#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tm9 s GLU 2 N 0.00 0.10 0.26 2.12 2.12 -1.26 -5.15 118.70 116.88 1tm9 s GLU 2 Ca 0.00 0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.54 1tm9 s GLU 2 Cb 0.00 0.12 0.00 0.00 0.26 0.00 0.00 34.13 34.51 1tm9 s GLU 2 CO 0.00 -0.06 0.00 1.04 -0.54 0.00 0.00 175.26 175.70 1tm9 n GLN 3 N 4.98 -1.69 -1.18 4.30 6.02 -1.26 -5.04 117.38 123.51 1tm9 n GLN 3 Ca -0.08 1.25 0.09 0.00 -0.01 0.00 0.00 57.00 58.26 1tm9 n GLN 3 Cb 0.55 -2.01 -0.05 0.00 1.02 0.00 0.00 30.24 29.75 1tm9 n GLN 3 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1tm9 n ASN 4 N -3.45 -6.41 0.02 1.08 3.02 -1.26 -4.69 115.26 103.57 1tm9 n ASN 4 Ca -0.02 1.29 0.00 0.00 -0.03 0.00 0.00 54.58 55.82 1tm9 n ASN 4 Cb 0.36 -3.91 0.00 0.00 -0.61 0.00 0.00 39.78 35.63 1tm9 n ASN 4 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1tm9 n ASN 5 N -3.31 0.31 0.00 6.41 4.13 -1.26 -4.55 115.26 116.98 1tm9 n ASN 5 Ca -0.05 0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1tm9 n ASN 5 Cb 0.49 -0.08 0.00 0.00 -1.54 0.00 0.00 39.78 38.64 1tm9 n ASN 5 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1tm9 n ILE 6 N -2.81 0.00 -0.35 2.41 2.08 -1.26 0.18 119.36 119.61 1tm9 n ILE 6 Ca 0.00 0.97 0.30 0.00 0.56 0.00 0.00 62.75 64.58 1tm9 n ILE 6 Cb 0.00 -1.87 0.55 0.00 -0.75 0.00 0.00 39.64 37.57 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 0.15 -0.47 0.38 3.11 -1.97 1.51 116.57 119.28 1tm9 h LYS 7 Ca 0.00 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.82 1tm9 h LYS 7 Cb 0.00 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.17 1tm9 h LYS 7 CO 0.00 0.10 0.24 1.49 -2.81 0.00 0.00 179.45 178.47 1tm9 h GLU 8 N 0.16 0.67 -0.70 1.90 4.57 -1.74 -1.93 114.58 117.52 1tm9 h GLU 8 Ca 0.79 -0.09 0.13 0.00 -1.18 0.00 0.00 59.36 59.01 1tm9 h GLU 8 Cb 2.07 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 30.49 1tm9 h GLU 8 CO -0.62 0.55 0.47 1.96 -1.18 0.00 0.00 179.01 180.19 1tm9 h GLN 9 N 0.62 0.40 -0.41 1.92 4.20 1.29 0.10 115.11 123.22 1tm9 h GLN 9 Ca 0.16 -0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.76 1tm9 h GLN 9 Cb 0.10 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1tm9 h GLN 9 CO -0.02 0.26 -0.08 -0.07 -0.67 0.00 0.00 178.83 178.25 1tm9 h LEU 10 N 0.41 0.78 0.84 1.46 3.38 -0.71 -2.54 115.31 118.93 1tm9 h LEU 10 Ca 0.33 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1tm9 h LEU 10 Cb 0.74 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.29 1tm9 h LEU 10 CO -0.10 0.95 -0.41 0.40 0.09 0.00 0.00 178.44 179.37 1tm9 h ILE 11 N 0.60 0.00 -0.96 1.22 5.03 -0.44 -2.97 117.51 119.99 1tm9 h ILE 11 Ca 0.11 -0.00 0.10 0.00 -0.12 0.00 0.00 64.86 64.95 1tm9 h ILE 11 Cb 0.59 0.00 -0.13 0.00 -3.03 0.00 0.00 36.82 34.26 1tm9 h ILE 11 CO 0.04 0.00 -0.52 -1.20 -0.68 0.00 0.00 178.15 175.79 1tm9 n SER 12 N -5.05 -0.92 0.00 1.72 7.64 -0.36 0.18 113.62 116.83 1tm9 n SER 12 Ca -0.14 1.71 0.00 0.00 1.01 0.00 0.00 58.87 61.45 1tm9 n SER 12 Cb 0.45 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1tm9 n SER 12 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1tm9 n PHE 13 N -5.26 0.00 -0.40 1.43 3.72 -0.96 0.20 117.46 116.19 1tm9 n PHE 13 Ca 0.04 0.00 0.32 0.00 -0.05 0.00 0.00 57.45 57.76 1tm9 n PHE 13 Cb 0.29 0.00 0.59 0.00 -0.94 0.00 0.00 39.48 39.42 1tm9 n PHE 13 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1tm9 h PHE 14 N 0.00 0.61 -0.83 1.38 -0.00 -1.40 1.75 116.94 118.45 1tm9 h PHE 14 Ca 0.00 0.03 0.03 0.00 -0.00 0.00 0.00 57.97 58.02 1tm9 h PHE 14 Cb 0.00 -0.16 -0.05 0.00 -0.00 0.00 0.00 35.95 35.75 1tm9 h PHE 14 CO 0.00 -0.15 0.55 -0.97 -0.00 0.00 0.00 178.31 177.74 1tm9 h ASN 15 N 0.18 0.91 -0.43 -0.68 -0.73 0.26 0.64 115.58 115.73 1tm9 h ASN 15 Ca 0.76 -0.01 -0.20 0.00 1.87 0.00 0.00 56.30 58.71 1tm9 h ASN 15 Cb 2.20 -0.22 -0.12 0.00 0.27 0.00 0.00 38.32 40.46 1tm9 h ASN 15 CO -0.42 0.64 0.25 0.00 -0.37 0.00 0.00 177.43 177.53 1tm9 n GLN 16 N -4.43 1.83 0.02 6.67 10.64 0.59 -4.14 117.38 128.56 1tm9 n GLN 16 Ca 0.10 -1.44 -0.00 0.00 -1.83 0.00 0.00 57.00 53.83 1tm9 n GLN 16 Cb 0.08 -1.62 -0.00 0.00 -0.86 0.00 0.00 30.24 27.85 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 -0.17 2.80 -2.43 2.61 0.00 0.20 -4.83 120.51 118.69 1tm9 n ALA 17 Ca 0.25 -0.04 -0.15 0.00 0.00 0.00 0.00 53.44 53.51 1tm9 n ALA 17 Cb 0.99 0.10 -0.11 0.00 0.00 0.00 0.00 19.45 20.44 1tm9 n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tm9 h SER 19 N 3.39 0.00 -0.08 0.00 0.02 -1.89 -3.43 113.55 111.57 1tm9 h SER 19 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1tm9 h SER 19 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1tm9 h SER 19 CO 0.55 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.59 1tm9 n THR 20 N -2.49 0.00 0.00 -2.27 -2.24 -1.26 -4.67 114.28 101.34 1tm9 n THR 20 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1tm9 n THR 20 Cb 0.09 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1tm9 n THR 20 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1tm9 n HIS 21 N -0.16 0.00 -0.07 4.78 -0.00 -1.26 -3.97 115.22 114.54 1tm9 n HIS 21 Ca 0.00 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.04 1tm9 n HIS 21 Cb 0.00 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 29.73 1tm9 n HIS 21 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1tm9 n GLN 22 N 0.00 0.68 -0.09 1.57 10.64 -1.26 -4.34 117.38 124.58 1tm9 n GLN 22 Ca 0.00 0.16 -0.07 0.00 -1.83 0.00 0.00 57.00 55.26 1tm9 n GLN 22 Cb 0.00 -1.63 0.00 0.00 -0.86 0.00 0.00 30.24 27.76 1tm9 n GLN 22 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 1tm9 h GLU 23 N 0.01 0.24 -0.88 2.61 4.81 -1.92 -2.02 114.58 117.44 1tm9 h GLU 23 Ca -0.47 -0.01 0.21 0.00 -0.13 0.00 0.00 59.36 58.96 1tm9 h GLU 23 Cb 2.07 -0.05 -0.16 0.00 0.63 0.00 0.00 28.75 31.23 1tm9 h GLU 23 CO 0.03 0.16 -0.01 0.07 -0.73 0.00 0.00 179.01 178.53 1tm9 h ARG 24 N 0.25 0.06 -0.40 1.92 0.11 -1.88 2.94 114.38 117.38 1tm9 h ARG 24 Ca 0.14 -0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.16 1tm9 h ARG 24 Cb 0.11 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.16 1tm9 h ARG 24 CO -0.15 0.04 0.01 -0.07 0.10 0.00 0.00 179.97 179.90 1tm9 h LEU 25 N 0.06 0.60 -0.14 0.08 3.38 -1.59 0.10 115.31 117.80 1tm9 h LEU 25 Ca 0.50 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1tm9 h LEU 25 Cb 0.93 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1tm9 h LEU 25 CO -0.81 0.66 -0.17 -0.67 0.09 0.00 0.00 178.44 177.54 1tm9 n ASP 26 N -4.26 0.39 -0.07 -0.43 2.03 0.56 -4.03 116.55 110.74 1tm9 n ASP 26 Ca 0.02 -0.27 -0.07 0.00 0.52 0.00 0.00 54.79 54.99 1tm9 n ASP 26 Cb 0.26 -0.09 -0.03 0.00 -0.72 0.00 0.00 41.12 40.54 1tm9 n ASP 26 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1tm9 h PHE 27 N 0.34 0.00 -1.63 -0.67 3.57 0.62 -1.42 116.94 117.75 1tm9 h PHE 27 Ca 0.00 0.00 0.49 0.00 3.53 0.00 0.00 57.97 61.99 1tm9 h PHE 27 Cb 0.43 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 39.08 1tm9 h PHE 27 CO 0.00 0.24 1.14 0.44 -2.23 0.00 0.00 178.31 177.91 1tm9 n ILE 28 N -4.60 -0.07 -0.07 1.41 -5.35 0.17 0.31 119.36 111.17 1tm9 n ILE 28 Ca -0.11 1.44 -0.05 0.00 -0.27 0.00 0.00 62.75 63.76 1tm9 n ILE 28 Cb 0.32 -2.38 -0.02 0.00 -1.74 0.00 0.00 39.64 35.82 1tm9 n ILE 28 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tm9 h SER 30 N -0.89 -0.42 0.00 0.00 0.02 0.49 2.12 113.55 114.87 1tm9 h SER 30 Ca 0.00 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1tm9 h SER 30 Cb 0.54 0.36 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1tm9 h SER 30 CO 0.00 -0.18 0.19 0.74 -1.14 0.00 0.00 176.83 176.44 1tm9 h THR 31 N 0.07 0.00 -0.08 -2.27 2.02 0.46 0.21 112.91 113.32 1tm9 h THR 31 Ca 0.37 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 67.36 1tm9 h THR 31 Cb 0.62 0.54 -0.37 0.00 -1.74 0.00 0.00 68.15 67.20 1tm9 h THR 31 CO -0.65 0.00 -1.02 -1.14 0.37 0.00 0.00 175.52 173.08 1tm9 n ARG 32 N -2.49 0.43 -0.92 6.66 0.00 0.59 -4.80 116.66 116.14 1tm9 n ARG 32 Ca -0.02 -2.36 -0.03 0.00 -0.00 0.00 0.00 57.85 55.45 1tm9 n ARG 32 Cb 0.23 -0.40 -0.02 0.00 0.00 0.00 0.00 32.46 32.28 1tm9 n ARG 32 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1tm9 n GLU 33 N 0.20 0.09 0.00 -0.14 -0.00 0.52 -4.94 120.64 116.38 1tm9 n GLU 33 Ca 0.08 -0.46 0.00 0.00 -0.00 0.00 0.00 57.16 56.78 1tm9 n GLU 33 Cb 1.06 0.45 0.00 0.00 -0.00 0.00 0.00 31.44 32.95 1tm9 n GLU 33 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1tm9 n SER 34 N -0.10 0.00 0.00 -1.84 7.64 0.53 -4.64 113.62 115.20 1tm9 n SER 34 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 1tm9 n SER 34 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1tm9 n SER 34 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1tm9 n ASP 35 N 0.00 0.00 0.00 6.43 9.92 -1.26 -5.12 116.55 126.52 1tm9 n ASP 35 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1tm9 n ASP 35 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 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 -0.83 0.00 -0.10 -3.53 5.66 -1.26 -5.08 114.28 109.15 1tm9 n THR 36 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 1tm9 n THR 36 Cb 0.00 -0.02 -0.09 0.00 -1.55 0.00 0.00 70.33 68.66 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 0.83 1.09 3.72 -1.26 -4.30 117.46 117.54 1tm9 n PHE 37 Ca 0.00 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.48 1tm9 n PHE 37 Cb 0.00 -0.79 0.43 0.00 -0.94 0.00 0.00 39.48 38.19 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 -3.14 0.00 -0.00 4.37 2.88 -1.26 -2.03 113.62 114.44 1tm9 n SER 38 Ca -0.36 -0.02 -0.12 0.00 -1.33 0.00 0.00 58.87 57.04 1tm9 n SER 38 Cb 0.88 -0.26 -0.14 0.00 -0.75 0.00 0.00 64.21 63.95 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 0.13 -3.74 -3.46 0.02 -1.96 -3.47 113.55 101.08 1tm9 h SER 39 Ca 0.00 -0.27 -0.56 0.00 -0.84 0.00 0.00 61.79 60.12 1tm9 h SER 39 Cb 0.14 -0.04 0.15 0.00 0.14 0.00 0.00 62.40 62.79 1tm9 h SER 39 CO 0.00 1.24 0.34 0.52 -1.14 0.00 0.00 176.83 177.79 1tm9 n VAL 40 N -3.20 3.78 -0.72 2.27 0.31 -0.86 -4.92 118.33 114.99 1tm9 n VAL 40 Ca -0.19 -0.50 -0.32 0.00 -0.01 0.00 0.00 64.34 63.32 1tm9 n VAL 40 Cb 1.04 -1.36 0.15 0.00 -0.91 0.00 0.00 33.84 32.76 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 -0.86 -1.85 0.00 4.52 -0.08 -1.26 -4.84 116.55 112.18 1tm9 n ASP 41 Ca 0.12 0.16 0.00 0.00 -1.51 0.00 0.00 54.79 53.57 1tm9 n ASP 41 Cb 0.46 -1.17 0.00 0.00 2.34 0.00 0.00 41.12 42.74 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 -4.04 -0.41 -1.69 5.18 3.14 -1.26 -5.03 118.33 114.21 1tm9 n VAL 42 Ca 0.05 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 61.12 1tm9 n VAL 42 Cb 0.56 -0.18 0.04 0.00 -1.06 0.00 0.00 33.84 33.19 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 -5.04 3.05 0.20 1.45 0.04 -1.26 -4.96 135.00 128.49 1tm9 s PRO 43 Ca 0.00 1.00 0.25 0.00 0.04 0.00 0.00 61.00 62.29 1tm9 s PRO 43 Cb 0.00 -2.00 0.50 0.00 0.04 0.00 0.00 34.50 33.04 1tm9 s PRO 43 CO 0.00 -1.01 1.52 -0.07 0.04 0.00 0.00 177.00 177.48 1tm9 h LEU 44 N -0.43 0.00 0.34 -3.56 3.38 -1.96 -3.10 115.31 109.99 1tm9 h LEU 44 Ca -0.44 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 1tm9 h LEU 44 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1tm9 h LEU 44 CO 0.57 0.04 -0.34 -0.33 0.09 0.00 0.00 178.44 178.47 1tm9 h GLU 45 N 0.00 -0.68 -0.03 1.13 5.08 -1.98 0.20 114.58 118.29 1tm9 h GLU 45 Ca 0.00 0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.29 1tm9 h GLU 45 Cb 0.79 0.15 0.01 0.00 0.50 0.00 0.00 28.75 30.21 1tm9 h GLU 45 CO 0.00 -0.45 -0.44 -1.00 -1.00 0.00 0.00 179.01 176.12 1tm9 h PRO 46 N -0.71 0.34 -0.55 2.33 0.13 -1.88 -3.25 132.00 128.41 1tm9 h PRO 46 Ca -0.02 -0.33 0.11 0.00 -0.87 0.00 0.00 66.00 64.89 1tm9 h PRO 46 Cb 0.64 0.09 -0.11 0.00 0.13 0.00 0.00 31.00 31.75 1tm9 h PRO 46 CO -0.06 1.01 -0.16 0.82 -0.23 0.00 0.00 178.00 179.37 1tm9 h ILE 47 N -0.19 0.41 0.00 -3.56 1.08 -1.52 1.99 117.51 115.72 1tm9 h ILE 47 Ca -0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1tm9 h ILE 47 Cb 1.14 0.41 0.00 0.00 -3.07 0.00 0.00 36.82 35.29 1tm9 h ILE 47 CO 0.09 0.00 0.10 0.11 -0.69 0.00 0.00 178.15 177.75 1tm9 h LYS 48 N -0.03 0.00 0.10 2.37 1.57 -0.67 0.99 116.57 120.90 1tm9 h LYS 48 Ca 0.26 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.75 1tm9 h LYS 48 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1tm9 h LYS 48 CO -0.58 0.00 -1.50 -0.97 -0.57 0.00 0.00 179.45 175.83 1tm9 h ASN 49 N 0.00 0.32 1.15 0.86 -0.73 0.31 -3.29 115.58 114.21 1tm9 h ASN 49 Ca 0.00 -0.45 -0.04 0.00 1.87 0.00 0.00 56.30 57.68 1tm9 h ASN 49 Cb 0.19 -0.10 -0.01 0.00 0.27 0.00 0.00 38.32 38.67 1tm9 h ASN 49 CO 0.00 1.37 -0.87 0.16 -0.37 0.00 0.00 177.43 177.72 1tm9 h ILE 50 N 0.06 0.18 0.00 2.57 3.07 0.98 -3.25 117.51 121.12 1tm9 h ILE 50 Ca -0.22 -1.32 -0.01 0.00 1.55 0.00 0.00 64.86 64.86 1tm9 h ILE 50 Cb 1.99 1.78 -0.00 0.00 -0.27 0.00 0.00 36.82 40.32 1tm9 h ILE 50 CO 0.15 0.10 -0.07 0.40 -1.05 0.00 0.00 178.15 177.69 1tm9 h ILE 51 N 0.00 0.24 -0.43 0.16 2.04 0.64 -1.93 117.51 118.23 1tm9 h ILE 51 Ca -0.04 -0.50 -0.21 0.00 1.00 0.00 0.00 64.86 65.12 1tm9 h ILE 51 Cb 1.16 1.39 -0.13 0.00 -0.74 0.00 0.00 36.82 38.50 1tm9 h ILE 51 CO 0.02 0.06 0.27 -0.62 0.00 0.00 0.00 178.15 177.88 1tm9 n GLU 52 N -3.29 1.62 -0.02 2.37 1.02 -1.23 -3.47 120.64 117.64 1tm9 n GLU 52 Ca -0.01 -1.33 0.01 0.00 -0.02 0.00 0.00 57.16 55.82 1tm9 n GLU 52 Cb 0.25 -1.54 -0.08 0.00 -0.02 0.00 0.00 31.44 30.05 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 -0.19 0.29 -1.03 -3.67 0.13 -0.73 -4.47 119.36 109.69 1tm9 n ILE 53 Ca 0.25 -0.33 0.08 0.00 -1.10 0.00 0.00 62.75 61.65 1tm9 n ILE 53 Cb 1.00 -0.16 0.25 0.00 -0.84 0.00 0.00 39.64 39.89 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 -2.09 2.28 0.11 9.51 -2.24 -1.23 -4.63 114.28 115.99 1tm9 n THR 54 Ca -0.08 -1.96 -0.11 0.00 -2.27 0.00 0.00 64.05 59.63 1tm9 n THR 54 Cb 0.52 -0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 68.42 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 1.63 -0.33 -6.70 -0.78 2.10 -1.78 -3.39 116.57 107.31 1tm9 h LYS 55 Ca 0.02 0.02 -0.52 0.00 -2.00 0.00 0.00 60.65 58.16 1tm9 h LYS 55 Cb 1.43 0.07 0.06 0.00 -0.90 0.00 0.00 32.23 32.90 1tm9 h LYS 55 CO 0.22 0.02 0.92 0.34 -2.00 0.00 0.00 179.45 178.95 1tm9 s ASP 56 N -5.26 6.45 0.53 7.07 2.15 -1.26 -4.85 116.67 121.49 1tm9 s ASP 56 Ca -0.12 2.82 0.23 0.00 0.43 0.00 0.00 52.55 55.92 1tm9 s ASP 56 Cb 0.01 -2.61 1.37 0.00 -0.30 0.00 0.00 42.92 41.39 1tm9 s ASP 56 CO 0.43 -0.90 2.03 1.05 -0.17 0.00 0.00 175.17 177.61 1tm9 h GLU 57 N 6.01 0.00 -0.23 4.34 9.09 -1.98 0.33 114.58 132.14 1tm9 h GLU 57 Ca -0.44 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 58.86 1tm9 h GLU 57 Cb 1.21 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.30 1tm9 h GLU 57 CO 0.88 0.00 -0.30 -0.91 0.05 0.00 0.00 179.01 178.73 1tm9 h ASN 58 N 0.00 0.48 -0.12 3.06 2.35 -1.95 -2.22 115.58 117.17 1tm9 h ASN 58 Ca 0.20 -0.18 -0.05 0.00 -0.55 0.00 0.00 56.30 55.71 1tm9 h ASN 58 Cb 0.79 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.03 1tm9 h ASN 58 CO -0.00 0.76 -0.14 1.56 -1.65 0.00 0.00 177.43 177.97 1tm9 h GLN 59 N 0.41 0.31 -0.83 0.81 1.08 -0.67 -0.56 115.11 115.66 1tm9 h GLN 59 Ca 0.05 -0.17 0.10 0.00 -1.45 0.00 0.00 58.65 57.18 1tm9 h GLN 59 Cb 0.74 0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 28.12 1tm9 h GLN 59 CO 0.06 0.72 0.54 1.96 -0.95 0.00 0.00 178.83 181.16 1tm9 h GLN 60 N -0.09 0.75 0.32 1.46 4.20 -1.18 1.51 115.11 122.09 1tm9 h GLN 60 Ca 0.02 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1tm9 h GLN 60 Cb 0.67 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1tm9 h GLN 60 CO 0.03 0.50 -0.15 0.82 -0.67 0.00 0.00 178.83 179.36 1tm9 h ILE 61 N 0.77 0.38 -0.67 2.54 2.04 -1.30 -2.41 117.51 118.87 1tm9 h ILE 61 Ca 0.38 -0.78 0.07 0.00 1.00 0.00 0.00 64.86 65.53 1tm9 h ILE 61 Cb 0.45 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1tm9 h ILE 61 CO -0.15 0.09 0.44 -0.08 0.00 0.00 0.00 178.15 178.45 1tm9 h GLU 62 N -1.00 0.64 -0.51 2.37 4.81 -0.67 -0.90 114.58 119.31 1tm9 h GLU 62 Ca -0.04 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1tm9 h GLU 62 Cb 0.48 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1tm9 h GLU 62 CO 0.07 0.42 0.34 0.82 -0.73 0.00 0.00 179.01 179.93 1tm9 h ILE 63 N 0.66 1.13 0.11 2.32 2.04 0.21 0.62 117.51 124.60 1tm9 h ILE 63 Ca 0.29 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.93 1tm9 h ILE 63 Cb 0.29 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1tm9 h ILE 63 CO -0.09 0.13 -0.35 0.74 0.00 0.00 0.00 178.15 178.57 1tm9 h THR 64 N 0.69 0.26 -0.48 -0.27 2.02 -0.64 0.63 112.91 115.12 1tm9 h THR 64 Ca 0.19 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.32 1tm9 h THR 64 Cb -0.07 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.57 1tm9 h THR 64 CO -0.04 0.00 0.11 0.50 0.37 0.00 0.00 175.52 176.46 1tm9 h LYS 65 N -0.58 0.73 0.09 6.66 3.11 -1.23 -2.13 116.57 123.21 1tm9 h LYS 65 Ca 0.03 -0.14 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 1tm9 h LYS 65 Cb 0.61 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.72 1tm9 h LYS 65 CO -0.21 0.67 -0.08 0.82 -2.81 0.00 0.00 179.45 177.84 1tm9 h ILE 66 N 0.71 0.82 -0.94 2.00 2.04 0.14 0.51 117.51 122.79 1tm9 h ILE 66 Ca 0.16 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.13 1tm9 h ILE 66 Cb 0.27 0.82 -0.08 0.00 -0.74 0.00 0.00 36.82 37.09 1tm9 h ILE 66 CO -0.00 0.00 0.57 0.00 0.00 0.00 0.00 178.15 178.72 1tm9 h ALA 67 N 0.73 1.40 0.31 1.87 0.00 0.58 -1.79 119.26 122.36 1tm9 h ALA 67 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1tm9 h ALA 67 Cb 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1tm9 h ALA 67 CO -0.02 0.15 -0.15 0.28 0.00 0.00 0.00 179.25 179.51 1tm9 h VAL 68 N 0.90 0.71 -1.82 0.00 2.07 -0.70 1.32 116.25 118.73 1tm9 h VAL 68 Ca 0.47 -0.47 0.54 0.00 0.82 0.00 0.00 66.70 68.06 1tm9 h VAL 68 Cb 0.48 0.95 -0.08 0.00 -1.52 0.00 0.00 31.29 31.11 1tm9 h VAL 68 CO -0.27 0.09 1.29 -3.20 0.02 0.00 0.00 177.57 175.50 1tm9 n ASN 69 N -5.16 0.03 -0.11 0.57 5.15 0.17 0.18 115.26 116.09 1tm9 n ASN 69 Ca -0.10 1.00 -0.18 0.00 -0.60 0.00 0.00 54.58 54.70 1tm9 n ASN 69 Cb 0.25 -0.50 -0.07 0.00 -0.53 0.00 0.00 39.78 38.94 1tm9 n ASN 69 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1tm9 n ASN 70 N -3.93 1.92 -0.22 1.20 2.85 -0.94 -4.16 115.26 111.98 1tm9 n ASN 70 Ca 0.42 0.39 -0.01 0.00 -0.11 0.00 0.00 54.58 55.27 1tm9 n ASN 70 Cb 1.87 -0.82 0.06 0.00 1.24 0.00 0.00 39.78 42.13 1tm9 n ASN 70 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1tm9 h ILE 71 N -1.00 0.32 -0.72 -1.44 1.08 0.49 0.27 117.51 116.51 1tm9 h ILE 71 Ca -0.33 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.28 1tm9 h ILE 71 Cb 1.22 0.32 -0.13 0.00 -3.07 0.00 0.00 36.82 35.15 1tm9 h ILE 71 CO -0.20 0.00 -0.25 0.11 -0.69 0.00 0.00 178.15 177.12 1tm9 h LYS 72 N -0.03 -0.05 -0.32 2.37 1.79 0.18 1.12 116.57 121.62 1tm9 h LYS 72 Ca 0.30 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.76 1tm9 h LYS 72 Cb 0.49 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.14 1tm9 h LYS 72 CO -0.67 -0.04 0.13 1.15 -1.08 0.00 0.00 179.45 178.95 1tm9 h THR 73 N -0.06 1.12 0.00 -0.16 2.02 -0.72 0.84 112.91 115.95 1tm9 h THR 73 Ca 0.32 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1tm9 h THR 73 Cb 0.56 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1tm9 h THR 73 CO -0.76 0.15 0.00 0.18 0.37 0.00 0.00 175.52 175.46 1tm9 n LEU 74 N -4.41 0.53 -2.10 2.58 4.77 0.38 -2.58 117.00 116.17 1tm9 n LEU 74 Ca 0.02 0.73 -0.16 0.00 -0.03 0.00 0.00 56.01 56.56 1tm9 n LEU 74 Cb 0.13 -0.78 -0.08 0.00 -2.33 0.00 0.00 43.42 40.36 1tm9 n LEU 74 CO 0.36 -0.87 1.48 -0.24 -1.33 0.00 0.00 177.39 176.79 1tm9 n SER 75 N -2.20 5.85 0.04 -1.43 2.88 0.29 -4.13 113.62 114.92 1tm9 n SER 75 Ca -0.01 -2.80 0.00 0.00 -1.33 0.00 0.00 58.87 54.73 1tm9 n SER 75 Cb 0.06 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.24 1tm9 n SER 75 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1tm9 n SER 76 N 1.52 -0.71 -3.67 -3.46 7.64 -1.06 -5.08 113.62 108.81 1tm9 n SER 76 Ca 0.38 0.23 -0.31 0.00 1.01 0.00 0.00 58.87 60.18 1tm9 n SER 76 Cb 0.69 0.90 0.02 0.00 -1.01 0.00 0.00 64.21 64.81 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 -2.39 -3.67 0.00 0.44 0.31 -1.23 -3.74 118.33 108.05 1tm9 n VAL 77 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1tm9 n VAL 77 Cb 0.00 -3.24 0.00 0.00 -0.91 0.00 0.00 33.84 29.69 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 -1.03 1.45 0.96 2.92 0.00 -1.26 -4.53 105.19 103.69 1tm9 n GLY 78 Ca -0.22 0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 6.82 0.00 -1.80 4.61 0.00 -1.25 -5.14 120.51 123.76 1tm9 n ALA 79 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1tm9 n ALA 79 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 -2.00 3.91 0.00 0.00 -4.23 -1.26 -4.87 115.64 107.19 1tm9 s THR 80 Ca 0.00 1.20 0.00 0.00 -1.18 0.00 0.00 61.69 61.71 1tm9 s THR 80 Cb 0.00 -3.49 0.00 0.00 1.34 0.00 0.00 72.50 70.35 1tm9 s THR 80 CO 0.00 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1tm9 n GLY 81 N -0.31 0.48 2.70 3.99 0.00 -1.26 -4.77 105.19 106.02 1tm9 n GLY 81 Ca 0.09 -0.78 -0.07 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.21 0.73 -3.43 1.61 7.27 -1.26 -5.03 117.38 117.06 1tm9 n GLN 82 Ca 0.00 -1.48 -0.44 0.00 0.07 0.00 0.00 57.00 55.15 1tm9 n GLN 82 Cb 0.00 -0.58 -0.05 0.00 2.41 0.00 0.00 30.24 32.01 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 1tm9 s TYR 83 N 0.18 3.52 0.45 3.69 2.02 -1.26 -4.66 117.35 121.28 1tm9 s TYR 83 Ca 0.20 -1.90 0.34 0.00 -0.37 0.00 0.00 57.07 55.34 1tm9 s TYR 83 Cb 0.29 -3.66 1.77 0.00 -0.40 0.00 0.00 41.96 39.96 1tm9 s TYR 83 CO -0.10 -0.98 2.17 1.98 -1.57 0.00 0.00 175.55 177.05 1tm9 h MET 84 N 8.09 0.00 -0.55 -0.62 1.85 -1.95 -2.06 114.93 119.69 1tm9 h MET 84 Ca -0.08 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 58.98 1tm9 h MET 84 Cb 1.05 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 33.05 1tm9 h MET 84 CO 0.84 0.05 0.22 0.00 -0.40 0.00 0.00 176.91 177.62 1tm9 h ALA 85 N 1.95 0.71 -0.09 0.39 0.00 -1.96 -1.74 119.26 118.53 1tm9 h ALA 85 Ca -0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1tm9 h ALA 85 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1tm9 h ALA 85 CO 0.01 0.32 -0.45 1.03 0.00 0.00 0.00 179.25 180.15 1tm9 h SER 86 N 0.75 0.22 -0.38 0.00 0.87 -1.80 -2.49 113.55 110.72 1tm9 h SER 86 Ca 0.18 -0.10 -0.10 0.00 -1.23 0.00 0.00 61.79 60.54 1tm9 h SER 86 Cb 0.19 -0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 62.03 1tm9 h SER 86 CO -0.02 0.65 0.13 0.33 -0.53 0.00 0.00 176.83 177.39 1tm9 n PHE 87 N -3.99 1.27 -0.02 2.24 7.35 -0.86 -3.71 117.46 119.75 1tm9 n PHE 87 Ca -0.02 -0.69 -0.02 0.00 -0.76 0.00 0.00 57.45 55.97 1tm9 n PHE 87 Cb 0.51 -0.43 -0.02 0.00 0.35 0.00 0.00 39.48 39.88 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 0.07 0.00 -0.00 -5.13 3.01 -0.71 -4.39 117.46 110.30 1tm9 n PHE 88 Ca 0.21 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.55 1tm9 n PHE 88 Cb 0.88 -0.16 -0.07 0.00 -0.01 0.00 0.00 39.48 40.12 1tm9 n PHE 88 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1tm9 h SER 89 N 0.00 0.07 -0.01 4.37 0.87 -1.63 -3.12 113.55 114.09 1tm9 h SER 89 Ca -0.09 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1tm9 h SER 89 Cb 1.18 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 63.12 1tm9 h SER 89 CO 0.00 0.26 0.01 0.71 -0.53 0.00 0.00 176.83 177.28 1tm9 h THR 90 N -0.13 1.01 -3.15 2.23 1.35 -1.84 -3.35 112.91 109.03 1tm9 h THR 90 Ca 0.01 -0.03 -0.75 0.00 -0.55 0.00 0.00 66.41 65.09 1tm9 h THR 90 Cb 0.22 1.00 -0.25 0.00 -1.73 0.00 0.00 68.15 67.39 1tm9 h THR 90 CO -0.00 0.01 -0.24 0.20 -0.25 0.00 0.00 175.52 175.24 1tm9 s ASN 91 N -5.21 6.12 -0.16 5.36 0.01 -1.18 -4.89 114.94 114.99 1tm9 s ASN 91 Ca -0.13 -1.84 -0.22 0.00 -0.71 0.00 0.00 52.86 49.96 1tm9 s ASN 91 Cb 0.06 -2.17 -0.23 0.00 0.41 0.00 0.00 41.25 39.31 1tm9 s ASN 91 CO 0.66 -0.82 0.46 0.77 -1.51 0.00 0.00 177.10 176.66 1tm9 h SER 92 N 8.77 0.12 -0.89 -1.22 4.64 -1.71 -2.72 113.55 120.55 1tm9 h SER 92 Ca -0.27 -0.74 0.15 0.00 -0.47 0.00 0.00 61.79 60.46 1tm9 h SER 92 Cb 1.09 -0.04 -0.15 0.00 -0.31 0.00 0.00 62.40 63.00 1tm9 h SER 92 CO 1.00 1.41 -0.32 -0.62 -0.87 0.00 0.00 176.83 177.43 1tm9 n GLU 93 N -4.31 -0.18 -0.04 4.77 1.02 -1.26 0.17 120.64 120.81 1tm9 n GLU 93 Ca -0.24 1.37 -0.14 0.00 -0.02 0.00 0.00 57.16 58.13 1tm9 n GLU 93 Cb 0.70 -2.04 -0.11 0.00 -0.02 0.00 0.00 31.44 29.97 1tm9 n GLU 93 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1tm9 h PRO 94 N 0.00 0.05 -0.91 3.49 0.13 -1.95 -2.92 132.00 129.89 1tm9 h PRO 94 Ca 0.33 -0.04 0.26 0.00 -0.87 0.00 0.00 66.00 65.68 1tm9 h PRO 94 Cb 0.56 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.66 1tm9 h PRO 94 CO -0.89 0.79 0.72 0.00 -0.23 0.00 0.00 178.00 178.39 1tm9 h ALA 95 N 0.26 2.80 0.16 -0.56 0.00 -0.64 1.10 119.26 122.39 1tm9 h ALA 95 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1tm9 h ALA 95 Cb 0.80 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1tm9 h ALA 95 CO 0.01 -1.19 -0.08 0.82 0.00 0.00 0.00 179.25 178.82 1tm9 h ILE 96 N 0.00 0.00 -0.95 0.00 2.04 0.18 -2.79 117.51 115.99 1tm9 h ILE 96 Ca 0.43 -0.24 0.15 0.00 1.00 0.00 0.00 64.86 66.20 1tm9 h ILE 96 Cb 1.86 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.85 1tm9 h ILE 96 CO -0.00 0.00 0.56 0.40 0.00 0.00 0.00 178.15 179.10 1tm9 h ILE 97 N -0.46 0.79 -0.00 -0.67 5.03 -1.06 -1.83 117.51 119.31 1tm9 h ILE 97 Ca -0.02 -0.27 0.00 0.00 -0.12 0.00 0.00 64.86 64.45 1tm9 h ILE 97 Cb 0.17 -0.07 -0.00 0.00 -3.03 0.00 0.00 36.82 33.88 1tm9 h ILE 97 CO 0.04 0.14 -0.00 -0.26 -0.68 0.00 0.00 178.15 177.39 1tm9 h PHE 98 N 0.79 -0.01 -0.12 1.37 0.04 0.11 1.24 116.94 120.37 1tm9 h PHE 98 Ca 0.51 0.00 0.02 0.00 2.80 0.00 0.00 57.97 61.30 1tm9 h PHE 98 Cb 0.67 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.79 1tm9 h PHE 98 CO -0.03 -0.00 -0.24 0.00 -0.60 0.00 0.00 178.31 177.43 1tm9 n VAL 100 N -3.85 -0.49 0.00 0.00 0.31 -0.72 0.12 118.33 113.70 1tm9 n VAL 100 Ca -0.02 2.25 0.00 0.00 -0.01 0.00 0.00 64.34 66.56 1tm9 n VAL 100 Cb 0.16 -2.99 0.00 0.00 -0.91 0.00 0.00 33.84 30.10 1tm9 n VAL 100 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1tm9 n ILE 101 N -5.44 0.00 -0.39 2.52 2.08 0.42 -2.00 119.36 116.56 1tm9 n ILE 101 Ca 0.11 1.41 -0.08 0.00 0.56 0.00 0.00 62.75 64.75 1tm9 n ILE 101 Cb 0.40 -2.29 -0.05 0.00 -0.75 0.00 0.00 39.64 36.94 1tm9 n ILE 101 CO 0.00 0.00 0.00 0.22 0.56 0.00 0.00 176.55 177.33 1tm9 h TYR 102 N 0.00 -1.60 -0.46 1.39 3.20 0.14 -0.82 116.97 118.83 1tm9 h TYR 102 Ca 0.00 0.12 0.04 0.00 3.14 0.00 0.00 58.73 62.03 1tm9 h TYR 102 Cb 0.00 0.83 -0.05 0.00 1.54 0.00 0.00 36.73 39.05 1tm9 h TYR 102 CO -0.03 -0.39 -0.27 0.34 -1.64 0.00 0.00 178.16 176.17 1tm9 n PHE 103 N -5.33 -0.20 0.01 -3.82 -0.00 0.33 -0.24 117.46 108.21 1tm9 n PHE 103 Ca 0.04 0.57 -0.06 0.00 -0.00 0.00 0.00 57.45 58.01 1tm9 n PHE 103 Cb 0.31 -0.51 -0.04 0.00 -0.00 0.00 0.00 39.48 39.25 1tm9 n PHE 103 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1tm9 h LEU 104 N 0.00 -0.64 -0.72 -2.13 3.38 -0.55 -2.32 115.31 112.33 1tm9 h LEU 104 Ca 0.07 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.19 1tm9 h LEU 104 Cb 0.19 0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.09 1tm9 h LEU 104 CO -0.43 -0.19 -0.39 -1.22 0.09 0.00 0.00 178.44 176.30 1tm9 n TYR 105 N -3.63 -0.24 -0.34 1.13 4.01 -0.51 0.18 117.16 117.77 1tm9 n TYR 105 Ca -0.03 0.90 -0.09 0.00 -0.16 0.00 0.00 57.90 58.52 1tm9 n TYR 105 Cb 0.15 -0.61 -0.08 0.00 -0.31 0.00 0.00 39.34 38.49 1tm9 n TYR 105 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1tm9 n HIS 106 N -4.94 -0.36 -2.73 -0.72 -0.00 0.67 -4.34 115.22 102.81 1tm9 n HIS 106 Ca 0.03 1.02 -0.05 0.00 0.46 0.00 0.00 57.72 59.18 1tm9 n HIS 106 Cb 0.21 -0.56 0.03 0.00 -0.12 0.00 0.00 29.99 29.55 1tm9 n HIS 106 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1tm9 n PHE 107 N -4.85 -2.64 0.00 1.57 1.16 0.14 -5.10 117.46 107.75 1tm9 n PHE 107 Ca 0.02 -1.22 0.00 0.00 -1.87 0.00 0.00 57.45 54.38 1tm9 n PHE 107 Cb 0.21 1.37 0.00 0.00 -1.61 0.00 0.00 39.48 39.46 1tm9 n PHE 107 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1tm9 n GLY 108 N 2.38 2.18 0.00 4.97 0.00 0.47 -4.84 105.19 110.35 1tm9 n GLY 108 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.60 1.61 3.01 -1.26 -5.00 117.46 114.22 1tm9 n PHE 109 Ca 0.00 0.00 -0.47 0.00 1.01 0.00 0.00 57.45 57.99 1tm9 n PHE 109 Cb 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 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 -2.31 1.92 -3.72 4.37 4.77 -1.26 -4.98 117.00 115.80 1tm9 n LEU 110 Ca 0.00 1.15 -0.12 0.00 -0.03 0.00 0.00 56.01 57.01 1tm9 n LEU 110 Cb 0.45 -1.28 -0.10 0.00 -2.33 0.00 0.00 43.42 40.16 1tm9 n LEU 110 CO 0.00 -1.17 0.06 -1.59 -1.33 0.00 0.00 177.39 173.36 1tm9 s LYS 111 N -0.75 0.43 -0.39 3.23 0.00 -1.26 -4.40 119.74 116.60 1tm9 s LYS 111 Ca 0.68 0.64 0.03 0.00 0.00 0.00 0.00 55.97 57.32 1tm9 s LYS 111 Cb -0.77 0.12 0.29 0.00 0.00 0.00 0.00 37.83 37.47 1tm9 s LYS 111 CO 0.54 -0.10 1.17 -3.47 0.00 0.00 0.00 175.35 173.50 1tm9 n ASP 112 N 3.44 -1.85 -3.05 0.03 2.03 -1.26 -4.91 116.55 110.97 1tm9 n ASP 112 Ca -0.17 -2.51 -0.00 0.00 0.52 0.00 0.00 54.79 52.62 1tm9 n ASP 112 Cb 0.56 1.31 -0.00 0.00 -0.72 0.00 0.00 41.12 42.27 1tm9 n ASP 112 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1tm9 n ASN 113 N 1.09 -6.61 -4.97 1.67 3.02 -1.26 -4.86 115.26 103.35 1tm9 n ASN 113 Ca 0.02 0.77 -0.22 0.00 -0.03 0.00 0.00 54.58 55.12 1tm9 n ASN 113 Cb 0.70 -2.38 0.02 0.00 -0.61 0.00 0.00 39.78 37.51 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 -0.81 5.64 -0.66 6.41 4.22 -1.26 -4.62 114.94 123.86 1tm9 s ASN 114 Ca -0.02 0.10 -0.04 0.00 -2.14 0.00 0.00 52.86 50.76 1tm9 s ASN 114 Cb 0.00 -1.23 -0.04 0.00 1.28 0.00 0.00 41.25 41.26 1tm9 s ASN 114 CO 0.17 -0.84 0.58 0.29 -2.04 0.00 0.00 177.10 175.26 1tm9 n LYS 115 N -2.12 -1.48 -2.66 3.55 4.76 -1.26 -4.98 118.16 113.97 1tm9 n LYS 115 Ca 0.04 0.55 -0.03 0.00 -2.87 0.00 0.00 58.31 55.99 1tm9 n LYS 115 Cb 0.58 -4.23 0.05 0.00 -1.84 0.00 0.00 35.03 29.59 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 -2.60 0.17 -3.91 1.97 2.85 -1.26 -4.95 118.16 110.43 1tm9 n LYS 116 Ca -0.05 -0.72 -0.31 0.00 -1.05 0.00 0.00 58.31 56.18 1tm9 n LYS 116 Cb 0.58 -0.09 -0.03 0.00 -0.65 0.00 0.00 35.03 34.84 1tm9 n LYS 116 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1tm9 n GLN 117 N 0.00 -2.68 -2.21 -1.58 10.64 -1.26 -4.92 117.38 115.37 1tm9 n GLN 117 Ca -0.16 0.32 -0.17 0.00 -1.83 0.00 0.00 57.00 55.15 1tm9 n GLN 117 Cb 0.71 -4.99 0.08 0.00 -0.86 0.00 0.00 30.24 25.18 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 -4.03 0.00 -0.24 -0.39 0.13 -1.26 -4.74 119.36 108.83 1tm9 n ILE 118 Ca 0.06 -1.28 -0.08 0.00 -1.10 0.00 0.00 62.75 60.35 1tm9 n ILE 118 Cb 0.49 -0.92 -0.07 0.00 -0.84 0.00 0.00 39.64 38.30 1tm9 n ILE 118 CO 0.00 0.00 0.00 0.40 2.80 0.00 0.00 176.55 179.75 1tm9 h ILE 119 N -0.42 0.00 -1.22 9.51 1.08 -1.89 1.63 117.51 126.20 1tm9 h ILE 119 Ca -0.25 0.00 0.39 0.00 -0.39 0.00 0.00 64.86 64.61 1tm9 h ILE 119 Cb 0.95 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.58 1tm9 h ILE 119 CO 0.28 0.00 0.77 0.50 -0.69 0.00 0.00 178.15 179.01 1tm9 h LYS 120 N -0.08 0.16 -0.22 2.37 3.64 -1.94 1.72 116.57 122.22 1tm9 h LYS 120 Ca 0.10 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.37 1tm9 h LYS 120 Cb 0.33 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1tm9 h LYS 120 CO -0.60 0.11 -0.22 -0.22 -2.27 0.00 0.00 179.45 176.25 1tm9 h LYS 121 N 0.16 0.54 0.30 1.90 1.63 0.18 -1.93 116.57 119.35 1tm9 h LYS 121 Ca 0.77 -0.29 -0.01 0.00 -0.85 0.00 0.00 60.65 60.27 1tm9 h LYS 121 Cb 2.26 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.90 1tm9 h LYS 121 CO -0.43 0.87 -0.14 0.00 -3.45 0.00 0.00 179.45 176.30 1tm9 h ALA 122 N 0.66 -0.79 -1.34 5.00 0.00 0.65 0.31 119.26 123.73 1tm9 h ALA 122 Ca 0.03 -0.09 0.44 0.00 0.00 0.00 0.00 54.91 55.29 1tm9 h ALA 122 Cb 0.77 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.59 1tm9 h ALA 122 CO 0.05 -0.76 0.88 1.88 0.00 0.00 0.00 179.25 181.30 1tm9 h TYR 123 N -0.53 0.49 -0.10 0.00 0.05 0.33 1.61 116.97 118.81 1tm9 h TYR 123 Ca -0.04 0.02 -0.23 0.00 0.05 0.00 0.00 58.73 58.53 1tm9 h TYR 123 Cb 0.30 -0.12 0.01 0.00 1.01 0.00 0.00 36.73 37.94 1tm9 h TYR 123 CO 0.09 -0.19 -0.85 1.49 -1.05 0.00 0.00 178.16 177.65 1tm9 h GLU 124 N 0.09 0.72 -0.46 4.88 4.57 -1.24 0.15 114.58 123.29 1tm9 h GLU 124 Ca 0.82 -0.65 0.13 0.00 -1.18 0.00 0.00 59.36 58.48 1tm9 h GLU 124 Cb 2.60 0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 31.33 1tm9 h GLU 124 CO -0.39 1.25 0.38 0.00 -1.18 0.00 0.00 179.01 179.07 1tm9 h THR 125 N 0.47 0.58 0.00 0.32 1.03 0.45 0.19 112.91 115.96 1tm9 h THR 125 Ca -0.07 0.00 -0.07 0.00 -0.01 0.00 0.00 66.41 66.26 1tm9 h THR 125 Cb 1.49 0.72 -0.01 0.00 -1.07 0.00 0.00 68.15 69.27 1tm9 h THR 125 CO 0.17 0.00 -0.87 -0.38 -0.01 0.00 0.00 175.52 174.43 1tm9 n ILE 126 N -4.10 1.46 -0.63 0.00 5.41 -0.87 -2.44 119.36 118.19 1tm9 n ILE 126 Ca 0.08 0.12 0.50 0.00 1.00 0.00 0.00 62.75 64.45 1tm9 n ILE 126 Cb 0.58 -2.30 0.78 0.00 -0.71 0.00 0.00 39.64 37.99 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 -0.92 3.73 0.00 -1.39 0.00 -0.68 1.49 119.26 121.49 1tm9 h ALA 127 Ca -0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1tm9 h ALA 127 Cb 0.81 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1tm9 h ALA 127 CO -0.06 -2.31 -0.51 0.22 0.00 0.00 0.00 179.25 176.59 1tm9 h ASP 128 N 0.00 0.00 -0.77 0.00 3.58 -1.12 -3.23 116.42 114.89 1tm9 h ASP 128 Ca 0.87 -0.14 0.17 0.00 0.42 0.00 0.00 57.03 58.34 1tm9 h ASP 128 Cb 3.60 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 44.53 1tm9 h ASP 128 CO -0.01 0.84 0.20 -1.13 -2.88 0.00 0.00 179.24 176.27 1tm9 h ASN 129 N -1.00 0.04 -0.21 2.28 -1.24 0.04 1.28 115.58 116.78 1tm9 h ASN 129 Ca -0.06 0.15 0.04 0.00 0.71 0.00 0.00 56.30 57.14 1tm9 h ASN 129 Cb 0.57 0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.81 1tm9 h ASN 129 CO -0.04 -0.04 0.14 -0.29 -1.29 0.00 0.00 177.43 175.91 1tm9 h ILE 130 N 0.28 0.96 -0.01 2.57 2.10 0.17 0.79 117.51 124.37 1tm9 h ILE 130 Ca 0.44 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 66.34 1tm9 h ILE 130 Cb 0.77 0.83 0.00 0.00 -1.09 0.00 0.00 36.82 37.34 1tm9 h ILE 130 CO -0.53 0.02 0.00 0.00 -1.08 0.00 0.00 178.15 176.56 1tm9 n ALA 131 N -2.55 2.64 0.10 0.18 0.00 0.43 -2.63 120.51 118.68 1tm9 n ALA 131 Ca 0.01 -0.18 0.06 0.00 0.00 0.00 0.00 53.44 53.34 1tm9 n ALA 131 Cb 0.20 -1.39 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 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 0.14 0.00 0.00 0.00 3.58 0.14 -3.35 116.42 116.93 1tm9 h ASP 132 Ca 0.00 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.27 1tm9 h ASP 132 Cb 0.03 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.05 1tm9 h ASP 132 CO 0.00 0.28 -2.09 0.00 -2.88 0.00 0.00 179.24 174.55 1tm9 n TYR 133 N -2.89 0.00 0.00 0.28 0.18 -1.10 -4.69 117.16 108.94 1tm9 n TYR 133 Ca -0.03 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.75 1tm9 n TYR 133 Cb 0.68 -0.70 0.00 0.00 -0.38 0.00 0.00 39.34 38.94 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 -2.45 0.00 0.00 -3.48 4.77 -1.08 -4.78 117.00 109.98 1tm9 n LEU 134 Ca -0.18 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1tm9 n LEU 134 Cb 0.83 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 1tm9 n LEU 134 CO 0.40 0.00 0.00 -3.20 -1.33 0.00 0.00 177.39 173.26 1tm9 n ASN 135 N -0.65 0.00 -2.08 -1.43 5.15 -1.26 -4.58 115.26 110.41 1tm9 n ASN 135 Ca 0.00 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 53.95 1tm9 n ASN 135 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1tm9 n ASN 135 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1tm9 n GLU 136 N 0.00 -1.09 0.00 1.20 2.13 -1.26 -5.18 120.64 116.44 1tm9 n GLU 136 Ca 0.00 1.24 0.13 0.00 0.66 0.00 0.00 57.16 59.18 1tm9 n GLU 136 Cb 0.00 -3.28 0.26 0.00 0.27 0.00 0.00 31.44 28.70 1tm9 n GLU 136 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99