#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tm9 n GLU 2 N 0.00 0.00 0.00 0.03 4.07 -1.26 -4.97 120.64 118.51 1tm9 n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1tm9 n GLU 2 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1tm9 n GLU 2 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1tm9 n GLN 3 N -1.86 0.00 -3.59 5.31 1.13 -1.26 -4.98 117.38 112.14 1tm9 n GLN 3 Ca 0.00 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 54.77 1tm9 n GLN 3 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.31 1tm9 n GLN 3 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1tm9 s ASN 4 N -4.00 6.43 0.00 1.08 0.01 -1.26 -3.67 114.94 113.52 1tm9 s ASN 4 Ca 0.00 0.53 0.00 0.00 -0.71 0.00 0.00 52.86 52.68 1tm9 s ASN 4 Cb 0.00 -2.07 0.00 0.00 0.41 0.00 0.00 41.25 39.59 1tm9 s ASN 4 CO 0.00 -0.06 0.00 0.59 -1.51 0.00 0.00 177.10 176.12 1tm9 n ASN 5 N -0.56 0.00 0.00 -1.22 4.13 -1.26 -4.30 115.26 112.04 1tm9 n ASN 5 Ca -0.03 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.23 1tm9 n ASN 5 Cb 0.53 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.77 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 0.00 0.00 -0.33 2.41 2.08 -1.26 0.19 119.36 122.44 1tm9 n ILE 6 Ca 0.00 1.00 0.21 0.00 0.56 0.00 0.00 62.75 64.52 1tm9 n ILE 6 Cb 0.00 -1.75 0.39 0.00 -0.75 0.00 0.00 39.64 37.54 1tm9 n ILE 6 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1tm9 n LYS 7 N -0.76 -0.07 -0.08 0.38 0.00 -1.24 0.19 118.16 116.58 1tm9 n LYS 7 Ca 0.00 1.44 -0.07 0.00 0.00 0.00 0.00 58.31 59.68 1tm9 n LYS 7 Cb 0.00 -2.40 -0.00 0.00 0.00 0.00 0.00 35.03 32.63 1tm9 n LYS 7 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1tm9 h GLU 8 N 0.00 0.20 -0.82 1.64 5.08 -1.55 -1.31 114.58 117.81 1tm9 h GLU 8 Ca 0.69 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 59.11 1tm9 h GLU 8 Cb 1.58 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.73 1tm9 h GLU 8 CO -0.87 0.13 0.54 1.96 -1.00 0.00 0.00 179.01 179.76 1tm9 h GLN 9 N 0.20 0.84 -0.56 2.33 4.20 1.32 -0.90 115.11 122.55 1tm9 h GLN 9 Ca 0.13 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.84 1tm9 h GLN 9 Cb 0.11 -0.19 -0.05 0.00 0.30 0.00 0.00 27.48 27.65 1tm9 h GLN 9 CO -0.15 0.56 0.29 -0.07 -0.67 0.00 0.00 178.83 178.79 1tm9 h LEU 10 N 0.87 0.41 0.10 1.46 3.38 0.01 -2.28 115.31 119.26 1tm9 h LEU 10 Ca 0.36 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.39 1tm9 h LEU 10 Cb 0.29 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1tm9 h LEU 10 CO -0.13 0.28 -0.38 0.40 0.09 0.00 0.00 178.44 178.69 1tm9 h ILE 11 N 0.55 0.22 -0.53 1.22 5.03 -0.70 -2.67 117.51 120.63 1tm9 h ILE 11 Ca 0.25 0.00 0.05 0.00 -0.12 0.00 0.00 64.86 65.04 1tm9 h ILE 11 Cb 0.16 0.22 -0.07 0.00 -3.03 0.00 0.00 36.82 34.10 1tm9 h ILE 11 CO -0.17 0.00 -0.40 0.28 -0.68 0.00 0.00 178.15 177.17 1tm9 h SER 12 N -0.60 -1.43 0.00 1.72 0.02 -1.16 0.03 113.55 112.13 1tm9 h SER 12 Ca 0.03 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1tm9 h SER 12 Cb 0.64 0.62 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1tm9 h SER 12 CO -0.23 -0.21 0.00 0.49 -1.14 0.00 0.00 176.83 175.74 1tm9 n PHE 13 N -4.57 0.00 -0.21 3.45 3.72 -0.94 -0.94 117.46 117.97 1tm9 n PHE 13 Ca -0.00 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.49 1tm9 n PHE 13 Cb 0.21 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 38.92 1tm9 n PHE 13 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1tm9 n PHE 14 N -0.06 0.38 -0.32 1.38 3.72 -1.13 0.25 117.46 121.68 1tm9 n PHE 14 Ca 0.00 0.74 0.18 0.00 -0.05 0.00 0.00 57.45 58.32 1tm9 n PHE 14 Cb 0.00 -0.96 0.34 0.00 -0.94 0.00 0.00 39.48 37.93 1tm9 n PHE 14 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1tm9 n ASN 15 N -4.79 -0.01 -1.89 4.37 5.15 -0.01 0.14 115.26 118.22 1tm9 n ASN 15 Ca 0.14 1.61 -0.10 0.00 -0.60 0.00 0.00 54.58 55.64 1tm9 n ASN 15 Cb 0.47 -0.63 -0.10 0.00 -0.53 0.00 0.00 39.78 38.98 1tm9 n ASN 15 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1tm9 n GLN 16 N -5.36 1.73 0.00 1.20 6.02 0.70 -4.09 117.38 117.58 1tm9 n GLN 16 Ca 0.26 -0.85 0.00 0.00 -0.01 0.00 0.00 57.00 56.39 1tm9 n GLN 16 Cb 0.85 -1.70 0.00 0.00 1.02 0.00 0.00 30.24 30.41 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 1.95 0.01 -3.64 -1.58 0.00 0.37 -4.52 120.51 113.10 1tm9 n ALA 17 Ca 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.73 1tm9 n ALA 17 Cb 0.75 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.16 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 5.40 0.06 -2.52 0.00 7.64 -1.26 -4.70 113.62 118.23 1tm9 n SER 19 Ca -0.12 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 58.01 1tm9 n SER 19 Cb 0.49 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 1tm9 n SER 19 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1tm9 n THR 20 N 0.05 0.00 -0.03 0.44 -2.24 -1.26 -5.05 114.28 106.19 1tm9 n THR 20 Ca -0.01 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.72 1tm9 n THR 20 Cb 0.69 -1.82 -0.02 0.00 -2.10 0.00 0.00 70.33 67.08 1tm9 n THR 20 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1tm9 n HIS 21 N -1.23 0.00 0.10 4.78 8.25 -1.26 -4.43 115.22 121.43 1tm9 n HIS 21 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.33 1tm9 n HIS 21 Cb 0.00 -0.21 -0.08 0.00 1.12 0.00 0.00 29.99 30.81 1tm9 n HIS 21 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1tm9 h GLN 22 N -0.10 -0.22 -0.83 -0.41 4.20 -2.00 -2.44 115.11 113.31 1tm9 h GLN 22 Ca -0.14 0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.73 1tm9 h GLN 22 Cb 1.17 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.93 1tm9 h GLN 22 CO -0.05 0.02 0.54 0.93 -0.67 0.00 0.00 178.83 179.60 1tm9 h GLU 23 N -0.44 0.59 0.42 1.46 5.08 -1.98 -1.13 114.58 118.58 1tm9 h GLU 23 Ca -0.02 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1tm9 h GLU 23 Cb 0.34 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1tm9 h GLU 23 CO 0.04 0.39 -0.22 0.00 -1.00 0.00 0.00 179.01 178.22 1tm9 h ARG 24 N 0.61 -0.57 -0.47 2.33 3.08 -1.70 0.71 114.38 118.37 1tm9 h ARG 24 Ca 0.41 0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.59 1tm9 h ARG 24 Cb 0.72 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.88 1tm9 h ARG 24 CO -0.17 -0.38 0.32 -0.07 -1.07 0.00 0.00 179.97 178.61 1tm9 h LEU 25 N -0.59 0.21 -0.07 3.04 3.38 -0.83 0.60 115.31 121.05 1tm9 h LEU 25 Ca -0.05 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1tm9 h LEU 25 Cb 0.46 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1tm9 h LEU 25 CO 0.08 0.13 -0.22 0.44 0.09 0.00 0.00 178.44 178.96 1tm9 h ASP 26 N 0.23 0.00 0.36 -0.43 3.32 -0.38 -3.33 116.42 116.20 1tm9 h ASP 26 Ca 0.22 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 1tm9 h ASP 26 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1tm9 h ASP 26 CO -0.04 0.22 -0.17 0.15 -1.72 0.00 0.00 179.24 177.68 1tm9 h PHE 27 N 0.00 -0.44 -1.92 4.55 3.57 0.59 0.11 116.94 123.40 1tm9 h PHE 27 Ca -0.00 -0.01 0.56 0.00 3.53 0.00 0.00 57.97 62.05 1tm9 h PHE 27 Cb 1.14 0.15 -0.08 0.00 2.79 0.00 0.00 35.95 39.95 1tm9 h PHE 27 CO 0.00 -0.28 1.38 0.44 -2.23 0.00 0.00 178.31 177.63 1tm9 n ILE 28 N -4.85 -0.01 0.00 1.41 -5.35 -0.44 0.19 119.36 110.31 1tm9 n ILE 28 Ca -0.06 1.47 0.00 0.00 -0.27 0.00 0.00 62.75 63.89 1tm9 n ILE 28 Cb 0.19 -2.44 0.00 0.00 -1.74 0.00 0.00 39.64 35.64 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 -1.45 -0.61 -0.36 0.00 7.64 0.38 0.39 113.62 119.61 1tm9 n SER 30 Ca 0.00 1.70 -0.04 0.00 1.01 0.00 0.00 58.87 61.54 1tm9 n SER 30 Cb 0.00 -0.40 -0.01 0.00 -1.01 0.00 0.00 64.21 62.80 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 -5.44 -0.52 -1.24 0.44 -1.04 0.51 0.19 114.28 107.16 1tm9 n THR 31 Ca 0.10 2.14 -0.19 0.00 -2.04 0.00 0.00 64.05 64.06 1tm9 n THR 31 Cb 0.40 -2.77 0.20 0.00 -1.82 0.00 0.00 70.33 66.33 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 -5.27 2.34 -2.69 -2.82 0.63 0.13 -4.47 116.66 104.51 1tm9 n ARG 32 Ca 0.07 -3.04 -0.06 0.00 -0.92 0.00 0.00 57.85 53.90 1tm9 n ARG 32 Cb 0.32 -2.13 0.09 0.00 0.45 0.00 0.00 32.46 31.19 1tm9 n ARG 32 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1tm9 n GLU 33 N -1.05 0.47 0.00 -0.14 4.07 0.50 -4.99 120.64 119.49 1tm9 n GLU 33 Ca 0.54 -1.17 0.00 0.00 -0.06 0.00 0.00 57.16 56.47 1tm9 n GLU 33 Cb 1.56 -0.57 0.00 0.00 -0.06 0.00 0.00 31.44 32.38 1tm9 n GLU 33 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1tm9 n SER 34 N 0.76 0.00 0.07 4.31 3.41 0.28 -4.07 113.62 118.37 1tm9 n SER 34 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1tm9 n SER 34 Cb 0.72 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.67 1tm9 n SER 34 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1tm9 n ASP 35 N 0.00 -1.24 0.00 4.04 8.00 -1.26 -4.94 116.55 121.15 1tm9 n ASP 35 Ca 0.00 0.42 0.11 0.00 0.71 0.00 0.00 54.79 56.03 1tm9 n ASP 35 Cb 0.00 1.39 -0.15 0.00 -0.02 0.00 0.00 41.12 42.35 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 -2.71 0.05 -1.02 -3.53 5.66 -1.26 -4.95 114.28 106.52 1tm9 n THR 36 Ca 0.00 -0.45 -0.01 0.00 -3.05 0.00 0.00 64.05 60.54 1tm9 n THR 36 Cb 0.00 0.07 -0.00 0.00 -1.55 0.00 0.00 70.33 68.85 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 -2.21 0.00 -0.31 1.09 3.72 -1.26 -4.69 117.46 113.80 1tm9 n PHE 37 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1tm9 n PHE 37 Cb 0.54 -1.68 0.00 0.00 -0.94 0.00 0.00 39.48 37.40 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 -0.81 0.76 -0.18 4.37 2.88 -1.26 -4.65 113.62 114.74 1tm9 n SER 38 Ca -0.01 -1.07 0.06 0.00 -1.33 0.00 0.00 58.87 56.52 1tm9 n SER 38 Cb 0.41 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 63.95 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 -0.03 1.55 0.00 -3.46 7.64 -1.26 -4.81 113.62 113.24 1tm9 n SER 39 Ca 0.00 -2.59 0.00 0.00 1.01 0.00 0.00 58.87 57.29 1tm9 n SER 39 Cb 0.10 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 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 -0.88 0.00 0.06 0.44 0.31 -1.26 -4.92 118.33 112.08 1tm9 n VAL 40 Ca 0.09 0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1tm9 n VAL 40 Cb 0.61 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.64 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 0.00 -0.05 -4.76 4.52 -0.08 -1.26 -5.09 116.55 109.83 1tm9 n ASP 41 Ca 0.00 0.21 -0.41 0.00 -1.51 0.00 0.00 54.79 53.08 1tm9 n ASP 41 Cb 0.00 0.17 0.00 0.00 2.34 0.00 0.00 41.12 43.63 1tm9 n ASP 41 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 1tm9 n VAL 42 N -2.94 2.08 -2.54 5.18 3.14 -1.26 -4.95 118.33 117.03 1tm9 n VAL 42 Ca 0.00 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.53 1tm9 n VAL 42 Cb 0.01 -1.87 -0.04 0.00 -1.06 0.00 0.00 33.84 30.89 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 -2.09 3.99 0.07 1.45 0.04 -1.26 -4.88 135.00 132.32 1tm9 s PRO 43 Ca 0.54 1.45 0.04 0.00 0.04 0.00 0.00 61.00 63.07 1tm9 s PRO 43 Cb -0.49 -2.33 -0.24 0.00 0.04 0.00 0.00 34.50 31.47 1tm9 s PRO 43 CO 0.63 -0.28 1.09 -0.07 0.04 0.00 0.00 177.00 178.41 1tm9 h LEU 44 N 2.06 0.15 -0.73 -3.56 3.38 -1.92 -2.87 115.31 111.82 1tm9 h LEU 44 Ca -0.49 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 57.39 1tm9 h LEU 44 Cb 1.22 -0.05 -0.11 0.00 0.09 0.00 0.00 40.66 41.81 1tm9 h LEU 44 CO 0.61 1.15 -0.50 -0.33 0.09 0.00 0.00 178.44 179.45 1tm9 h GLU 45 N 0.03 -0.16 -0.02 1.13 5.08 -1.96 1.62 114.58 120.30 1tm9 h GLU 45 Ca -0.11 0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.15 1tm9 h GLU 45 Cb 1.89 0.04 0.01 0.00 0.50 0.00 0.00 28.75 31.18 1tm9 h GLU 45 CO 0.14 -0.10 -0.39 -1.00 -1.00 0.00 0.00 179.01 176.66 1tm9 h PRO 46 N -0.16 0.31 -0.55 2.33 0.13 -1.80 -3.21 132.00 129.05 1tm9 h PRO 46 Ca 0.17 -0.30 0.11 0.00 -0.87 0.00 0.00 66.00 65.12 1tm9 h PRO 46 Cb 0.53 0.08 -0.10 0.00 0.13 0.00 0.00 31.00 31.64 1tm9 h PRO 46 CO -0.79 0.98 -0.10 0.82 -0.23 0.00 0.00 178.00 178.68 1tm9 h ILE 47 N -0.26 0.48 0.00 -3.56 1.08 -1.15 1.76 117.51 115.87 1tm9 h ILE 47 Ca -0.04 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1tm9 h ILE 47 Cb 1.10 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.30 1tm9 h ILE 47 CO 0.08 0.00 0.03 0.11 -0.69 0.00 0.00 178.15 177.68 1tm9 h LYS 48 N 0.03 0.00 0.09 2.37 1.57 0.23 0.51 116.57 121.37 1tm9 h LYS 48 Ca 0.27 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.79 1tm9 h LYS 48 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1tm9 h LYS 48 CO -0.54 0.00 -1.13 -0.97 -0.57 0.00 0.00 179.45 176.24 1tm9 h ASN 49 N 0.00 0.44 0.39 0.86 -0.73 0.27 -3.30 115.58 113.51 1tm9 h ASN 49 Ca 0.00 -0.43 -0.32 0.00 1.87 0.00 0.00 56.30 57.42 1tm9 h ASN 49 Cb 0.06 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 38.50 1tm9 h ASN 49 CO 0.00 1.29 -1.63 0.16 -0.37 0.00 0.00 177.43 176.88 1tm9 h ILE 50 N 0.12 1.03 -0.64 2.57 3.07 0.18 -3.29 117.51 120.55 1tm9 h ILE 50 Ca -0.11 -2.70 0.19 0.00 1.55 0.00 0.00 64.86 63.78 1tm9 h ILE 50 Cb 1.83 2.69 -0.03 0.00 -0.27 0.00 0.00 36.82 41.04 1tm9 h ILE 50 CO 0.19 0.80 0.81 0.40 -1.05 0.00 0.00 178.15 179.29 1tm9 h ILE 51 N 0.06 0.16 -0.43 0.16 2.04 -0.26 0.86 117.51 120.10 1tm9 h ILE 51 Ca -0.28 0.00 -0.27 0.00 1.00 0.00 0.00 64.86 65.31 1tm9 h ILE 51 Cb 2.02 0.33 -0.13 0.00 -0.74 0.00 0.00 36.82 38.31 1tm9 h ILE 51 CO 0.14 0.00 0.35 -0.62 0.00 0.00 0.00 178.15 178.02 1tm9 n GLU 52 N -3.38 1.67 -0.06 2.37 1.02 -1.24 -3.69 120.64 117.33 1tm9 n GLU 52 Ca 0.13 -1.38 -0.07 0.00 -0.02 0.00 0.00 57.16 55.82 1tm9 n GLU 52 Cb 1.03 -1.54 -0.06 0.00 -0.02 0.00 0.00 31.44 30.84 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 0.24 0.69 -1.08 -3.67 0.13 0.30 -4.54 119.36 111.42 1tm9 n ILE 53 Ca 0.27 -0.33 -0.02 0.00 -1.10 0.00 0.00 62.75 61.57 1tm9 n ILE 53 Cb 0.71 -0.86 0.29 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 -2.65 2.75 0.05 9.51 -2.24 -1.24 -4.41 114.28 116.05 1tm9 n THR 54 Ca -0.19 -1.83 -0.10 0.00 -2.27 0.00 0.00 64.05 59.66 1tm9 n THR 54 Cb 0.77 -0.33 0.03 0.00 -2.10 0.00 0.00 70.33 68.70 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 2.34 0.40 -7.37 -0.78 2.10 -1.80 -3.41 116.57 108.05 1tm9 h LYS 55 Ca 0.19 -0.32 -0.45 0.00 -2.00 0.00 0.00 60.65 58.07 1tm9 h LYS 55 Cb 2.05 0.07 0.16 0.00 -0.90 0.00 0.00 32.23 33.60 1tm9 h LYS 55 CO 0.58 0.96 0.20 -0.51 -2.00 0.00 0.00 179.45 178.68 1tm9 s ASP 56 N -6.97 2.70 -0.19 7.07 1.01 -1.26 -4.99 116.67 114.05 1tm9 s ASP 56 Ca -0.06 1.18 -0.21 0.00 0.71 0.00 0.00 52.55 54.18 1tm9 s ASP 56 Cb 0.11 -1.84 -0.18 0.00 1.01 0.00 0.00 42.92 42.02 1tm9 s ASP 56 CO 0.84 -3.08 0.23 -0.08 0.21 0.00 0.00 175.17 173.28 1tm9 h GLU 57 N -1.86 0.00 0.00 8.23 4.81 -1.97 -3.19 114.58 120.60 1tm9 h GLU 57 Ca -0.54 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1tm9 h GLU 57 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 1tm9 h GLU 57 CO 0.58 0.87 0.05 -0.97 -0.73 0.00 0.00 179.01 178.80 1tm9 h ASN 58 N -1.00 0.00 0.07 1.04 -1.24 -1.98 -1.94 115.58 110.53 1tm9 h ASN 58 Ca -0.26 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.74 1tm9 h ASN 58 Cb 1.15 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.20 1tm9 h ASN 58 CO -0.16 0.00 -0.03 1.56 -1.29 0.00 0.00 177.43 177.51 1tm9 h GLN 59 N 0.00 -0.09 -0.94 6.67 7.50 -1.91 -2.48 115.11 123.87 1tm9 h GLN 59 Ca 0.00 0.01 0.21 0.00 0.50 0.00 0.00 58.65 59.36 1tm9 h GLN 59 Cb 0.09 0.02 -0.11 0.00 0.05 0.00 0.00 27.48 27.53 1tm9 h GLN 59 CO 0.00 0.29 0.51 -0.56 -1.50 0.00 0.00 178.83 177.58 1tm9 h GLN 60 N -0.98 0.57 0.63 1.46 3.07 -1.36 1.16 115.11 119.65 1tm9 h GLN 60 Ca -0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 58.65 58.67 1tm9 h GLN 60 Cb 0.42 -0.13 0.01 0.00 0.08 0.00 0.00 27.48 27.86 1tm9 h GLN 60 CO 0.02 0.37 -0.30 0.82 0.09 0.00 0.00 178.83 179.83 1tm9 h ILE 61 N 0.58 0.00 -0.85 1.86 2.04 -1.53 0.18 117.51 119.80 1tm9 h ILE 61 Ca 0.57 -0.14 0.17 0.00 1.00 0.00 0.00 64.86 66.46 1tm9 h ILE 61 Cb 0.99 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 1tm9 h ILE 61 CO -0.45 0.00 0.56 -0.08 0.00 0.00 0.00 178.15 178.18 1tm9 h GLU 62 N -0.99 0.44 0.08 2.37 4.57 -0.85 -0.21 114.58 119.99 1tm9 h GLU 62 Ca -0.09 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1tm9 h GLU 62 Cb 0.65 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1tm9 h GLU 62 CO 0.14 0.29 -0.04 0.82 -1.18 0.00 0.00 179.01 179.04 1tm9 h ILE 63 N 0.45 1.01 -0.55 2.32 2.04 0.15 0.26 117.51 123.20 1tm9 h ILE 63 Ca 0.43 -0.31 0.07 0.00 1.00 0.00 0.00 64.86 66.05 1tm9 h ILE 63 Cb 0.99 1.21 -0.10 0.00 -0.74 0.00 0.00 36.82 38.18 1tm9 h ILE 63 CO -0.16 0.08 -0.51 0.74 0.00 0.00 0.00 178.15 178.30 1tm9 h THR 64 N -0.24 0.04 -0.49 -0.27 2.02 0.91 0.75 112.91 115.62 1tm9 h THR 64 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1tm9 h THR 64 Cb 0.21 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.63 1tm9 h THR 64 CO 0.02 0.00 0.26 0.11 0.37 0.00 0.00 175.52 176.28 1tm9 h LYS 65 N -0.28 0.69 -0.63 6.66 6.56 -1.41 -2.34 116.57 125.82 1tm9 h LYS 65 Ca 0.13 -0.08 0.13 0.00 -1.06 0.00 0.00 60.65 59.76 1tm9 h LYS 65 Cb 0.56 -0.13 -0.10 0.00 -0.57 0.00 0.00 32.23 31.99 1tm9 h LYS 65 CO -0.68 0.55 0.05 0.82 -2.06 0.00 0.00 179.45 178.13 1tm9 h ILE 66 N 0.65 0.53 -0.63 1.86 2.04 0.19 0.99 117.51 123.15 1tm9 h ILE 66 Ca 0.17 -0.06 0.08 0.00 1.00 0.00 0.00 64.86 66.06 1tm9 h ILE 66 Cb 0.06 0.35 -0.07 0.00 -0.74 0.00 0.00 36.82 36.42 1tm9 h ILE 66 CO -0.03 0.03 0.28 0.00 0.00 0.00 0.00 178.15 178.44 1tm9 h ALA 67 N 1.55 0.83 -0.16 1.87 0.00 0.91 0.12 119.26 124.38 1tm9 h ALA 67 Ca 0.33 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.20 1tm9 h ALA 67 Cb 0.53 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1tm9 h ALA 67 CO -0.49 -0.11 -0.35 0.28 0.00 0.00 0.00 179.25 178.57 1tm9 h VAL 68 N 0.50 1.29 -0.16 0.00 2.07 -0.18 0.93 116.25 120.70 1tm9 h VAL 68 Ca 0.30 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.40 1tm9 h VAL 68 Cb 0.32 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1tm9 h VAL 68 CO -0.26 0.43 0.04 -1.13 0.02 0.00 0.00 177.57 176.67 1tm9 h ASN 69 N 0.29 0.20 0.18 0.57 -1.24 0.33 1.22 115.58 117.14 1tm9 h ASN 69 Ca 0.03 -0.02 -0.35 0.00 0.71 0.00 0.00 56.30 56.67 1tm9 h ASN 69 Cb 0.76 -0.05 -0.04 0.00 0.73 0.00 0.00 38.32 39.72 1tm9 h ASN 69 CO 0.06 0.22 -2.05 -0.46 -1.29 0.00 0.00 177.43 173.91 1tm9 n ASN 70 N -4.44 1.60 -0.06 1.15 6.94 -0.22 -4.20 115.26 116.03 1tm9 n ASN 70 Ca -0.01 0.18 -0.11 0.00 -0.02 0.00 0.00 54.58 54.62 1tm9 n ASN 70 Cb 0.14 -0.42 -0.05 0.00 -2.36 0.00 0.00 39.78 37.09 1tm9 n ASN 70 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 1tm9 h ILE 71 N 0.04 1.22 -0.58 1.53 1.08 0.13 -1.75 117.51 119.17 1tm9 h ILE 71 Ca -0.43 -0.72 0.17 0.00 -0.39 0.00 0.00 64.86 63.49 1tm9 h ILE 71 Cb 2.03 1.31 -0.02 0.00 -3.07 0.00 0.00 36.82 37.07 1tm9 h ILE 71 CO 0.05 0.22 0.76 0.07 -0.69 0.00 0.00 178.15 178.56 1tm9 h LYS 72 N 0.13 0.00 0.06 2.37 2.10 0.13 1.54 116.57 122.91 1tm9 h LYS 72 Ca 0.06 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.40 1tm9 h LYS 72 Cb 0.30 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.60 1tm9 h LYS 72 CO 0.00 0.00 -1.69 1.15 -2.00 0.00 0.00 179.45 176.92 1tm9 h THR 73 N 0.00 0.93 0.00 0.07 2.02 -1.51 -3.30 112.91 111.12 1tm9 h THR 73 Ca 0.27 -2.68 0.00 0.00 0.77 0.00 0.00 66.41 64.77 1tm9 h THR 73 Cb 1.78 2.56 0.00 0.00 -1.74 0.00 0.00 68.15 70.75 1tm9 h THR 73 CO -0.00 0.71 0.27 -0.07 0.37 0.00 0.00 175.52 176.79 1tm9 h LEU 74 N 0.04 0.00 -3.42 2.58 3.38 0.29 -0.03 115.31 118.15 1tm9 h LEU 74 Ca -0.29 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.39 1tm9 h LEU 74 Cb 2.00 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.63 1tm9 h LEU 74 CO 0.11 0.00 0.37 -0.24 0.09 0.00 0.00 178.44 178.76 1tm9 n SER 75 N -2.89 6.33 -0.85 -0.43 2.88 -1.02 -3.42 113.62 114.22 1tm9 n SER 75 Ca -0.02 -2.99 -0.05 0.00 -1.33 0.00 0.00 58.87 54.48 1tm9 n SER 75 Cb 0.32 -1.07 -0.05 0.00 -0.75 0.00 0.00 64.21 62.66 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 0.48 -0.72 -4.81 -3.46 7.64 -0.02 -5.10 113.62 107.62 1tm9 n SER 76 Ca 0.26 -1.53 -0.31 0.00 1.01 0.00 0.00 58.87 58.30 1tm9 n SER 76 Cb 0.57 0.22 0.05 0.00 -1.01 0.00 0.00 64.21 64.04 1tm9 n SER 76 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1tm9 s VAL 77 N 0.00 3.91 0.07 0.44 1.01 -1.22 -4.91 120.40 119.71 1tm9 s VAL 77 Ca 0.00 0.65 -0.36 0.00 0.00 0.00 0.00 61.98 62.26 1tm9 s VAL 77 Cb 0.00 -3.33 -0.19 0.00 0.00 0.00 0.00 36.38 32.86 1tm9 s VAL 77 CO 0.00 -0.79 0.97 0.61 0.00 0.00 0.00 175.10 175.89 1tm9 n GLY 78 N -1.80 -0.53 0.00 4.51 0.00 -1.26 -4.89 105.19 101.22 1tm9 n GLY 78 Ca 0.08 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.73 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 1.23 -0.40 -1.49 4.61 0.00 -1.26 -4.53 120.51 118.66 1tm9 n ALA 79 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.24 1tm9 n ALA 79 Cb 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.44 1tm9 n ALA 79 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1tm9 n THR 80 N -1.93 0.00 -0.96 0.00 -2.24 -1.26 -4.06 114.28 103.82 1tm9 n THR 80 Ca 0.00 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1tm9 n THR 80 Cb 0.00 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.77 1tm9 n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tm9 n GLY 81 N 6.38 -4.02 1.47 3.38 0.00 -1.26 -4.70 105.19 106.44 1tm9 n GLY 81 Ca 0.66 -0.85 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 1tm9 n GLY 81 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tm9 n GLN 82 N -0.78 2.66 -1.09 1.61 1.13 -1.26 -4.77 117.38 114.89 1tm9 n GLN 82 Ca 0.00 -1.80 -0.39 0.00 -1.94 0.00 0.00 57.00 52.88 1tm9 n GLN 82 Cb 0.00 -1.84 -0.09 0.00 0.11 0.00 0.00 30.24 28.42 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1tm9 n TYR 83 N 0.04 1.20 0.31 1.08 4.02 -1.26 -4.64 117.16 117.90 1tm9 n TYR 83 Ca 0.23 -1.10 0.14 0.00 -0.01 0.00 0.00 57.90 57.17 1tm9 n TYR 83 Cb 0.95 -1.59 0.70 0.00 -0.02 0.00 0.00 39.34 39.38 1tm9 n TYR 83 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 176.86 177.83 1tm9 h MET 84 N 9.34 0.00 -0.88 -0.72 4.05 -1.94 -0.00 114.93 124.78 1tm9 h MET 84 Ca 0.29 0.00 0.20 0.00 -0.28 0.00 0.00 59.70 59.91 1tm9 h MET 84 Cb 0.76 0.00 -0.12 0.00 -0.80 0.00 0.00 31.60 31.44 1tm9 h MET 84 CO 1.78 0.00 0.40 0.00 0.23 0.00 0.00 176.91 179.32 1tm9 h ALA 85 N 1.15 1.40 -0.48 0.39 0.00 -1.98 0.77 119.26 120.51 1tm9 h ALA 85 Ca 0.02 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1tm9 h ALA 85 Cb 0.91 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1tm9 h ALA 85 CO -0.00 -0.29 0.10 0.77 0.00 0.00 0.00 179.25 179.83 1tm9 h SER 86 N 0.45 0.68 -0.94 0.00 0.02 -1.38 -2.31 113.55 110.06 1tm9 h SER 86 Ca 0.54 -0.12 0.18 0.00 -0.84 0.00 0.00 61.79 61.54 1tm9 h SER 86 Cb 0.97 -0.18 -0.08 0.00 0.14 0.00 0.00 62.40 63.25 1tm9 h SER 86 CO -0.49 0.68 0.60 0.15 -1.14 0.00 0.00 176.83 176.63 1tm9 h PHE 87 N 0.70 0.83 -0.93 3.45 3.57 0.43 0.17 116.94 125.17 1tm9 h PHE 87 Ca 0.16 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1tm9 h PHE 87 Cb 0.29 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.73 1tm9 h PHE 87 CO 0.01 0.24 0.61 0.74 -2.23 0.00 0.00 178.31 177.69 1tm9 h PHE 88 N 0.64 1.17 -0.00 0.41 -1.00 -1.13 -0.37 116.94 116.66 1tm9 h PHE 88 Ca 0.50 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 61.30 1tm9 h PHE 88 Cb 0.91 -0.39 0.00 0.00 3.61 0.00 0.00 35.95 40.07 1tm9 h PHE 88 CO -0.00 0.74 -0.01 1.03 -1.61 0.00 0.00 178.31 178.45 1tm9 h SER 89 N 1.26 0.02 -0.52 2.17 0.87 -0.84 -2.88 113.55 113.62 1tm9 h SER 89 Ca 0.34 -0.68 0.10 0.00 -1.23 0.00 0.00 61.79 60.32 1tm9 h SER 89 Cb -0.14 -0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 61.72 1tm9 h SER 89 CO -0.07 0.70 -0.12 0.71 -0.53 0.00 0.00 176.83 177.52 1tm9 h THR 90 N -0.67 0.49 -3.03 2.23 1.35 -0.75 -3.37 112.91 109.16 1tm9 h THR 90 Ca -0.00 -0.00 -0.48 0.00 -0.55 0.00 0.00 66.41 65.37 1tm9 h THR 90 Cb 0.70 0.48 -0.41 0.00 -1.73 0.00 0.00 68.15 67.19 1tm9 h THR 90 CO 0.00 0.00 -0.76 0.20 -0.25 0.00 0.00 175.52 174.72 1tm9 s ASN 91 N -5.23 2.69 -0.01 5.36 0.01 -0.17 -4.99 114.94 112.61 1tm9 s ASN 91 Ca -0.14 -0.80 -0.01 0.00 -0.71 0.00 0.00 52.86 51.21 1tm9 s ASN 91 Cb 0.17 -0.33 -0.27 0.00 0.41 0.00 0.00 41.25 41.24 1tm9 s ASN 91 CO 0.72 -0.36 0.80 0.28 -1.51 0.00 0.00 177.10 177.03 1tm9 h SER 92 N 8.39 0.32 -0.52 -1.22 0.02 -1.68 -2.80 113.55 116.05 1tm9 h SER 92 Ca -0.16 -0.48 0.09 0.00 -0.84 0.00 0.00 61.79 60.41 1tm9 h SER 92 Cb 1.12 -0.10 -0.10 0.00 0.14 0.00 0.00 62.40 63.45 1tm9 h SER 92 CO 0.33 1.40 -0.34 -0.33 -1.14 0.00 0.00 176.83 176.75 1tm9 h GLU 93 N 0.06 -0.19 -0.04 3.45 5.08 -1.94 1.14 114.58 122.13 1tm9 h GLU 93 Ca -0.25 0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 57.97 1tm9 h GLU 93 Cb 2.00 0.04 0.01 0.00 0.50 0.00 0.00 28.75 31.31 1tm9 h GLU 93 CO 0.14 -0.13 -0.57 -1.00 -1.00 0.00 0.00 179.01 176.45 1tm9 h PRO 94 N -0.20 0.45 -0.03 2.33 0.13 -1.97 -2.82 132.00 129.90 1tm9 h PRO 94 Ca 0.21 -0.44 0.01 0.00 -0.87 0.00 0.00 66.00 64.90 1tm9 h PRO 94 Cb 0.55 0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.79 1tm9 h PRO 94 CO -0.63 1.09 0.14 0.00 -0.23 0.00 0.00 178.00 178.37 1tm9 h ALA 95 N 0.38 1.26 0.03 -0.56 0.00 -1.11 -1.29 119.26 117.97 1tm9 h ALA 95 Ca -0.06 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1tm9 h ALA 95 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1tm9 h ALA 95 CO 0.12 -0.15 -0.02 0.82 0.00 0.00 0.00 179.25 180.02 1tm9 h ILE 96 N 0.00 0.00 -0.69 0.00 2.04 0.14 -2.58 117.51 116.42 1tm9 h ILE 96 Ca 0.01 -0.60 0.07 0.00 1.00 0.00 0.00 64.86 65.35 1tm9 h ILE 96 Cb 0.29 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.27 1tm9 h ILE 96 CO -0.00 0.00 -0.57 0.40 0.00 0.00 0.00 178.15 177.98 1tm9 h ILE 97 N -0.65 0.00 -0.53 -0.67 5.03 -1.19 0.24 117.51 119.75 1tm9 h ILE 97 Ca -0.00 0.00 0.11 0.00 -0.12 0.00 0.00 64.86 64.84 1tm9 h ILE 97 Cb 0.04 0.00 -0.09 0.00 -3.03 0.00 0.00 36.82 33.73 1tm9 h ILE 97 CO 0.01 0.00 -0.05 0.15 -0.68 0.00 0.00 178.15 177.57 1tm9 h PHE 98 N -0.21 -0.14 0.02 1.37 3.57 -1.42 0.16 116.94 120.30 1tm9 h PHE 98 Ca 0.12 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1tm9 h PHE 98 Cb 0.51 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 1tm9 h PHE 98 CO -0.87 -0.17 -0.22 0.00 -2.23 0.00 0.00 178.31 174.82 1tm9 h VAL 100 N -0.29 0.37 0.00 0.00 2.07 -0.21 1.08 116.25 119.27 1tm9 h VAL 100 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1tm9 h VAL 100 Cb 0.30 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1tm9 h VAL 100 CO -0.13 0.05 0.00 -0.38 0.02 0.00 0.00 177.57 177.13 1tm9 n ILE 101 N -4.68 0.00 -0.36 4.57 2.08 0.50 -2.51 119.36 118.96 1tm9 n ILE 101 Ca 0.30 0.65 0.37 0.00 0.56 0.00 0.00 62.75 64.63 1tm9 n ILE 101 Cb 1.07 -1.30 0.66 0.00 -0.75 0.00 0.00 39.64 39.33 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 0.00 0.87 1.39 3.20 0.24 0.14 116.97 122.82 1tm9 h TYR 102 Ca 0.00 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 1tm9 h TYR 102 Cb 0.00 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.28 1tm9 h TYR 102 CO 0.03 0.00 -0.42 0.35 -1.64 0.00 0.00 178.16 176.48 1tm9 h PHE 103 N 0.00 -1.09 0.00 -3.82 3.04 0.12 1.56 116.94 116.75 1tm9 h PHE 103 Ca 0.62 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.54 1tm9 h PHE 103 Cb 2.85 0.36 0.00 0.00 2.56 0.00 0.00 35.95 41.72 1tm9 h PHE 103 CO 0.00 -0.68 0.16 -0.07 -2.02 0.00 0.00 178.31 175.70 1tm9 h LEU 104 N -1.27 0.00 0.12 0.59 3.38 -0.42 0.12 115.31 117.82 1tm9 h LEU 104 Ca -0.12 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.49 1tm9 h LEU 104 Cb 0.90 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1tm9 h LEU 104 CO 0.20 0.00 -2.01 -1.22 0.09 0.00 0.00 178.44 175.50 1tm9 n TYR 105 N -2.74 1.20 1.84 1.13 4.01 -0.80 0.47 117.16 122.26 1tm9 n TYR 105 Ca -0.02 0.26 0.12 0.00 -0.16 0.00 0.00 57.90 58.10 1tm9 n TYR 105 Cb 0.21 -1.16 0.74 0.00 -0.31 0.00 0.00 39.34 38.82 1tm9 n TYR 105 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 1tm9 n HIS 106 N -3.46 0.00 0.00 -0.72 1.44 0.53 -3.72 115.22 109.29 1tm9 n HIS 106 Ca -0.32 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.39 1tm9 n HIS 106 Cb 1.05 0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.16 1tm9 n HIS 106 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1tm9 n PHE 107 N -0.92 0.00 0.00 -1.40 3.72 0.18 -4.77 117.46 114.26 1tm9 n PHE 107 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 1tm9 n PHE 107 Cb 0.09 0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 1tm9 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1tm9 n GLY 108 N 2.54 1.42 0.09 1.37 0.00 0.18 -5.06 105.19 105.73 1tm9 n GLY 108 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 1.16 -0.11 -1.96 1.61 3.72 0.62 -4.93 117.46 117.56 1tm9 n PHE 109 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1tm9 n PHE 109 Cb 0.00 0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 38.54 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 -2.06 4.38 0.09 4.37 0.20 -1.19 -4.96 118.68 119.51 1tm9 s LEU 110 Ca 0.00 2.69 -0.22 0.00 0.69 0.00 0.00 54.13 57.29 1tm9 s LEU 110 Cb 0.00 -3.62 -0.07 0.00 -0.43 0.00 0.00 46.19 42.07 1tm9 s LEU 110 CO 0.00 -0.76 0.66 -0.54 -0.29 0.00 0.00 176.35 175.43 1tm9 s LYS 111 N -0.05 4.37 0.16 1.98 -0.14 -1.26 -4.95 119.74 119.86 1tm9 s LYS 111 Ca 0.62 0.92 -0.23 0.00 -1.36 0.00 0.00 55.97 55.92 1tm9 s LYS 111 Cb -0.43 -3.27 0.08 0.00 -1.68 0.00 0.00 37.83 32.53 1tm9 s LYS 111 CO 0.41 0.55 1.06 0.34 -0.76 0.00 0.00 175.35 176.95 1tm9 s ASP 112 N -0.90 -0.00 0.71 2.83 2.15 -1.26 -4.72 116.67 115.47 1tm9 s ASP 112 Ca 0.33 -0.62 0.00 0.00 0.43 0.00 0.00 52.55 52.69 1tm9 s ASP 112 Cb -0.21 0.46 0.00 0.00 -0.30 0.00 0.00 42.92 42.88 1tm9 s ASP 112 CO 0.22 -0.92 0.00 0.59 -0.17 0.00 0.00 175.17 174.89 1tm9 n ASN 113 N -1.17 -1.42 -3.89 -0.34 4.13 -1.26 -4.90 115.26 106.40 1tm9 n ASN 113 Ca -0.03 0.00 -0.25 0.00 1.68 0.00 0.00 54.58 55.99 1tm9 n ASN 113 Cb 0.59 0.00 0.13 0.00 -1.54 0.00 0.00 39.78 38.96 1tm9 n ASN 113 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1tm9 n ASN 114 N -2.13 -2.73 0.00 6.41 4.13 -1.26 -4.83 115.26 114.86 1tm9 n ASN 114 Ca 0.00 -0.21 0.00 0.00 1.68 0.00 0.00 54.58 56.05 1tm9 n ASN 114 Cb 0.00 -0.76 0.00 0.00 -1.54 0.00 0.00 39.78 37.48 1tm9 n ASN 114 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 1tm9 n LYS 115 N -0.88 0.00 0.00 3.52 4.81 -1.26 -4.82 118.16 119.53 1tm9 n LYS 115 Ca 0.02 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.30 1tm9 n LYS 115 Cb 0.48 -1.33 0.00 0.00 0.02 0.00 0.00 35.03 34.20 1tm9 n LYS 115 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1tm9 n LYS 116 N -2.33 0.00 0.10 1.64 4.01 -1.26 -4.89 118.16 115.42 1tm9 n LYS 116 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1tm9 n LYS 116 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1tm9 n LYS 116 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1tm9 n GLN 117 N -0.51 0.00 0.00 1.97 10.64 -1.26 -4.93 117.38 123.29 1tm9 n GLN 117 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1tm9 n GLN 117 Cb 0.00 -0.11 0.00 0.00 -0.86 0.00 0.00 30.24 29.27 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 -3.32 0.00 0.16 -0.39 3.06 -1.26 0.17 119.36 117.79 1tm9 n ILE 118 Ca 0.00 0.00 -0.07 0.00 -2.50 0.00 0.00 62.75 60.18 1tm9 n ILE 118 Cb 0.02 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.17 1tm9 n ILE 118 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 1tm9 h ILE 119 N 0.00 0.00 -1.82 9.51 1.08 -1.97 -1.73 117.51 122.58 1tm9 h ILE 119 Ca 0.00 0.00 0.54 0.00 -0.39 0.00 0.00 64.86 65.01 1tm9 h ILE 119 Cb 0.00 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.67 1tm9 h ILE 119 CO 0.00 0.00 1.30 0.11 -0.69 0.00 0.00 178.15 178.87 1tm9 h LYS 120 N -0.43 0.01 0.38 2.37 1.57 0.14 1.32 116.57 121.92 1tm9 h LYS 120 Ca -0.04 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1tm9 h LYS 120 Cb 0.34 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1tm9 h LYS 120 CO 0.06 0.00 -0.18 -0.22 -0.57 0.00 0.00 179.45 178.54 1tm9 h LYS 121 N 0.01 -0.49 0.00 3.15 3.11 -0.17 -0.34 116.57 121.83 1tm9 h LYS 121 Ca 0.89 0.03 0.00 0.00 -2.81 0.00 0.00 60.65 58.77 1tm9 h LYS 121 Cb 3.50 0.11 0.00 0.00 -1.00 0.00 0.00 32.23 34.84 1tm9 h LYS 121 CO -0.06 -0.26 0.00 0.00 -2.81 0.00 0.00 179.45 176.31 1tm9 n ALA 122 N -2.38 -0.47 -0.67 5.00 0.00 0.44 0.20 120.51 122.64 1tm9 n ALA 122 Ca -0.11 0.00 0.51 0.00 0.00 0.00 0.00 53.44 53.84 1tm9 n ALA 122 Cb 0.25 0.02 0.80 0.00 0.00 0.00 0.00 19.45 20.51 1tm9 n ALA 122 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1tm9 n TYR 123 N -2.00 0.13 0.05 0.00 4.01 -0.71 0.21 117.16 118.84 1tm9 n TYR 123 Ca 0.00 0.13 -0.22 0.00 -0.16 0.00 0.00 57.90 57.64 1tm9 n TYR 123 Cb 0.00 -0.61 -0.14 0.00 -0.31 0.00 0.00 39.34 38.27 1tm9 n TYR 123 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1tm9 h GLU 124 N 0.00 0.33 -0.19 -0.72 4.39 -0.53 -1.94 114.58 115.92 1tm9 h GLU 124 Ca 0.93 -0.56 0.05 0.00 0.34 0.00 0.00 59.36 60.12 1tm9 h GLU 124 Cb 3.61 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 32.46 1tm9 h GLU 124 CO -0.09 1.27 0.37 0.00 -1.16 0.00 0.00 179.01 179.40 1tm9 h THR 125 N -0.13 0.19 0.00 1.13 1.03 1.44 0.49 112.91 117.06 1tm9 h THR 125 Ca -0.30 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.10 1tm9 h THR 125 Cb 1.90 0.67 0.00 0.00 -1.07 0.00 0.00 68.15 69.65 1tm9 h THR 125 CO 0.13 0.00 -0.65 -0.38 -0.01 0.00 0.00 175.52 174.61 1tm9 n ILE 126 N -3.30 1.12 -0.08 0.00 5.41 -0.51 -2.27 119.36 119.74 1tm9 n ILE 126 Ca 0.02 0.24 0.25 0.00 1.00 0.00 0.00 62.75 64.27 1tm9 n ILE 126 Cb 0.48 -2.15 0.58 0.00 -0.71 0.00 0.00 39.64 37.83 1tm9 n ILE 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1tm9 h ALA 127 N -1.24 2.60 0.00 -1.39 0.00 -1.07 1.16 119.26 119.32 1tm9 h ALA 127 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1tm9 h ALA 127 Cb 0.65 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1tm9 h ALA 127 CO 0.00 -1.28 -0.58 -3.47 0.00 0.00 0.00 179.25 173.92 1tm9 n ASP 128 N -3.44 1.82 -0.35 0.00 2.03 0.17 -3.24 116.55 113.54 1tm9 n ASP 128 Ca 0.16 0.61 0.24 0.00 0.52 0.00 0.00 54.79 56.32 1tm9 n ASP 128 Cb 1.14 -0.87 0.51 0.00 -0.72 0.00 0.00 41.12 41.18 1tm9 n ASP 128 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 1tm9 h ASN 129 N -1.00 0.46 -0.27 1.67 2.35 -0.58 1.40 115.58 119.61 1tm9 h ASN 129 Ca -0.02 0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.73 1tm9 h ASN 129 Cb 0.58 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1tm9 h ASN 129 CO -0.01 0.03 -0.24 -0.29 -1.65 0.00 0.00 177.43 175.26 1tm9 h ILE 130 N 0.37 1.27 0.00 2.81 2.10 0.11 -1.49 117.51 122.68 1tm9 h ILE 130 Ca 0.65 -1.36 0.00 0.00 1.08 0.00 0.00 64.86 65.23 1tm9 h ILE 130 Cb 1.64 1.24 0.00 0.00 -1.09 0.00 0.00 36.82 38.61 1tm9 h ILE 130 CO -0.38 0.45 0.00 0.00 -1.08 0.00 0.00 178.15 177.15 1tm9 n ALA 131 N -2.50 1.38 0.09 0.18 0.00 0.47 -0.92 120.51 119.21 1tm9 n ALA 131 Ca -0.00 0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1tm9 n ALA 131 Cb 0.44 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1tm9 n ALA 131 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1tm9 h ASP 132 N 0.00 0.00 0.33 0.00 5.19 -0.37 -2.97 116.42 118.60 1tm9 h ASP 132 Ca 0.00 0.00 -0.32 0.00 -0.62 0.00 0.00 57.03 56.09 1tm9 h ASP 132 Cb 0.16 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.63 1tm9 h ASP 132 CO 0.00 0.84 -1.85 -1.22 -3.12 0.00 0.00 179.24 173.89 1tm9 n TYR 133 N -3.41 1.07 0.00 4.55 4.01 -0.09 -4.48 117.16 118.81 1tm9 n TYR 133 Ca 0.00 0.31 0.00 0.00 -0.16 0.00 0.00 57.90 58.05 1tm9 n TYR 133 Cb 0.84 -1.17 0.00 0.00 -0.31 0.00 0.00 39.34 38.70 1tm9 n TYR 133 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1tm9 n LEU 134 N -3.21 0.00 0.00 7.72 4.77 -0.65 -4.93 117.00 120.70 1tm9 n LEU 134 Ca -0.23 0.96 0.00 0.00 -0.03 0.00 0.00 56.01 56.70 1tm9 n LEU 134 Cb 1.05 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1tm9 n LEU 134 CO 0.44 -0.46 0.00 -3.20 -1.33 0.00 0.00 177.39 172.84 1tm9 n ASN 135 N -1.87 0.00 -2.20 -1.43 2.85 -1.13 -5.03 115.26 106.44 1tm9 n ASN 135 Ca 0.00 0.00 -0.28 0.00 -0.11 0.00 0.00 54.58 54.19 1tm9 n ASN 135 Cb 0.00 0.00 0.11 0.00 1.24 0.00 0.00 39.78 41.13 1tm9 n ASN 135 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1tm9 n GLU 136 N 0.00 2.39 0.00 1.20 0.28 -1.17 -4.99 120.64 118.35 1tm9 n GLU 136 Ca 0.00 -2.90 0.00 0.00 -0.16 0.00 0.00 57.16 54.10 1tm9 n GLU 136 Cb 0.00 -2.14 0.00 0.00 1.43 0.00 0.00 31.44 30.73 1tm9 n GLU 136 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06