.86 -1.63 0.03 0.00 0.00 0.00 0.00 32.46 31.73 1tm9 n ARG 32 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1tm9 n GLU 33 N -0.93 0.60 0.00 -0.14 -0.58 0.49 -4.95 120.64 115.14 1tm9 n GLU 33 Ca 0.22 -2.47 0.00 0.00 -0.42 0.00 0.00 57.16 54.49 1tm9 n GLU 33 Cb 0.77 -0.52 0.00 0.00 -0.57 0.00 0.00 31.44 31.12 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 0.09 0.00 0.04 1.62 2.88 -0.97 -4.70 113.62 112.58 1tm9 n SER 34 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1tm9 n SER 34 Cb 1.02 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.48 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 -0.69 0.00 -3.46 8.00 -1.26 -5.14 116.55 113.99 1tm9 n ASP 35 Ca 0.00 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.74 1tm9 n ASP 35 Cb 0.00 0.88 0.00 0.00 -0.02 0.00 0.00 41.12 41.98 1tm9 n ASP 35 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1tm9 n THR 36 N -2.56 0.00 -0.10 -3.53 5.66 -1.26 -5.08 114.28 107.40 1tm9 n THR 36 Ca 0.00 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.82 1tm9 n THR 36 Cb 0.00 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.69 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 0.00 0.64 1.09 3.72 -1.26 -4.36 117.46 117.29 1tm9 n PHE 37 Ca 0.00 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.47 1tm9 n PHE 37 Cb 0.00 -0.78 0.35 0.00 -0.94 0.00 0.00 39.48 38.11 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 -3.42 0.00 0.05 4.37 2.88 -1.26 -1.63 113.62 114.60 1tm9 n SER 38 Ca -0.39 0.16 -0.04 0.00 -1.33 0.00 0.00 58.87 57.28 1tm9 n SER 38 Cb 0.85 -0.33 -0.09 0.00 -0.75 0.00 0.00 64.21 63.90 1tm9 n SER 38 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1tm9 h SER 39 N 0.00 0.00 -3.62 -3.46 0.87 -1.92 -3.47 113.55 101.95 1tm9 h SER 39 Ca 0.00 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.04 1tm9 h SER 39 Cb 0.15 0.00 0.21 0.00 -0.44 0.00 0.00 62.40 62.33 1tm9 h SER 39 CO 0.00 0.80 -0.30 0.52 -0.53 0.00 0.00 176.83 177.32 1tm9 n VAL 40 N -3.14 0.00 -1.81 2.23 0.31 -0.65 -4.82 118.33 110.46 1tm9 n VAL 40 Ca -0.06 -0.15 -0.41 0.00 -0.01 0.00 0.00 64.34 63.71 1tm9 n VAL 40 Cb 0.91 -0.77 -0.01 0.00 -0.91 0.00 0.00 33.84 33.05 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 -2.58 6.88 -3.63 4.52 2.03 -1.26 -4.80 116.55 117.70 1tm9 n ASP 41 Ca 0.08 -2.91 -0.10 0.00 0.52 0.00 0.00 54.79 52.38 1tm9 n ASP 41 Cb 0.54 -1.50 -0.07 0.00 -0.72 0.00 0.00 41.12 39.37 1tm9 n ASP 41 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1tm9 s VAL 42 N 0.98 0.00 0.39 5.18 0.11 -1.26 -4.74 120.40 121.05 1tm9 s VAL 42 Ca 0.55 0.00 -0.25 0.00 -2.93 0.00 0.00 61.98 59.35 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 -0.06 0.00 1.06 -2.16 -3.33 0.00 0.00 175.10 170.61 1tm9 s PRO 43 N 0.22 4.21 0.06 1.54 0.04 -1.26 -4.91 135.00 134.89 1tm9 s PRO 43 Ca 0.02 1.55 -0.00 0.00 0.04 0.00 0.00 61.00 62.62 1tm9 s PRO 43 Cb -0.05 -2.62 -0.26 0.00 0.04 0.00 0.00 34.50 31.62 1tm9 s PRO 43 CO -0.04 -0.11 1.08 -0.07 0.04 0.00 0.00 177.00 177.90 1tm9 h LEU 44 N 2.64 0.28 -0.91 -3.56 3.38 -1.96 -2.97 115.31 112.21 1tm9 h LEU 44 Ca -0.48 -0.33 0.13 0.00 0.09 0.00 0.00 57.88 57.29 1tm9 h LEU 44 Cb 1.22 -0.09 -0.14 0.00 0.09 0.00 0.00 40.66 41.73 1tm9 h LEU 44 CO 0.63 1.26 -0.44 -0.33 0.09 0.00 0.00 178.44 179.65 1tm9 h GLU 45 N 0.05 -0.04 0.02 1.13 5.08 -1.98 1.87 114.58 120.70 1tm9 h GLU 45 Ca -0.14 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1tm9 h GLU 45 Cb 1.93 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.19 1tm9 h GLU 45 CO 0.17 -0.03 -0.01 -1.00 -1.00 0.00 0.00 179.01 177.14 1tm9 h PRO 46 N -0.04 -0.02 -0.61 2.33 0.13 -1.92 -3.28 132.00 128.57 1tm9 h PRO 46 Ca 0.27 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.52 1tm9 h PRO 46 Cb 0.54 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 31.56 1tm9 h PRO 46 CO -0.92 0.68 -0.17 0.82 -0.23 0.00 0.00 178.00 178.18 1tm9 h ILE 47 N -0.77 0.35 -0.26 -3.56 1.08 -1.18 1.77 117.51 114.94 1tm9 h ILE 47 Ca -0.00 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.54 1tm9 h ILE 47 Cb 0.71 0.35 -0.01 0.00 -3.07 0.00 0.00 36.82 34.81 1tm9 h ILE 47 CO 0.00 0.00 0.53 0.11 -0.69 0.00 0.00 178.15 178.10 1tm9 h LYS 48 N -0.02 0.00 0.16 2.37 1.57 0.28 1.25 116.57 122.18 1tm9 h LYS 48 Ca 0.29 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.77 1tm9 h LYS 48 Cb 0.47 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.81 1tm9 h LYS 48 CO -0.64 0.00 -1.30 -0.97 -0.57 0.00 0.00 179.45 175.97 1tm9 h ASN 49 N 0.00 0.80 -0.01 0.86 -0.73 0.26 -2.78 115.58 113.98 1tm9 h ASN 49 Ca 0.12 -0.78 0.00 0.00 1.87 0.00 0.00 56.30 57.52 1tm9 h ASN 49 Cb 1.18 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 39.52 1tm9 h ASN 49 CO -0.00 1.59 0.00 2.30 -0.37 0.00 0.00 177.43 180.95 1tm9 n ILE 50 N -3.73 0.00 -0.01 2.57 -5.35 0.39 -3.05 119.36 110.17 1tm9 n ILE 50 Ca -0.14 -0.12 0.05 0.00 -0.27 0.00 0.00 62.75 62.28 1tm9 n ILE 50 Cb 1.02 -0.03 -0.14 0.00 -1.74 0.00 0.00 39.64 38.76 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 -0.44 0.50 -0.73 7.28 5.41 0.13 -4.21 119.36 127.29 1tm9 n ILE 51 Ca 0.22 -0.60 -0.16 0.00 1.00 0.00 0.00 62.75 63.20 1tm9 n ILE 51 Cb 0.23 -0.22 0.05 0.00 -0.71 0.00 0.00 39.64 38.98 1tm9 n ILE 51 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1tm9 n GLU 52 N -2.49 1.79 -0.05 0.38 0.28 -1.06 -3.74 120.64 115.75 1tm9 n GLU 52 Ca -0.10 -1.60 -0.06 0.00 -0.16 0.00 0.00 57.16 55.23 1tm9 n GLU 52 Cb 0.72 -1.63 -0.07 0.00 1.43 0.00 0.00 31.44 31.89 1tm9 n GLU 52 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 1tm9 n ILE 53 N 0.16 0.67 -0.77 3.84 0.13 -1.26 -4.50 119.36 117.62 1tm9 n ILE 53 Ca 0.31 -0.36 -0.07 0.00 -1.10 0.00 0.00 62.75 61.54 1tm9 n ILE 53 Cb 0.70 -0.81 0.26 0.00 -0.84 0.00 0.00 39.64 38.94 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 -2.52 2.64 0.01 9.51 -2.24 -1.25 -4.53 114.28 115.91 1tm9 n THR 54 Ca -0.17 -1.42 -0.00 0.00 -2.27 0.00 0.00 64.05 60.18 1tm9 n THR 54 Cb 0.78 -0.42 -0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1tm9 n THR 54 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1tm9 h LYS 55 N 2.22 -0.02 -6.43 -0.78 1.57 -1.79 -3.36 116.57 107.98 1tm9 h LYS 55 Ca 0.26 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.42 1tm9 h LYS 55 Cb 2.18 0.00 0.08 0.00 0.08 0.00 0.00 32.23 34.58 1tm9 h LYS 55 CO 0.68 -0.01 0.39 -0.25 -0.57 0.00 0.00 179.45 179.68 1tm9 n ASP 56 N -2.08 1.85 0.30 0.86 9.92 -1.26 -4.77 116.55 121.37 1tm9 n ASP 56 Ca -0.00 1.14 0.18 0.00 -0.53 0.00 0.00 54.79 55.59 1tm9 n ASP 56 Cb 0.01 -1.30 0.95 0.00 -0.64 0.00 0.00 41.12 40.15 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 3.60 0.00 -0.01 -1.24 9.09 -1.97 0.17 114.58 124.22 1tm9 h GLU 57 Ca -0.44 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 58.93 1tm9 h GLU 57 Cb 1.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.42 1tm9 h GLU 57 CO 0.72 0.00 -0.17 -0.91 0.05 0.00 0.00 179.01 178.70 1tm9 h ASN 58 N 0.00 0.16 0.28 3.06 2.35 -1.94 -2.46 115.58 117.03 1tm9 h ASN 58 Ca 0.02 -0.75 0.00 0.00 -0.55 0.00 0.00 56.30 55.02 1tm9 h ASN 58 Cb 0.43 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1tm9 h ASN 58 CO -0.00 0.89 -0.29 1.56 -1.65 0.00 0.00 177.43 177.94 1tm9 h GLN 59 N -0.56 -0.59 -0.95 0.81 1.08 -1.27 0.16 115.11 113.80 1tm9 h GLN 59 Ca -0.02 0.04 0.14 0.00 -1.45 0.00 0.00 58.65 57.37 1tm9 h GLN 59 Cb 0.91 0.13 -0.09 0.00 -0.05 0.00 0.00 27.48 28.38 1tm9 h GLN 59 CO 0.03 -0.39 0.57 -0.56 -0.95 0.00 0.00 178.83 177.53 1tm9 h GLN 60 N -0.61 0.80 0.90 1.46 3.07 -1.48 0.46 115.11 119.71 1tm9 h GLN 60 Ca -0.01 -0.05 -0.04 0.00 0.09 0.00 0.00 58.65 58.64 1tm9 h GLN 60 Cb 0.56 -0.18 0.01 0.00 0.08 0.00 0.00 27.48 27.95 1tm9 h GLN 60 CO -0.07 0.53 -0.43 0.82 0.09 0.00 0.00 178.83 179.77 1tm9 h ILE 61 N 0.83 0.05 -0.43 1.86 2.04 -0.87 0.53 117.51 121.52 1tm9 h ILE 61 Ca 0.51 -0.09 0.12 0.00 1.00 0.00 0.00 64.86 66.40 1tm9 h ILE 61 Cb 0.63 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1tm9 h ILE 61 CO -0.32 0.00 0.33 -0.33 0.00 0.00 0.00 178.15 177.83 1tm9 h GLU 62 N -1.28 0.00 0.05 2.37 5.08 -0.02 -1.06 114.58 119.71 1tm9 h GLU 62 Ca -0.12 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1tm9 h GLU 62 Cb 0.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1tm9 h GLU 62 CO 0.20 0.00 -0.02 0.82 -1.00 0.00 0.00 179.01 179.01 1tm9 h ILE 63 N 0.00 1.32 -0.50 3.13 2.04 0.41 -2.23 117.51 121.68 1tm9 h ILE 63 Ca 0.20 -1.43 0.05 0.00 1.00 0.00 0.00 64.86 64.68 1tm9 h ILE 63 Cb 0.86 2.23 -0.07 0.00 -0.74 0.00 0.00 36.82 39.10 1tm9 h ILE 63 CO -0.00 0.35 -0.36 0.74 0.00 0.00 0.00 178.15 178.87 1tm9 h THR 64 N -0.72 0.00 -0.83 -0.27 2.02 0.14 1.02 112.91 114.26 1tm9 h THR 64 Ca -0.01 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.26 1tm9 h THR 64 Cb 0.62 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.96 1tm9 h THR 64 CO 0.01 0.00 0.48 0.11 0.37 0.00 0.00 175.52 176.49 1tm9 h LYS 65 N -0.09 0.79 -0.38 6.66 1.57 -1.60 -0.53 116.57 123.00 1tm9 h LYS 65 Ca 0.08 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.88 1tm9 h LYS 65 Cb 0.30 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.37 1tm9 h LYS 65 CO -0.51 0.52 0.02 0.82 -0.57 0.00 0.00 179.45 179.73 1tm9 h ILE 66 N 0.82 0.74 -0.76 1.86 2.04 0.34 1.33 117.51 123.88 1tm9 h ILE 66 Ca 0.40 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 66.25 1tm9 h ILE 66 Cb 0.34 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 1tm9 h ILE 66 CO -0.24 0.02 0.48 0.00 0.00 0.00 0.00 178.15 178.41 1tm9 h ALA 67 N 1.32 1.00 -0.15 1.87 0.00 0.23 -2.15 119.26 121.37 1tm9 h ALA 67 Ca 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1tm9 h ALA 67 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1tm9 h ALA 67 CO -0.29 0.26 0.01 0.28 0.00 0.00 0.00 179.25 179.51 1tm9 h VAL 68 N 0.92 1.24 -0.97 0.00 2.07 0.37 0.33 116.25 120.21 1tm9 h VAL 68 Ca 0.31 -0.78 0.18 0.00 0.82 0.00 0.00 66.70 67.22 1tm9 h VAL 68 Cb 0.03 1.47 -0.17 0.00 -1.52 0.00 0.00 31.29 31.10 1tm9 h VAL 68 CO -0.12 0.23 -0.30 -1.13 0.02 0.00 0.00 177.57 176.27 1tm9 h ASN 69 N 0.01 -1.12 0.19 0.57 -1.24 0.23 1.66 115.58 115.88 1tm9 h ASN 69 Ca 0.04 0.30 -0.01 0.00 0.71 0.00 0.00 56.30 57.34 1tm9 h ASN 69 Cb 0.34 0.66 0.00 0.00 0.73 0.00 0.00 38.32 40.06 1tm9 h ASN 69 CO 0.01 -0.31 -0.09 -1.13 -1.29 0.00 0.00 177.43 174.61 1tm9 h ASN 70 N -0.01 -0.22 -0.93 1.15 -0.73 -1.32 -2.99 115.58 110.54 1tm9 h ASN 70 Ca 0.41 -0.22 0.09 0.00 1.87 0.00 0.00 56.30 58.46 1tm9 h ASN 70 Cb 0.66 0.06 -0.12 0.00 0.27 0.00 0.00 38.32 39.19 1tm9 h ASN 70 CO -0.99 0.32 -0.56 0.40 -0.37 0.00 0.00 177.43 176.23 1tm9 h ILE 71 N -0.98 0.00 -0.96 2.57 1.08 0.11 1.79 117.51 121.12 1tm9 h ILE 71 Ca -0.03 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.69 1tm9 h ILE 71 Cb 0.43 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.05 1tm9 h ILE 71 CO 0.04 0.00 0.51 0.50 -0.69 0.00 0.00 178.15 178.51 1tm9 h LYS 72 N -0.05 0.46 -0.02 2.37 3.11 0.23 1.07 116.57 123.74 1tm9 h LYS 72 Ca 0.17 -0.03 -0.14 0.00 -2.81 0.00 0.00 60.65 57.84 1tm9 h LYS 72 Cb 0.45 -0.10 -0.02 0.00 -1.00 0.00 0.00 32.23 31.56 1tm9 h LYS 72 CO -0.90 0.31 -0.64 1.15 -2.81 0.00 0.00 179.45 176.55 1tm9 h THR 73 N 0.48 1.44 0.00 1.00 2.02 0.22 -2.56 112.91 115.51 1tm9 h THR 73 Ca 0.62 -2.15 0.00 0.00 0.77 0.00 0.00 66.41 65.65 1tm9 h THR 73 Cb 1.21 2.14 0.00 0.00 -1.74 0.00 0.00 68.15 69.77 1tm9 h THR 73 CO -0.51 0.62 0.00 0.18 0.37 0.00 0.00 175.52 176.18 1tm9 n LEU 74 N -3.80 0.37 -1.80 2.58 4.77 0.43 -2.36 117.00 117.19 1tm9 n LEU 74 Ca -0.02 0.66 -0.10 0.00 -0.03 0.00 0.00 56.01 56.52 1tm9 n LEU 74 Cb 0.64 -0.69 -0.01 0.00 -2.33 0.00 0.00 43.42 41.02 1tm9 n LEU 74 CO 0.43 -0.74 1.21 -1.54 -1.33 0.00 0.00 177.39 175.42 1tm9 n SER 75 N -1.98 5.84 0.10 -1.43 3.41 -0.94 -4.09 113.62 114.53 1tm9 n SER 75 Ca -0.00 -2.73 0.00 0.00 -0.26 0.00 0.00 58.87 55.88 1tm9 n SER 75 Cb 0.05 -1.15 0.00 0.00 -0.26 0.00 0.00 64.21 62.85 1tm9 n SER 75 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1tm9 n SER 76 N 1.16 -1.72 -3.60 4.04 7.64 -0.99 -5.08 113.62 115.07 1tm9 n SER 76 Ca 0.21 0.58 -0.29 0.00 1.01 0.00 0.00 58.87 60.37 1tm9 n SER 76 Cb 0.59 1.85 0.02 0.00 -1.01 0.00 0.00 64.21 65.65 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 -2.99 -3.28 -3.95 0.44 0.31 -1.18 -4.52 118.33 103.17 1tm9 n VAL 77 Ca 0.00 0.02 0.04 0.00 -0.01 0.00 0.00 64.34 64.39 1tm9 n VAL 77 Cb 0.00 -2.96 -0.01 0.00 -0.91 0.00 0.00 33.84 29.96 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 -1.01 -1.33 0.18 2.92 0.00 -1.26 -4.43 105.19 100.25 1tm9 n GLY 78 Ca -0.22 -1.11 -0.07 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.50 0.98 -2.88 4.61 0.00 -1.26 -4.82 120.51 116.63 1tm9 n ALA 79 Ca 0.00 -0.66 -0.43 0.00 0.00 0.00 0.00 53.44 52.35 1tm9 n ALA 79 Cb 0.13 0.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.60 1tm9 n ALA 79 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1tm9 s THR 80 N -2.54 4.54 -5.00 0.00 -4.23 -1.26 -4.87 115.64 102.28 1tm9 s THR 80 Ca -0.22 -1.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1tm9 s THR 80 Cb 0.03 -4.76 0.00 0.00 1.34 0.00 0.00 72.50 69.11 1tm9 s THR 80 CO 0.33 -1.51 0.00 0.61 -0.54 0.00 0.00 174.62 173.50 1tm9 n GLY 81 N 5.54 -0.16 1.13 3.99 0.00 -1.26 -5.08 105.19 109.34 1tm9 n GLY 81 Ca 0.15 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1tm9 n GLY 81 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1tm9 n GLN 82 N -0.27 0.00 -1.38 1.61 7.27 -1.26 -4.96 117.38 118.39 1tm9 n GLN 82 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 57.00 56.45 1tm9 n GLN 82 Cb 0.00 0.00 -0.11 0.00 2.41 0.00 0.00 30.24 32.54 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1tm9 n TYR 83 N -2.47 1.32 1.01 3.69 4.01 -1.26 -4.74 117.16 118.73 1tm9 n TYR 83 Ca 0.00 0.85 0.10 0.00 -0.16 0.00 0.00 57.90 58.69 1tm9 n TYR 83 Cb 0.00 -2.28 0.53 0.00 -0.31 0.00 0.00 39.34 37.27 1tm9 n TYR 83 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 1tm9 n MET 84 N 6.65 0.35 0.04 -0.72 0.00 -1.26 -3.12 117.12 119.07 1tm9 n MET 84 Ca 0.49 0.08 -0.11 0.00 -0.00 0.00 0.00 57.70 58.15 1tm9 n MET 84 Cb -0.04 -1.50 -0.08 0.00 0.00 0.00 0.00 33.22 31.60 1tm9 n MET 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1tm9 h ALA 85 N 3.01 -0.19 -0.43 -5.12 0.00 -1.95 -3.08 119.26 111.50 1tm9 h ALA 85 Ca 0.00 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 54.80 1tm9 h ALA 85 Cb 0.15 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1tm9 h ALA 85 CO 0.00 -0.29 0.43 1.03 0.00 0.00 0.00 179.25 180.43 1tm9 h SER 86 N -0.83 0.00 -0.29 0.00 0.87 -1.93 -1.79 113.55 109.58 1tm9 h SER 86 Ca -0.02 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.30 1tm9 h SER 86 Cb 0.54 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 62.41 1tm9 h SER 86 CO 0.03 0.00 -0.06 0.49 -0.53 0.00 0.00 176.83 176.76 1tm9 n PHE 87 N -3.81 0.51 0.00 2.24 3.01 -1.16 -3.64 117.46 114.61 1tm9 n PHE 87 Ca 0.08 -1.55 0.00 0.00 1.01 0.00 0.00 57.45 56.99 1tm9 n PHE 87 Cb 0.62 -1.28 0.00 0.00 -0.01 0.00 0.00 39.48 38.81 1tm9 n PHE 87 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1tm9 n PHE 88 N 1.73 0.00 -0.04 1.38 -0.00 -0.67 -4.73 117.46 115.12 1tm9 n PHE 88 Ca 0.35 0.00 0.15 0.00 -0.00 0.00 0.00 57.45 57.95 1tm9 n PHE 88 Cb 0.72 0.04 0.57 0.00 -0.00 0.00 0.00 39.48 40.82 1tm9 n PHE 88 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1tm9 h SER 89 N 0.00 0.23 -0.76 -2.13 0.87 -1.78 -0.85 113.55 109.13 1tm9 h SER 89 Ca 0.00 0.01 0.16 0.00 -1.23 0.00 0.00 61.79 60.73 1tm9 h SER 89 Cb 0.71 -0.04 -0.11 0.00 -0.44 0.00 0.00 62.40 62.52 1tm9 h SER 89 CO 0.00 0.13 0.24 0.71 -0.53 0.00 0.00 176.83 177.39 1tm9 h THR 90 N 0.25 0.56 -1.65 2.23 1.35 -1.85 -3.42 112.91 110.37 1tm9 h THR 90 Ca 0.26 -0.12 0.07 0.00 -0.55 0.00 0.00 66.41 66.08 1tm9 h THR 90 Cb 0.70 0.19 -0.26 0.00 -1.73 0.00 0.00 68.15 67.05 1tm9 h THR 90 CO -0.05 0.06 0.34 0.20 -0.25 0.00 0.00 175.52 175.82 1tm9 s ASN 91 N -5.27 -0.56 -0.09 5.36 -0.87 -0.32 -5.06 114.94 108.13 1tm9 s ASN 91 Ca -0.12 0.97 -0.17 0.00 -1.57 0.00 0.00 52.86 51.97 1tm9 s ASN 91 Cb 0.21 1.12 -0.28 0.00 -0.02 0.00 0.00 41.25 42.29 1tm9 s ASN 91 CO 0.76 -0.16 0.64 0.77 -2.57 0.00 0.00 177.10 176.54 1tm9 h SER 92 N 5.42 0.42 -0.91 -1.22 4.64 -1.83 -2.88 113.55 117.19 1tm9 h SER 92 Ca -0.28 -0.88 0.16 0.00 -0.47 0.00 0.00 61.79 60.32 1tm9 h SER 92 Cb 1.19 -0.14 -0.16 0.00 -0.31 0.00 0.00 62.40 62.99 1tm9 h SER 92 CO 0.15 1.59 -0.31 -0.62 -0.87 0.00 0.00 176.83 176.76 1tm9 n GLU 93 N -3.94 -0.17 -0.04 4.77 -0.58 -1.26 0.28 120.64 119.71 1tm9 n GLU 93 Ca -0.23 1.41 -0.13 0.00 -0.42 0.00 0.00 57.16 57.80 1tm9 n GLU 93 Cb 0.90 -2.10 -0.11 0.00 -0.57 0.00 0.00 31.44 29.55 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 -0.49 3.49 0.13 -1.97 -2.90 132.00 130.25 1tm9 h PRO 94 Ca 0.36 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.63 1tm9 h PRO 94 Cb 0.59 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.70 1tm9 h PRO 94 CO -0.92 0.72 0.44 0.00 -0.23 0.00 0.00 178.00 178.01 1tm9 h ALA 95 N 0.20 2.28 0.31 -0.56 0.00 -0.80 -0.04 119.26 120.65 1tm9 h ALA 95 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1tm9 h ALA 95 Cb 0.73 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1tm9 h ALA 95 CO 0.00 -0.69 -0.15 0.82 0.00 0.00 0.00 179.25 179.23 1tm9 h ILE 96 N 0.00 0.53 -0.81 0.00 2.04 0.42 -2.10 117.51 117.59 1tm9 h ILE 96 Ca 0.23 -0.77 0.15 0.00 1.00 0.00 0.00 64.86 65.48 1tm9 h ILE 96 Cb 1.11 0.83 -0.10 0.00 -0.74 0.00 0.00 36.82 37.93 1tm9 h ILE 96 CO -0.00 0.12 0.36 0.40 0.00 0.00 0.00 178.15 179.03 1tm9 h ILE 97 N -0.93 0.66 -0.20 -0.67 5.03 -0.87 0.54 117.51 121.07 1tm9 h ILE 97 Ca -0.04 -0.17 -0.01 0.00 -0.12 0.00 0.00 64.86 64.51 1tm9 h ILE 97 Cb 0.51 0.11 -0.01 0.00 -3.03 0.00 0.00 36.82 34.40 1tm9 h ILE 97 CO 0.07 0.09 0.08 0.15 -0.68 0.00 0.00 178.15 177.86 1tm9 h PHE 98 N 0.51 0.27 0.03 1.37 3.57 -1.08 0.21 116.94 121.81 1tm9 h PHE 98 Ca 0.45 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.95 1tm9 h PHE 98 Cb 0.69 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1tm9 h PHE 98 CO -0.13 0.22 -0.01 0.00 -2.23 0.00 0.00 178.31 176.15 1tm9 h VAL 100 N -0.10 0.05 0.03 0.00 2.07 -0.76 0.63 116.25 118.17 1tm9 h VAL 100 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1tm9 h VAL 100 Cb 0.03 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.81 1tm9 h VAL 100 CO 0.01 0.00 -0.41 0.40 0.02 0.00 0.00 177.57 177.58 1tm9 h ILE 101 N -0.07 0.00 -0.18 4.57 1.08 -0.71 -1.63 117.51 120.58 1tm9 h ILE 101 Ca 0.28 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.77 1tm9 h ILE 101 Cb 0.57 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 1tm9 h ILE 101 CO -0.87 0.00 -0.11 -1.22 -0.69 0.00 0.00 178.15 175.26 1tm9 n TYR 102 N -4.78 -0.08 -0.38 1.37 4.02 0.08 -1.18 117.16 116.21 1tm9 n TYR 102 Ca -0.06 0.22 -0.10 0.00 -0.01 0.00 0.00 57.90 57.95 1tm9 n TYR 102 Cb 0.31 -0.49 -0.09 0.00 -0.02 0.00 0.00 39.34 39.05 1tm9 n TYR 102 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 1tm9 h PHE 103 N 0.00 -1.74 0.00 -0.72 3.04 -0.96 0.51 116.94 117.07 1tm9 h PHE 103 Ca 0.03 0.12 0.00 0.00 3.98 0.00 0.00 57.97 62.10 1tm9 h PHE 103 Cb 0.07 0.88 0.00 0.00 2.56 0.00 0.00 35.95 39.46 1tm9 h PHE 103 CO -0.89 -0.34 0.00 1.28 -2.02 0.00 0.00 178.31 176.34 1tm9 n LEU 104 N -5.07 0.00 -0.20 0.59 4.77 -0.32 0.30 117.00 117.07 1tm9 n LEU 104 Ca 0.02 0.79 -0.02 0.00 -0.03 0.00 0.00 56.01 56.77 1tm9 n LEU 104 Cb 0.24 -0.32 0.05 0.00 -2.33 0.00 0.00 43.42 41.06 1tm9 n LEU 104 CO -0.14 -0.32 0.72 1.88 -1.33 0.00 0.00 177.39 178.19 1tm9 h TYR 105 N 0.00 -0.44 0.00 -1.77 0.05 -0.54 0.29 116.97 114.55 1tm9 h TYR 105 Ca 0.00 0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1tm9 h TYR 105 Cb 0.00 0.29 0.00 0.00 1.01 0.00 0.00 36.73 38.03 1tm9 h TYR 105 CO -0.60 -0.29 0.00 0.72 -1.05 0.00 0.00 178.16 176.94 1tm9 n HIS 106 N -5.43 0.00 -0.20 4.88 8.25 0.17 -0.39 115.22 122.50 1tm9 n HIS 106 Ca 0.07 0.00 0.26 0.00 -0.26 0.00 0.00 57.72 57.79 1tm9 n HIS 106 Cb 0.33 -0.46 0.66 0.00 1.12 0.00 0.00 29.99 31.64 1tm9 n HIS 106 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1tm9 h PHE 107 N 0.00 0.17 0.00 4.41 -1.00 0.33 -3.45 116.94 117.40 1tm9 h PHE 107 Ca 0.00 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1tm9 h PHE 107 Cb 0.00 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.51 1tm9 h PHE 107 CO -0.55 0.04 0.00 0.41 -1.61 0.00 0.00 178.31 176.60 1tm9 n GLY 108 N -1.65 0.88 0.74 -1.45 0.00 0.89 -5.07 105.19 99.52 1tm9 n GLY 108 Ca 0.19 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.17 1.61 3.72 -0.43 -4.98 117.46 115.22 1tm9 n PHE 109 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.99 1tm9 n PHE 109 Cb 0.00 0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.58 1tm9 n PHE 109 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1tm9 s LEU 110 N -5.30 4.43 0.64 4.37 1.43 -1.26 -4.94 118.68 118.05 1tm9 s LEU 110 Ca 0.00 2.55 -0.18 0.00 -1.03 0.00 0.00 54.13 55.46 1tm9 s LEU 110 Cb 0.00 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 1tm9 s LEU 110 CO 0.00 -0.52 1.27 -1.59 0.23 0.00 0.00 176.35 175.74 1tm9 s LYS 111 N -0.93 2.65 -0.29 1.70 0.00 -1.26 -4.75 119.74 116.85 1tm9 s LYS 111 Ca 0.53 2.00 -0.15 0.00 0.00 0.00 0.00 55.97 58.35 1tm9 s LYS 111 Cb -0.38 -1.87 0.14 0.00 0.00 0.00 0.00 37.83 35.72 1tm9 s LYS 111 CO 0.45 -1.50 0.87 0.16 0.00 0.00 0.00 175.35 175.33 1tm9 s ASP 112 N -1.46 -0.72 0.72 0.03 1.47 -1.26 -4.90 116.67 110.55 1tm9 s ASP 112 Ca 0.81 1.07 0.00 0.00 1.18 0.00 0.00 52.55 55.61 1tm9 s ASP 112 Cb -0.36 1.56 0.00 0.00 -0.34 0.00 0.00 42.92 43.79 1tm9 s ASP 112 CO 0.38 -0.16 0.00 0.59 0.68 0.00 0.00 175.17 176.66 1tm9 n ASN 113 N 4.49 -1.03 -4.43 2.11 3.02 -1.26 -5.05 115.26 113.11 1tm9 n ASN 113 Ca -0.15 -0.21 -0.29 0.00 -0.03 0.00 0.00 54.58 53.90 1tm9 n ASN 113 Cb 0.55 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.59 1tm9 n ASN 113 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1tm9 s ASN 114 N -1.71 3.55 0.00 6.41 2.20 -1.26 -4.92 114.94 119.21 1tm9 s ASN 114 Ca 0.00 -0.65 0.00 0.00 -0.94 0.00 0.00 52.86 51.27 1tm9 s ASN 114 Cb 0.00 -0.37 0.00 0.00 -2.00 0.00 0.00 41.25 38.88 1tm9 s ASN 114 CO 0.00 0.19 0.00 0.29 -2.94 0.00 0.00 177.10 174.64 1tm9 n LYS 115 N 0.98 -1.40 -0.01 3.55 4.76 -1.26 -4.95 118.16 119.83 1tm9 n LYS 115 Ca -0.17 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.41 1tm9 n LYS 115 Cb 0.53 0.00 0.71 0.00 -1.84 0.00 0.00 35.03 34.43 1tm9 n LYS 115 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1tm9 n LYS 116 N -0.00 1.20 -3.42 1.97 2.85 -1.26 -4.70 118.16 114.80 1tm9 n LYS 116 Ca 0.00 -0.30 0.01 0.00 -1.05 0.00 0.00 58.31 56.97 1tm9 n LYS 116 Cb 0.00 -1.44 -0.04 0.00 -0.65 0.00 0.00 35.03 32.90 1tm9 n LYS 116 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 1tm9 s GLN 117 N -1.98 0.30 0.29 -1.58 -2.07 -1.26 -5.12 119.66 108.24 1tm9 s GLN 117 Ca 0.40 0.74 0.05 0.00 -1.82 0.00 0.00 55.36 54.73 1tm9 s GLN 117 Cb 0.19 0.43 -0.06 0.00 -1.09 0.00 0.00 33.01 32.48 1tm9 s GLN 117 CO 0.32 -0.10 -0.01 -1.50 -1.32 0.00 0.00 175.29 172.67 1tm9 s ILE 118 N 2.39 1.41 0.02 3.63 1.10 -1.26 -4.99 121.20 123.49 1tm9 s ILE 118 Ca -0.03 -2.07 -0.04 0.00 -0.51 0.00 0.00 60.65 58.01 1tm9 s ILE 118 Cb -0.06 -2.55 -0.01 0.00 0.15 0.00 0.00 42.46 39.99 1tm9 s ILE 118 CO -0.17 -0.21 1.00 -0.38 -2.11 0.00 0.00 174.94 173.07 1tm9 n ILE 119 N -0.60 -0.08 -0.35 2.00 2.08 -1.26 0.98 119.36 122.13 1tm9 n ILE 119 Ca -0.04 1.51 0.11 0.00 0.56 0.00 0.00 62.75 64.89 1tm9 n ILE 119 Cb 0.65 -1.99 0.23 0.00 -0.75 0.00 0.00 39.64 37.78 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 0.00 -0.49 0.38 3.64 -1.96 1.41 116.57 119.56 1tm9 h LYS 120 Ca 0.02 -0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.50 1tm9 h LYS 120 Cb 0.05 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 31.78 1tm9 h LYS 120 CO -0.12 0.00 -0.08 -0.22 -2.27 0.00 0.00 179.45 176.76 1tm9 h LYS 121 N 0.00 0.03 0.33 1.90 3.11 0.24 0.52 116.57 122.70 1tm9 h LYS 121 Ca 0.55 -0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 58.37 1tm9 h LYS 121 Cb 1.02 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.25 1tm9 h LYS 121 CO -0.97 0.02 -0.16 0.00 -2.81 0.00 0.00 179.45 175.53 1tm9 h ALA 122 N 1.47 -1.11 -0.56 5.00 0.00 0.39 0.40 119.26 124.85 1tm9 h ALA 122 Ca 0.24 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.21 1tm9 h ALA 122 Cb 0.37 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1tm9 h ALA 122 CO -0.47 -1.08 0.82 1.88 0.00 0.00 0.00 179.25 180.39 1tm9 h TYR 123 N -0.45 0.00 0.14 0.00 0.05 -0.67 1.44 116.97 117.49 1tm9 h TYR 123 Ca -0.05 0.00 -0.32 0.00 0.05 0.00 0.00 58.73 58.42 1tm9 h TYR 123 Cb 0.34 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.08 1tm9 h TYR 123 CO 0.15 0.00 -1.59 1.49 -1.05 0.00 0.00 178.16 177.16 1tm9 h GLU 124 N 0.00 0.30 0.00 4.88 4.81 0.73 -1.01 114.58 124.29 1tm9 h GLU 124 Ca 0.27 -0.51 -0.02 0.00 -0.13 0.00 0.00 59.36 58.96 1tm9 h GLU 124 Cb 1.91 0.19 -0.00 0.00 0.63 0.00 0.00 28.75 31.48 1tm9 h GLU 124 CO -0.00 1.18 -0.11 0.00 -0.73 0.00 0.00 179.01 179.35 1tm9 h THR 125 N 0.08 0.98 0.00 0.32 1.03 0.64 -2.34 112.91 113.62 1tm9 h THR 125 Ca -0.27 -0.38 -0.14 0.00 -0.01 0.00 0.00 66.41 65.61 1tm9 h THR 125 Cb 2.05 1.21 -0.02 0.00 -1.07 0.00 0.00 68.15 70.32 1tm9 h THR 125 CO 0.17 0.11 -0.99 -0.38 -0.01 0.00 0.00 175.52 174.42 1tm9 n ILE 126 N -4.27 1.49 -0.70 0.00 5.41 -0.66 -2.53 119.36 118.10 1tm9 n ILE 126 Ca -0.03 0.07 0.53 0.00 1.00 0.00 0.00 62.75 64.32 1tm9 n ILE 126 Cb 0.19 -2.18 0.81 0.00 -0.71 0.00 0.00 39.64 37.74 1tm9 n ILE 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1tm9 n ALA 127 N -3.54 1.88 -0.09 -1.39 0.00 -0.38 0.21 120.51 117.20 1tm9 n ALA 127 Ca -0.22 0.65 -0.16 0.00 0.00 0.00 0.00 53.44 53.70 1tm9 n ALA 127 Cb 0.52 -1.13 -0.10 0.00 0.00 0.00 0.00 19.45 18.74 1tm9 n ALA 127 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1tm9 h ASP 128 N 0.00 0.00 -0.66 0.00 1.82 -1.56 -2.43 116.42 113.59 1tm9 h ASP 128 Ca 0.93 -0.49 0.16 0.00 -0.39 0.00 0.00 57.03 57.24 1tm9 h ASP 128 Cb 3.74 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 43.71 1tm9 h ASP 128 CO -0.02 1.23 0.45 -1.13 -1.61 0.00 0.00 179.24 178.17 1tm9 h ASN 129 N -1.00 0.20 1.12 2.28 -0.73 0.11 0.68 115.58 118.23 1tm9 h ASN 129 Ca -0.21 0.01 -0.16 0.00 1.87 0.00 0.00 56.30 57.81 1tm9 h ASN 129 Cb 1.05 -0.03 -0.03 0.00 0.27 0.00 0.00 38.32 39.59 1tm9 h ASN 129 CO -0.13 0.10 -0.92 -0.29 -0.37 0.00 0.00 177.43 175.82 1tm9 h ILE 130 N 0.21 1.05 -0.12 2.57 2.10 0.23 -3.10 117.51 120.45 1tm9 h ILE 130 Ca 0.32 -2.58 0.00 0.00 1.08 0.00 0.00 64.86 63.67 1tm9 h ILE 130 Cb 0.96 2.48 0.00 0.00 -1.09 0.00 0.00 36.82 39.17 1tm9 h ILE 130 CO -0.06 0.60 0.00 0.00 -1.08 0.00 0.00 178.15 177.61 1tm9 n ALA 131 N -2.32 2.54 0.13 0.18 0.00 0.20 -3.16 120.51 118.08 1tm9 n ALA 131 Ca -0.02 -0.40 0.07 0.00 0.00 0.00 0.00 53.44 53.09 1tm9 n ALA 131 Cb 0.84 -1.14 0.04 0.00 0.00 0.00 0.00 19.45 19.19 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 1.54 0.00 0.00 0.00 3.32 -0.35 -3.33 116.42 117.60 1tm9 h ASP 132 Ca 0.00 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1tm9 h ASP 132 Cb 0.34 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1tm9 h ASP 132 CO 0.00 0.22 -1.87 0.00 -1.72 0.00 0.00 179.24 175.87 1tm9 n TYR 133 N -2.97 0.00 0.00 4.55 0.18 -1.21 -4.71 117.16 113.00 1tm9 n TYR 133 Ca -0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1tm9 n TYR 133 Cb 0.64 -0.52 0.00 0.00 -0.38 0.00 0.00 39.34 39.08 1tm9 n TYR 133 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1tm9 n LEU 134 N -2.26 0.00 -2.51 -3.48 4.77 -1.19 -4.96 117.00 107.37 1tm9 n LEU 134 Ca -0.11 0.49 -0.03 0.00 -0.03 0.00 0.00 56.01 56.33 1tm9 n LEU 134 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1tm9 n LEU 134 CO 0.34 0.00 -0.19 0.59 -1.33 0.00 0.00 177.39 176.80 1tm9 n ASN 135 N -0.77 -6.75 -1.84 -1.43 4.13 -1.26 -4.95 115.26 102.38 1tm9 n ASN 135 Ca 0.00 0.81 -0.21 0.00 1.68 0.00 0.00 54.58 56.86 1tm9 n ASN 135 Cb 0.00 -4.46 0.08 0.00 -1.54 0.00 0.00 39.78 33.86 1tm9 n ASN 135 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1tm9 n GLU 136 N 0.14 2.91 -0.11 3.52 0.00 -1.26 -5.20 120.64 120.64 1tm9 n GLU 136 Ca 0.04 -3.71 0.00 0.00 0.00 0.00 0.00 57.16 53.49 1tm9 n GLU 136 Cb 0.17 -2.15 0.00 0.00 0.00 0.00 0.00 31.44 29.46 1tm9 n GLU 136 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40