#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 -1.46 0.00 0.03 -0.58 -1.26 -4.80 120.64 112.57 1tm9 n GLU 2 Ca 0.00 1.53 0.00 0.00 -0.42 0.00 0.00 57.16 58.27 1tm9 n GLU 2 Cb 0.00 -4.68 0.00 0.00 -0.57 0.00 0.00 31.44 26.19 1tm9 n GLU 2 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1tm9 n GLN 3 N -0.86 -0.64 0.00 3.49 -0.00 -1.26 -3.98 117.38 114.13 1tm9 n GLN 3 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.05 1tm9 n GLN 3 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.65 1tm9 n GLN 3 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1tm9 n ASN 4 N 0.00 0.00 0.00 2.61 5.03 -1.26 -4.82 115.26 116.82 1tm9 n ASN 4 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 1tm9 n ASN 4 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1tm9 n ASN 4 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1tm9 n ASN 5 N 0.00 -1.33 -0.07 6.41 5.15 -1.26 -3.35 115.26 120.81 1tm9 n ASN 5 Ca 0.00 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 53.96 1tm9 n ASN 5 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 1tm9 n ASN 5 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1tm9 n ILE 6 N 0.00 -0.11 -0.34 -1.44 2.08 -1.26 0.19 119.36 118.48 1tm9 n ILE 6 Ca 0.00 0.97 -0.04 0.00 0.56 0.00 0.00 62.75 64.23 1tm9 n ILE 6 Cb 0.00 -1.25 -0.02 0.00 -0.75 0.00 0.00 39.64 37.63 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 -3.20 -0.27 0.01 0.38 3.00 -1.24 0.91 118.16 117.74 1tm9 n LYS 7 Ca 0.00 1.30 -0.10 0.00 -0.00 0.00 0.00 58.31 59.51 1tm9 n LYS 7 Cb 0.04 -1.92 -0.03 0.00 0.00 0.00 0.00 35.03 33.12 1tm9 n LYS 7 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1tm9 h GLU 8 N 0.00 -0.29 -0.78 1.64 4.81 0.21 0.30 114.58 120.47 1tm9 h GLU 8 Ca 0.23 0.02 0.18 0.00 -0.13 0.00 0.00 59.36 59.66 1tm9 h GLU 8 Cb 0.44 0.07 -0.13 0.00 0.63 0.00 0.00 28.75 29.76 1tm9 h GLU 8 CO -0.83 -0.20 0.09 1.96 -0.73 0.00 0.00 179.01 179.31 1tm9 h GLN 9 N -0.31 0.15 -0.36 1.92 4.20 0.33 1.30 115.11 122.35 1tm9 h GLN 9 Ca 0.09 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 1tm9 h GLN 9 Cb 0.45 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1tm9 h GLN 9 CO -0.29 0.10 0.19 -0.07 -0.67 0.00 0.00 178.83 178.09 1tm9 h LEU 10 N 0.16 0.46 0.91 1.46 3.38 0.33 -2.91 115.31 119.10 1tm9 h LEU 10 Ca 0.44 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.27 1tm9 h LEU 10 Cb 0.81 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.45 1tm9 h LEU 10 CO -0.63 0.43 -0.44 0.40 0.09 0.00 0.00 178.44 178.29 1tm9 h ILE 11 N 0.45 0.01 -0.49 1.22 5.03 0.17 -3.02 117.51 120.87 1tm9 h ILE 11 Ca 0.13 -0.10 0.06 0.00 -0.12 0.00 0.00 64.86 64.82 1tm9 h ILE 11 Cb 0.08 0.01 -0.07 0.00 -3.03 0.00 0.00 36.82 33.81 1tm9 h ILE 11 CO -0.02 0.00 -0.25 -0.24 -0.68 0.00 0.00 178.15 176.96 1tm9 n SER 12 N -5.59 -0.44 0.01 1.72 2.88 0.41 0.21 113.62 112.82 1tm9 n SER 12 Ca -0.15 0.87 -0.09 0.00 -1.33 0.00 0.00 58.87 58.17 1tm9 n SER 12 Cb 0.48 -0.15 -0.06 0.00 -0.75 0.00 0.00 64.21 63.74 1tm9 n SER 12 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 1tm9 h PHE 13 N 0.00 -0.96 0.00 0.66 0.04 -1.43 0.25 116.94 115.49 1tm9 h PHE 13 Ca 0.12 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.92 1tm9 h PHE 13 Cb 0.24 0.43 -0.00 0.00 2.20 0.00 0.00 35.95 38.81 1tm9 h PHE 13 CO -0.48 -0.34 -0.01 0.35 -0.60 0.00 0.00 178.31 177.23 1tm9 h PHE 14 N -0.38 0.00 -0.80 -0.55 3.04 0.36 -1.05 116.94 117.56 1tm9 h PHE 14 Ca 0.01 0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.03 1tm9 h PHE 14 Cb 0.42 0.00 -0.05 0.00 2.56 0.00 0.00 35.95 38.88 1tm9 h PHE 14 CO -0.49 0.01 0.52 -0.97 -2.02 0.00 0.00 178.31 175.37 1tm9 h ASN 15 N 0.00 0.75 -0.27 0.41 -0.73 0.46 -0.06 115.58 116.14 1tm9 h ASN 15 Ca -0.00 0.01 -0.17 0.00 1.87 0.00 0.00 56.30 58.01 1tm9 h ASN 15 Cb 0.04 -0.16 -0.08 0.00 0.27 0.00 0.00 38.32 38.39 1tm9 h ASN 15 CO 0.00 0.48 0.22 0.00 -0.37 0.00 0.00 177.43 177.76 1tm9 n GLN 16 N -4.49 1.42 0.00 6.67 10.64 -0.40 -4.25 117.38 126.98 1tm9 n GLN 16 Ca 0.12 -0.86 0.00 0.00 -1.83 0.00 0.00 57.00 54.43 1tm9 n GLN 16 Cb 0.23 -1.34 0.00 0.00 -0.86 0.00 0.00 30.24 28.27 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 0.63 1.74 -3.73 2.61 0.00 -0.08 -4.70 120.51 116.98 1tm9 n ALA 17 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.33 1tm9 n ALA 17 Cb 0.62 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.90 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 4.35 0.66 -3.59 0.00 3.41 -1.26 -4.59 113.62 112.59 1tm9 n SER 19 Ca -0.18 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.10 1tm9 n SER 19 Cb 0.51 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.47 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 -2.59 0.00 -0.05 6.66 -2.24 -1.26 -4.92 114.28 109.88 1tm9 n THR 20 Ca 0.00 -0.42 -0.01 0.00 -2.27 0.00 0.00 64.05 61.34 1tm9 n THR 20 Cb 0.29 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.52 1tm9 n THR 20 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1tm9 h HIS 21 N 0.00 0.00 -1.09 4.78 3.86 -2.01 -3.32 115.15 117.37 1tm9 h HIS 21 Ca -0.35 0.00 0.31 0.00 -1.16 0.00 0.00 60.37 59.18 1tm9 h HIS 21 Cb 1.22 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.65 1tm9 h HIS 21 CO 0.19 0.00 1.07 1.96 0.86 0.00 0.00 177.93 182.01 1tm9 h GLN 22 N -0.82 0.00 -0.08 2.45 4.20 -2.01 0.99 115.11 119.84 1tm9 h GLN 22 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1tm9 h GLN 22 Cb 0.15 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 1tm9 h GLN 22 CO 0.00 0.00 0.02 1.49 -0.67 0.00 0.00 178.83 179.67 1tm9 h GLU 23 N 0.00 0.13 -0.55 1.46 4.57 -1.93 -1.97 114.58 116.28 1tm9 h GLU 23 Ca 0.52 -0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.76 1tm9 h GLU 23 Cb 2.64 -0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 31.11 1tm9 h GLU 23 CO -0.01 0.33 -0.36 0.00 -1.18 0.00 0.00 179.01 177.79 1tm9 h ARG 24 N -0.09 -0.19 -0.74 1.92 2.47 0.94 0.85 114.38 119.54 1tm9 h ARG 24 Ca 0.03 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.80 1tm9 h ARG 24 Cb 0.25 0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.58 1tm9 h ARG 24 CO 0.00 -0.13 0.49 -0.07 0.56 0.00 0.00 179.97 180.82 1tm9 h LEU 25 N -0.20 0.76 0.00 3.04 3.38 -1.53 0.56 115.31 121.32 1tm9 h LEU 25 Ca 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1tm9 h LEU 25 Cb 0.56 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1tm9 h LEU 25 CO -0.66 0.52 0.00 -0.67 0.09 0.00 0.00 178.44 177.72 1tm9 n ASP 26 N -4.46 0.00 -0.04 -0.43 2.03 0.20 -3.53 116.55 110.33 1tm9 n ASP 26 Ca 0.10 0.45 -0.01 0.00 0.52 0.00 0.00 54.79 55.85 1tm9 n ASP 26 Cb 0.14 -0.48 -0.00 0.00 -0.72 0.00 0.00 41.12 40.05 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 0.00 0.00 -1.77 -0.67 3.57 0.58 -1.68 116.94 116.97 1tm9 h PHE 27 Ca 0.00 0.00 0.52 0.00 3.53 0.00 0.00 57.97 62.02 1tm9 h PHE 27 Cb 0.34 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.00 1tm9 h PHE 27 CO 0.00 0.00 1.26 0.44 -2.23 0.00 0.00 178.31 177.78 1tm9 n ILE 28 N -3.62 -0.04 -0.04 1.41 -5.35 -0.71 0.22 119.36 111.24 1tm9 n ILE 28 Ca -0.02 1.43 -0.01 0.00 -0.27 0.00 0.00 62.75 63.88 1tm9 n ILE 28 Cb 0.08 -2.38 -0.00 0.00 -1.74 0.00 0.00 39.64 35.60 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 -0.67 -1.27 -0.85 0.00 0.02 0.72 0.32 113.55 111.81 1tm9 h SER 30 Ca 0.00 0.18 0.34 0.00 -0.84 0.00 0.00 61.79 61.48 1tm9 h SER 30 Cb 0.15 0.54 -0.15 0.00 0.14 0.00 0.00 62.40 63.08 1tm9 h SER 30 CO 0.00 -0.39 0.41 0.41 -1.14 0.00 0.00 176.83 176.12 1tm9 n THR 31 N -5.42 -0.36 -2.14 -2.27 -1.04 0.60 0.19 114.28 103.84 1tm9 n THR 31 Ca -0.02 1.74 -0.24 0.00 -2.04 0.00 0.00 64.05 63.49 1tm9 n THR 31 Cb 0.35 -2.79 0.02 0.00 -1.82 0.00 0.00 70.33 66.09 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 -4.95 3.49 -2.69 -2.82 0.63 0.33 -4.73 116.66 105.92 1tm9 n ARG 32 Ca 0.31 -4.20 -0.06 0.00 -0.92 0.00 0.00 57.85 52.98 1tm9 n ARG 32 Cb 1.05 -2.24 0.10 0.00 0.45 0.00 0.00 32.46 31.81 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 -0.66 0.57 0.00 -0.14 4.07 0.51 -4.94 120.64 120.04 1tm9 n GLU 33 Ca 0.41 -1.28 0.00 0.00 -0.06 0.00 0.00 57.16 56.24 1tm9 n GLU 33 Cb 0.91 -0.51 0.00 0.00 -0.06 0.00 0.00 31.44 31.78 1tm9 n GLU 33 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1tm9 n SER 34 N 0.32 0.00 0.04 4.31 2.88 -1.14 -4.50 113.62 115.54 1tm9 n SER 34 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1tm9 n SER 34 Cb 0.73 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.19 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 -0.76 0.00 -3.46 9.92 -1.26 -5.13 116.55 115.86 1tm9 n ASP 35 Ca 0.00 0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.52 1tm9 n ASP 35 Cb 0.00 0.94 0.00 0.00 -0.64 0.00 0.00 41.12 41.42 1tm9 n ASP 35 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1tm9 n THR 36 N -2.59 0.00 -0.08 -3.53 5.66 -1.26 -5.07 114.28 107.40 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 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 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 1.66 1.09 3.01 -1.26 -4.43 117.46 117.52 1tm9 n PHE 37 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.58 1tm9 n PHE 37 Cb 0.00 -0.63 0.72 0.00 -0.01 0.00 0.00 39.48 39.56 1tm9 n PHE 37 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1tm9 n SER 38 N -3.32 0.00 0.11 4.37 2.88 -1.26 -2.39 113.62 114.00 1tm9 n SER 38 Ca -0.31 -0.90 0.09 0.00 -1.33 0.00 0.00 58.87 56.41 1tm9 n SER 38 Cb 0.78 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.25 1tm9 n SER 38 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1tm9 h SER 39 N 0.00 0.00 0.00 -3.46 0.02 -1.92 -3.44 113.55 104.75 1tm9 h SER 39 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1tm9 h SER 39 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1tm9 h SER 39 CO 0.00 0.16 0.00 0.52 -1.14 0.00 0.00 176.83 176.37 1tm9 n VAL 40 N -2.82 0.00 0.10 2.27 0.31 -1.00 -4.97 118.33 112.21 1tm9 n VAL 40 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1tm9 n VAL 40 Cb 0.62 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 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 -0.40 -4.66 4.52 -0.08 -1.26 -5.09 116.55 109.58 1tm9 n ASP 41 Ca 0.00 0.35 -0.45 0.00 -1.51 0.00 0.00 54.79 53.18 1tm9 n ASP 41 Cb 0.00 0.53 -0.03 0.00 2.34 0.00 0.00 41.12 43.96 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 -3.12 0.96 -2.54 5.18 3.14 -1.26 -4.93 118.33 115.75 1tm9 n VAL 42 Ca 0.00 -0.24 -0.34 0.00 -2.96 0.00 0.00 64.34 60.80 1tm9 n VAL 42 Cb 0.00 -1.41 -0.03 0.00 -1.06 0.00 0.00 33.84 31.34 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 -0.42 3.82 0.07 1.45 0.04 -1.26 -4.85 135.00 133.85 1tm9 s PRO 43 Ca 0.68 1.37 0.01 0.00 0.04 0.00 0.00 61.00 63.11 1tm9 s PRO 43 Cb -0.67 -2.12 -0.25 0.00 0.04 0.00 0.00 34.50 31.50 1tm9 s PRO 43 CO 0.50 -0.42 1.12 -0.07 0.04 0.00 0.00 177.00 178.18 1tm9 h LEU 44 N 1.61 0.23 -0.87 -3.56 3.38 -1.94 -2.88 115.31 111.27 1tm9 h LEU 44 Ca -0.49 -0.26 0.10 0.00 0.09 0.00 0.00 57.88 57.31 1tm9 h LEU 44 Cb 1.22 -0.07 -0.12 0.00 0.09 0.00 0.00 40.66 41.78 1tm9 h LEU 44 CO 0.59 1.21 -0.53 -0.33 0.09 0.00 0.00 178.44 179.47 1tm9 h GLU 45 N 0.04 -0.08 0.01 1.13 3.07 -1.98 1.52 114.58 118.30 1tm9 h GLU 45 Ca -0.11 0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.75 1tm9 h GLU 45 Cb 1.90 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.83 1tm9 h GLU 45 CO 0.16 -0.05 -0.01 -1.00 -1.40 0.00 0.00 179.01 176.71 1tm9 h PRO 46 N -0.08 -0.02 -0.71 2.33 0.13 -1.84 -3.30 132.00 128.51 1tm9 h PRO 46 Ca 0.18 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.45 1tm9 h PRO 46 Cb 0.49 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.49 1tm9 h PRO 46 CO -0.87 0.70 -0.22 0.82 -0.23 0.00 0.00 178.00 178.20 1tm9 h ILE 47 N -0.77 0.24 -0.99 -3.56 1.08 -1.19 1.84 117.51 114.16 1tm9 h ILE 47 Ca -0.00 0.00 0.29 0.00 -0.39 0.00 0.00 64.86 64.75 1tm9 h ILE 47 Cb 0.72 0.24 -0.04 0.00 -3.07 0.00 0.00 36.82 34.68 1tm9 h ILE 47 CO 0.00 0.00 0.96 0.11 -0.69 0.00 0.00 178.15 178.53 1tm9 h LYS 48 N -0.03 0.00 0.08 2.37 1.57 0.21 1.74 116.57 122.51 1tm9 h LYS 48 Ca 0.33 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.93 1tm9 h LYS 48 Cb 0.54 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.87 1tm9 h LYS 48 CO -0.75 0.00 -0.74 -0.97 -0.57 0.00 0.00 179.45 176.42 1tm9 h ASN 49 N 0.00 0.51 0.52 0.86 -0.73 0.27 -3.07 115.58 113.93 1tm9 h ASN 49 Ca 0.47 -0.87 0.00 0.00 1.87 0.00 0.00 56.30 57.77 1tm9 h ASN 49 Cb 2.38 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 40.81 1tm9 h ASN 49 CO -0.00 1.33 0.00 2.30 -0.37 0.00 0.00 177.43 180.68 1tm9 n ILE 50 N -4.15 0.36 0.04 2.57 -5.35 0.53 -2.19 119.36 111.17 1tm9 n ILE 50 Ca -0.12 0.09 -0.04 0.00 -0.27 0.00 0.00 62.75 62.40 1tm9 n ILE 50 Cb 0.77 -0.72 -0.09 0.00 -1.74 0.00 0.00 39.64 37.85 1tm9 n ILE 50 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1tm9 h ILE 51 N 0.00 1.05 0.00 7.28 2.04 0.39 -3.23 117.51 125.04 1tm9 h ILE 51 Ca 0.00 -2.70 0.00 0.00 1.00 0.00 0.00 64.86 63.16 1tm9 h ILE 51 Cb 0.26 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 1tm9 h ILE 51 CO 0.00 0.60 0.00 -0.08 0.00 0.00 0.00 178.15 178.67 1tm9 h GLU 52 N 0.00 0.00 -0.74 2.37 4.81 -1.35 -2.24 114.58 117.42 1tm9 h GLU 52 Ca -0.12 0.00 0.19 0.00 -0.13 0.00 0.00 59.36 59.30 1tm9 h GLU 52 Cb 1.73 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 31.07 1tm9 h GLU 52 CO 0.09 0.00 0.52 0.97 -0.73 0.00 0.00 179.01 179.85 1tm9 h ILE 53 N 0.00 0.68 0.00 2.32 6.09 -1.69 -3.35 117.51 121.56 1tm9 h ILE 53 Ca 0.00 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.44 1tm9 h ILE 53 Cb 0.18 0.53 0.00 0.00 0.47 0.00 0.00 36.82 38.00 1tm9 h ILE 53 CO 0.00 0.03 0.00 0.35 -3.07 0.00 0.00 178.15 175.46 1tm9 n THR 54 N -4.38 0.00 -4.40 2.19 -2.24 -0.84 -4.78 114.28 99.82 1tm9 n THR 54 Ca 0.15 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.56 1tm9 n THR 54 Cb 0.71 -0.51 -0.08 0.00 -2.10 0.00 0.00 70.33 68.35 1tm9 n THR 54 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1tm9 n LYS 55 N -0.09 -1.12 0.00 -0.78 4.76 -1.24 -4.65 118.16 115.04 1tm9 n LYS 55 Ca 0.00 0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 1tm9 n LYS 55 Cb 0.00 -4.24 0.00 0.00 -1.84 0.00 0.00 35.03 28.95 1tm9 n LYS 55 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1tm9 n ASP 56 N -2.69 0.00 0.06 4.39 9.92 -1.26 -5.02 116.55 121.95 1tm9 n ASP 56 Ca -0.10 0.00 -0.14 0.00 -0.53 0.00 0.00 54.79 54.02 1tm9 n ASP 56 Cb 0.57 0.00 -0.14 0.00 -0.64 0.00 0.00 41.12 40.92 1tm9 n ASP 56 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 1tm9 h GLU 57 N 0.00 0.17 -0.04 -1.24 9.09 -1.98 -2.90 114.58 117.68 1tm9 h GLU 57 Ca 0.00 -0.29 0.04 0.00 0.05 0.00 0.00 59.36 59.16 1tm9 h GLU 57 Cb 0.00 0.11 -0.05 0.00 -1.65 0.00 0.00 28.75 27.15 1tm9 h GLU 57 CO 0.00 1.02 -0.30 -0.97 0.05 0.00 0.00 179.01 178.81 1tm9 h ASN 58 N 0.05 -0.91 -0.21 3.06 -0.73 -1.95 0.68 115.58 115.57 1tm9 h ASN 58 Ca -0.19 0.13 -0.02 0.00 1.87 0.00 0.00 56.30 58.09 1tm9 h ASN 58 Cb 1.96 0.38 -0.01 0.00 0.27 0.00 0.00 38.32 40.92 1tm9 h ASN 58 CO 0.15 -0.36 0.05 1.56 -0.37 0.00 0.00 177.43 178.46 1tm9 h GLN 59 N -0.43 0.33 -1.00 6.67 1.08 -1.83 -2.27 115.11 117.67 1tm9 h GLN 59 Ca 0.07 -0.08 0.15 0.00 -1.45 0.00 0.00 58.65 57.35 1tm9 h GLN 59 Cb 0.53 -0.04 -0.09 0.00 -0.05 0.00 0.00 27.48 27.83 1tm9 h GLN 59 CO -0.28 0.46 0.62 0.37 -0.95 0.00 0.00 178.83 179.05 1tm9 h GLN 60 N 0.15 0.85 0.84 1.46 4.15 -1.20 1.02 115.11 122.37 1tm9 h GLN 60 Ca 0.07 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.39 1tm9 h GLN 60 Cb 0.28 -0.19 0.01 0.00 0.21 0.00 0.00 27.48 27.78 1tm9 h GLN 60 CO 0.00 0.56 -0.40 0.82 -1.93 0.00 0.00 178.83 177.88 1tm9 h ILE 61 N 0.88 0.00 -0.11 2.39 2.04 0.68 0.23 117.51 123.61 1tm9 h ILE 61 Ca 0.53 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 66.34 1tm9 h ILE 61 Cb 0.69 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1tm9 h ILE 61 CO -0.32 0.00 0.09 -0.33 0.00 0.00 0.00 178.15 177.60 1tm9 h GLU 62 N -1.22 0.00 -0.27 2.37 3.07 -0.82 -0.59 114.58 117.12 1tm9 h GLU 62 Ca -0.12 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.64 1tm9 h GLU 62 Cb 0.86 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.77 1tm9 h GLU 62 CO 0.19 0.00 -0.25 0.82 -1.40 0.00 0.00 179.01 178.37 1tm9 h ILE 63 N 0.00 1.31 0.08 3.13 2.04 0.14 -0.91 117.51 123.30 1tm9 h ILE 63 Ca 0.05 -1.41 0.02 0.00 1.00 0.00 0.00 64.86 64.53 1tm9 h ILE 63 Cb 0.24 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.88 1tm9 h ILE 63 CO -0.00 0.45 -0.39 0.74 0.00 0.00 0.00 178.15 178.95 1tm9 h THR 64 N 0.38 0.20 -0.33 -0.27 2.02 0.11 0.62 112.91 115.64 1tm9 h THR 64 Ca 0.05 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 1tm9 h THR 64 Cb 0.81 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1tm9 h THR 64 CO 0.06 0.00 0.13 0.50 0.37 0.00 0.00 175.52 176.58 1tm9 h LYS 65 N -0.60 0.46 -0.17 6.66 3.11 -1.52 -1.52 116.57 122.99 1tm9 h LYS 65 Ca 0.03 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.81 1tm9 h LYS 65 Cb 0.64 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.78 1tm9 h LYS 65 CO -0.25 0.39 0.08 0.82 -2.81 0.00 0.00 179.45 177.68 1tm9 h ILE 66 N 0.46 1.13 -0.72 2.00 2.04 0.37 0.27 117.51 123.06 1tm9 h ILE 66 Ca 0.12 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.63 1tm9 h ILE 66 Cb 0.10 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1tm9 h ILE 66 CO -0.01 0.13 0.44 0.00 0.00 0.00 0.00 178.15 178.71 1tm9 h ALA 67 N 0.95 0.96 -0.97 1.87 0.00 0.90 -0.96 119.26 122.01 1tm9 h ALA 67 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1tm9 h ALA 67 Cb 0.12 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1tm9 h ALA 67 CO -0.01 0.20 0.61 0.28 0.00 0.00 0.00 179.25 180.33 1tm9 h VAL 68 N 0.85 1.26 -0.92 0.00 2.07 -0.88 0.62 116.25 119.25 1tm9 h VAL 68 Ca 0.30 -0.51 0.27 0.00 0.82 0.00 0.00 66.70 67.57 1tm9 h VAL 68 Cb 0.07 -0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.67 1tm9 h VAL 68 CO -0.13 0.26 0.93 -1.13 0.02 0.00 0.00 177.57 177.51 1tm9 h ASN 69 N 1.32 0.00 0.00 0.57 -1.24 0.48 1.56 115.58 118.28 1tm9 h ASN 69 Ca 0.35 0.00 -0.45 0.00 0.71 0.00 0.00 56.30 56.91 1tm9 h ASN 69 Cb -0.10 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 38.88 1tm9 h ASN 69 CO -0.07 0.00 -2.54 0.59 -1.29 0.00 0.00 177.43 174.12 1tm9 n ASN 70 N -3.58 1.96 -0.19 1.15 3.02 -0.24 -4.04 115.26 113.35 1tm9 n ASN 70 Ca 0.20 0.23 -0.00 0.00 -0.03 0.00 0.00 54.58 54.97 1tm9 n ASN 70 Cb 1.23 -0.72 0.10 0.00 -0.61 0.00 0.00 39.78 39.77 1tm9 n ASN 70 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1tm9 h ILE 71 N -0.76 0.74 -0.37 2.41 6.09 0.13 0.58 117.51 126.33 1tm9 h ILE 71 Ca -0.68 -0.12 0.06 0.00 -1.37 0.00 0.00 64.86 62.75 1tm9 h ILE 71 Cb 1.68 0.36 -0.02 0.00 0.47 0.00 0.00 36.82 39.31 1tm9 h ILE 71 CO -0.35 0.06 0.25 0.11 -3.07 0.00 0.00 178.15 175.16 1tm9 h LYS 72 N 0.35 0.23 0.07 2.19 1.79 0.19 0.07 116.57 121.45 1tm9 h LYS 72 Ca 0.30 -0.01 -0.24 0.00 -2.18 0.00 0.00 60.65 58.51 1tm9 h LYS 72 Cb 0.39 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.98 1tm9 h LYS 72 CO -0.33 0.15 -1.09 1.15 -1.08 0.00 0.00 179.45 178.26 1tm9 h THR 73 N 0.24 1.53 -0.59 -0.16 2.02 -0.35 -3.17 112.91 112.43 1tm9 h THR 73 Ca 0.17 -2.97 0.15 0.00 0.77 0.00 0.00 66.41 64.52 1tm9 h THR 73 Cb 0.35 2.77 -0.03 0.00 -1.74 0.00 0.00 68.15 69.50 1tm9 h THR 73 CO -0.03 0.87 0.41 -0.07 0.37 0.00 0.00 175.52 177.07 1tm9 h LEU 74 N 0.08 0.13 -5.17 2.58 3.38 0.19 -2.96 115.31 113.54 1tm9 h LEU 74 Ca -0.09 0.01 -0.41 0.00 0.09 0.00 0.00 57.88 57.48 1tm9 h LEU 74 Cb 1.79 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 42.53 1tm9 h LEU 74 CO 0.17 0.07 2.49 -1.54 0.09 0.00 0.00 178.44 179.72 1tm9 n SER 75 N -4.41 5.62 0.00 -0.43 3.41 -1.05 -2.31 113.62 114.44 1tm9 n SER 75 Ca 0.11 -2.35 0.00 0.00 -0.26 0.00 0.00 58.87 56.36 1tm9 n SER 75 Cb 0.57 -1.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 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 3.83 0.00 -2.80 4.04 7.64 -1.12 -5.08 113.62 120.13 1tm9 n SER 76 Ca 0.50 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 60.14 1tm9 n SER 76 Cb 0.23 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.33 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 -0.82 0.00 0.00 0.44 0.31 -0.98 -4.71 118.33 112.57 1tm9 n VAL 77 Ca 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1tm9 n VAL 77 Cb 0.00 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.66 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 3.97 4.96 3.57 2.92 0.00 -1.26 -4.05 105.19 115.29 1tm9 n GLY 78 Ca 0.41 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.00 0.00 -2.69 4.61 0.00 -1.26 -4.32 120.51 113.85 1tm9 n ALA 79 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1tm9 n ALA 79 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1tm9 n ALA 79 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1tm9 n THR 80 N 0.00 0.63 0.00 0.00 5.66 -1.26 -5.06 114.28 114.24 1tm9 n THR 80 Ca 0.00 -2.58 0.00 0.00 -3.05 0.00 0.00 64.05 58.42 1tm9 n THR 80 Cb 0.00 0.76 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 1tm9 n THR 80 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1tm9 n GLY 81 N -0.22 0.75 0.47 1.09 0.00 -1.26 -4.72 105.19 101.30 1tm9 n GLY 81 Ca 0.06 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 0.00 -2.56 1.61 6.02 -1.26 -4.24 117.38 116.94 1tm9 n GLN 82 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1tm9 n GLN 82 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1tm9 n TYR 83 N -1.35 0.00 0.10 1.08 4.02 -1.26 -4.60 117.16 115.15 1tm9 n TYR 83 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.84 1tm9 n TYR 83 Cb 0.00 -0.77 0.07 0.00 -0.02 0.00 0.00 39.34 38.61 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 3.07 0.10 -0.63 -0.72 1.85 -1.95 -3.11 114.93 113.54 1tm9 h MET 84 Ca 0.00 -0.09 0.09 0.00 -0.61 0.00 0.00 59.70 59.09 1tm9 h MET 84 Cb 0.73 0.02 -0.07 0.00 0.43 0.00 0.00 31.60 32.71 1tm9 h MET 84 CO 0.00 0.80 0.25 0.00 -0.40 0.00 0.00 176.91 177.56 1tm9 h ALA 85 N 1.17 0.83 0.00 0.39 0.00 -1.95 0.39 119.26 120.08 1tm9 h ALA 85 Ca -0.02 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1tm9 h ALA 85 Cb 1.32 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1tm9 h ALA 85 CO 0.11 -0.16 -0.14 0.77 0.00 0.00 0.00 179.25 179.82 1tm9 h SER 86 N 0.45 0.00 -0.74 0.00 0.02 -1.89 -3.05 113.55 108.33 1tm9 h SER 86 Ca 0.32 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.86 1tm9 h SER 86 Cb 0.38 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.76 1tm9 h SER 86 CO -0.30 0.14 0.41 0.33 -1.14 0.00 0.00 176.83 176.27 1tm9 n PHE 87 N -3.33 1.60 0.00 3.45 7.35 0.13 -3.87 117.46 122.79 1tm9 n PHE 87 Ca -0.00 -1.99 0.00 0.00 -0.76 0.00 0.00 57.45 54.70 1tm9 n PHE 87 Cb 0.36 -1.17 0.00 0.00 0.35 0.00 0.00 39.48 39.02 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 0.56 0.00 -0.27 -5.13 3.72 -1.15 -4.61 117.46 110.58 1tm9 n PHE 88 Ca 0.40 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.87 1tm9 n PHE 88 Cb 0.58 0.05 0.19 0.00 -0.94 0.00 0.00 39.48 39.36 1tm9 n PHE 88 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1tm9 h SER 89 N 0.00 -0.27 0.12 4.37 0.87 -1.75 -2.65 113.55 114.24 1tm9 h SER 89 Ca 0.00 0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 1tm9 h SER 89 Cb 0.45 0.33 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 1tm9 h SER 89 CO 0.00 -0.18 -0.06 0.71 -0.53 0.00 0.00 176.83 176.78 1tm9 h THR 90 N 0.13 0.00 -2.32 2.23 1.35 -1.87 -3.39 112.91 109.03 1tm9 h THR 90 Ca 0.45 -0.10 -0.61 0.00 -0.55 0.00 0.00 66.41 65.61 1tm9 h THR 90 Cb 0.83 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 67.12 1tm9 h THR 90 CO -0.67 0.00 0.87 0.20 -0.25 0.00 0.00 175.52 175.67 1tm9 s ASN 91 N -2.93 6.28 -0.15 5.36 0.01 -1.01 -4.80 114.94 117.70 1tm9 s ASN 91 Ca -0.02 -1.05 -0.14 0.00 -0.71 0.00 0.00 52.86 50.94 1tm9 s ASN 91 Cb 0.00 -2.48 -0.24 0.00 0.41 0.00 0.00 41.25 38.95 1tm9 s ASN 91 CO 0.07 -1.51 0.35 -1.28 -1.51 0.00 0.00 177.10 173.22 1tm9 h SER 92 N 9.63 0.25 -0.90 -1.22 0.87 -1.75 -2.98 113.55 117.46 1tm9 h SER 92 Ca -0.15 -0.77 0.20 0.00 -1.23 0.00 0.00 61.79 59.84 1tm9 h SER 92 Cb 1.05 -0.08 -0.17 0.00 -0.44 0.00 0.00 62.40 62.76 1tm9 h SER 92 CO 1.23 1.67 -0.12 -0.33 -0.53 0.00 0.00 176.83 178.75 1tm9 h GLU 93 N -0.41 0.02 0.04 2.24 5.08 -1.87 1.65 114.58 121.32 1tm9 h GLU 93 Ca -0.37 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1tm9 h GLU 93 Cb 1.70 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.95 1tm9 h GLU 93 CO -0.03 0.01 -0.02 -1.00 -1.00 0.00 0.00 179.01 176.98 1tm9 h PRO 94 N 0.02 -0.05 -0.95 2.33 0.13 -1.92 -2.51 132.00 129.05 1tm9 h PRO 94 Ca 0.47 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.83 1tm9 h PRO 94 Cb 0.81 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.88 1tm9 h PRO 94 CO -0.88 0.61 0.63 0.00 -0.23 0.00 0.00 178.00 178.12 1tm9 h ALA 95 N 0.05 2.22 0.21 -0.56 0.00 -1.04 1.38 119.26 121.51 1tm9 h ALA 95 Ca -0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1tm9 h ALA 95 Cb 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1tm9 h ALA 95 CO 0.01 -0.54 -0.10 0.82 0.00 0.00 0.00 179.25 179.44 1tm9 h ILE 96 N 0.41 0.87 -0.67 0.00 2.04 0.24 -2.86 117.51 117.54 1tm9 h ILE 96 Ca 0.51 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1tm9 h ILE 96 Cb 1.28 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 1tm9 h ILE 96 CO -0.21 0.15 0.40 0.40 0.00 0.00 0.00 178.15 178.89 1tm9 h ILE 97 N -0.66 1.19 -0.43 -0.67 5.03 -0.47 -2.85 117.51 118.66 1tm9 h ILE 97 Ca -0.03 -0.43 0.04 0.00 -0.12 0.00 0.00 64.86 64.32 1tm9 h ILE 97 Cb 0.47 0.28 -0.06 0.00 -3.03 0.00 0.00 36.82 34.47 1tm9 h ILE 97 CO 0.05 0.20 -0.38 -0.26 -0.68 0.00 0.00 178.15 177.08 1tm9 h PHE 98 N 0.90 -1.20 -0.47 1.37 0.04 0.18 0.66 116.94 118.42 1tm9 h PHE 98 Ca 0.24 0.07 0.09 0.00 2.80 0.00 0.00 57.97 61.17 1tm9 h PHE 98 Cb -0.02 0.58 -0.10 0.00 2.20 0.00 0.00 35.95 38.61 1tm9 h PHE 98 CO -0.01 -0.30 -0.30 0.00 -0.60 0.00 0.00 178.31 177.10 1tm9 n VAL 100 N -5.42 0.00 -0.16 0.00 0.31 0.04 -0.82 118.33 112.28 1tm9 n VAL 100 Ca 0.03 1.20 -0.10 0.00 -0.01 0.00 0.00 64.34 65.45 1tm9 n VAL 100 Cb 0.34 -1.96 -0.08 0.00 -0.91 0.00 0.00 33.84 31.23 1tm9 n VAL 100 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1tm9 h ILE 101 N 0.00 0.00 -0.59 2.52 1.08 0.51 -0.42 117.51 120.61 1tm9 h ILE 101 Ca 0.00 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.52 1tm9 h ILE 101 Cb 0.00 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 33.68 1tm9 h ILE 101 CO 0.00 0.00 -0.35 0.00 -0.69 0.00 0.00 178.15 177.11 1tm9 n TYR 102 N -4.75 -0.25 -0.09 1.37 9.36 0.57 0.17 117.16 123.54 1tm9 n TYR 102 Ca -0.02 0.74 -0.07 0.00 3.32 0.00 0.00 57.90 61.87 1tm9 n TYR 102 Cb 0.25 -0.55 0.01 0.00 -0.63 0.00 0.00 39.34 38.41 1tm9 n TYR 102 CO 0.00 0.00 0.00 0.35 0.22 0.00 0.00 176.86 177.43 1tm9 h PHE 103 N 0.00 0.22 -1.06 2.98 3.57 0.33 1.00 116.94 123.99 1tm9 h PHE 103 Ca 0.10 0.02 0.28 0.00 3.53 0.00 0.00 57.97 61.89 1tm9 h PHE 103 Cb 0.24 -0.05 -0.08 0.00 2.79 0.00 0.00 35.95 38.85 1tm9 h PHE 103 CO -0.61 0.10 0.70 -0.07 -2.23 0.00 0.00 178.31 176.21 1tm9 h LEU 104 N 0.27 0.32 0.00 0.59 3.38 0.33 0.18 115.31 120.39 1tm9 h LEU 104 Ca 0.15 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1tm9 h LEU 104 Cb 0.11 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1tm9 h LEU 104 CO -0.14 0.06 -0.37 1.88 0.09 0.00 0.00 178.44 179.96 1tm9 h TYR 105 N 0.28 0.00 -0.96 1.13 0.05 0.67 0.79 116.97 118.94 1tm9 h TYR 105 Ca 0.57 0.00 0.10 0.00 0.05 0.00 0.00 58.73 59.45 1tm9 h TYR 105 Cb 1.68 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 39.29 1tm9 h TYR 105 CO -0.00 0.00 -0.52 0.72 -1.05 0.00 0.00 178.16 177.31 1tm9 n HIS 106 N -4.49 -0.32 -2.74 4.88 8.25 0.33 -4.19 115.22 116.94 1tm9 n HIS 106 Ca -0.05 1.19 -0.05 0.00 -0.26 0.00 0.00 57.72 58.55 1tm9 n HIS 106 Cb 0.19 -0.64 0.02 0.00 1.12 0.00 0.00 29.99 30.69 1tm9 n HIS 106 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1tm9 n PHE 107 N -5.24 -3.22 0.00 4.41 3.72 0.59 -5.06 117.46 112.65 1tm9 n PHE 107 Ca 0.04 -1.32 0.00 0.00 -0.05 0.00 0.00 57.45 56.12 1tm9 n PHE 107 Cb 0.28 1.44 0.00 0.00 -0.94 0.00 0.00 39.48 40.26 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 2.59 2.37 0.00 1.37 0.00 -0.86 -4.75 105.19 105.91 1tm9 n GLY 108 Ca 0.15 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.08 1.61 3.01 -0.60 -5.00 117.46 115.40 1tm9 n PHE 109 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.11 1tm9 n PHE 109 Cb 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.54 1tm9 n PHE 109 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1tm9 n LEU 110 N -1.79 -1.03 -3.73 4.37 4.77 0.17 -4.99 117.00 114.77 1tm9 n LEU 110 Ca 0.00 0.45 -0.12 0.00 -0.03 0.00 0.00 56.01 56.31 1tm9 n LEU 110 Cb 0.32 -1.10 -0.11 0.00 -2.33 0.00 0.00 43.42 40.19 1tm9 n LEU 110 CO 0.00 -3.91 -0.00 -0.54 -1.33 0.00 0.00 177.39 171.61 1tm9 s LYS 111 N -2.74 0.35 -0.30 3.23 1.02 -1.26 -4.64 119.74 115.41 1tm9 s LYS 111 Ca 0.58 0.59 -0.07 0.00 0.02 0.00 0.00 55.97 57.09 1tm9 s LYS 111 Cb -0.29 0.05 0.19 0.00 -0.52 0.00 0.00 37.83 37.26 1tm9 s LYS 111 CO 0.66 -0.11 0.92 0.34 -0.92 0.00 0.00 175.35 176.23 1tm9 s ASP 112 N 0.83 -0.76 0.00 2.83 2.15 -1.26 -5.03 116.67 115.43 1tm9 s ASP 112 Ca -0.05 0.16 0.00 0.00 0.43 0.00 0.00 52.55 53.09 1tm9 s ASP 112 Cb -0.06 1.51 0.00 0.00 -0.30 0.00 0.00 42.92 44.07 1tm9 s ASP 112 CO -0.06 -0.14 0.00 -3.20 -0.17 0.00 0.00 175.17 171.60 1tm9 n ASN 113 N 5.25 0.00 0.00 -0.34 5.15 -1.26 -4.62 115.26 119.44 1tm9 n ASN 113 Ca 0.05 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.03 1tm9 n ASN 113 Cb 0.56 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.81 1tm9 n ASN 113 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1tm9 n ASN 114 N 0.00 0.00 0.00 1.20 5.15 -1.26 -5.02 115.26 115.33 1tm9 n ASN 114 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1tm9 n ASN 114 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1tm9 n ASN 114 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1tm9 n LYS 115 N -0.73 0.00 -1.50 1.20 4.76 -1.26 -5.10 118.16 115.53 1tm9 n LYS 115 Ca 0.00 0.22 -0.02 0.00 -2.87 0.00 0.00 58.31 55.65 1tm9 n LYS 115 Cb 0.00 -0.69 0.00 0.00 -1.84 0.00 0.00 35.03 32.50 1tm9 n LYS 115 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1tm9 n LYS 116 N -2.10 0.18 -1.45 1.97 5.02 -1.26 -5.13 118.16 115.40 1tm9 n LYS 116 Ca 0.00 -0.37 -0.52 0.00 -2.02 0.00 0.00 58.31 55.41 1tm9 n LYS 116 Cb 0.00 0.45 -0.05 0.00 -0.02 0.00 0.00 35.03 35.41 1tm9 n LYS 116 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1tm9 n GLN 117 N -0.09 0.10 0.00 1.97 10.64 -1.26 -4.86 117.38 123.88 1tm9 n GLN 117 Ca -0.01 0.03 0.00 0.00 -1.83 0.00 0.00 57.00 55.19 1tm9 n GLN 117 Cb 0.10 -1.23 0.00 0.00 -0.86 0.00 0.00 30.24 28.24 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 0.57 0.00 0.00 -0.39 3.06 -1.26 -4.96 119.36 116.38 1tm9 n ILE 118 Ca 0.18 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.43 1tm9 n ILE 118 Cb 0.20 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.38 1tm9 n ILE 118 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 1tm9 n ILE 119 N 0.00 0.00 -0.30 9.51 2.08 -1.26 0.20 119.36 129.59 1tm9 n ILE 119 Ca 0.00 1.46 0.19 0.00 0.56 0.00 0.00 62.75 64.97 1tm9 n ILE 119 Cb 0.00 -2.19 0.37 0.00 -0.75 0.00 0.00 39.64 37.07 1tm9 n ILE 119 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1tm9 n LYS 120 N -2.43 -0.06 0.08 0.38 4.81 -1.26 0.18 118.16 119.86 1tm9 n LYS 120 Ca 0.00 1.31 -0.13 0.00 -0.87 0.00 0.00 58.31 58.62 1tm9 n LYS 120 Cb 0.00 -2.18 -0.08 0.00 0.02 0.00 0.00 35.03 32.79 1tm9 n LYS 120 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1tm9 h LYS 121 N 0.00 -0.19 0.24 1.64 1.63 -1.37 -2.21 116.57 116.31 1tm9 h LYS 121 Ca 0.63 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 60.44 1tm9 h LYS 121 Cb 1.48 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 33.14 1tm9 h LYS 121 CO -0.79 0.10 -0.25 0.00 -3.45 0.00 0.00 179.45 175.06 1tm9 h ALA 122 N 0.32 -0.94 -0.90 5.00 0.00 1.30 0.95 119.26 124.98 1tm9 h ALA 122 Ca -0.02 -0.09 0.20 0.00 0.00 0.00 0.00 54.91 54.99 1tm9 h ALA 122 Cb 0.38 0.50 -0.17 0.00 0.00 0.00 0.00 17.79 18.50 1tm9 h ALA 122 CO 0.03 -0.96 -0.17 0.66 0.00 0.00 0.00 179.25 178.82 1tm9 n TYR 123 N -3.87 0.38 -0.08 0.00 4.01 0.22 0.21 117.16 118.04 1tm9 n TYR 123 Ca -0.06 1.10 -0.10 0.00 -0.16 0.00 0.00 57.90 58.67 1tm9 n TYR 123 Cb 0.23 -1.06 0.04 0.00 -0.31 0.00 0.00 39.34 38.23 1tm9 n TYR 123 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 1tm9 h GLU 124 N 0.00 0.79 -0.67 -0.72 4.81 -0.92 0.51 114.58 118.38 1tm9 h GLU 124 Ca 0.46 -0.40 0.19 0.00 -0.13 0.00 0.00 59.36 59.48 1tm9 h GLU 124 Cb 0.76 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.12 1tm9 h GLU 124 CO -0.91 1.03 0.50 0.00 -0.73 0.00 0.00 179.01 178.90 1tm9 h THR 125 N 0.65 0.62 0.00 0.32 1.03 1.03 0.35 112.91 116.91 1tm9 h THR 125 Ca 0.06 0.00 -0.14 0.00 -0.01 0.00 0.00 66.41 66.31 1tm9 h THR 125 Cb 0.93 0.65 -0.02 0.00 -1.07 0.00 0.00 68.15 68.63 1tm9 h THR 125 CO 0.09 0.00 -1.12 -0.38 -0.01 0.00 0.00 175.52 174.09 1tm9 n ILE 126 N -4.25 1.48 -0.39 0.00 5.41 -0.38 -2.52 119.36 118.72 1tm9 n ILE 126 Ca 0.13 0.04 0.38 0.00 1.00 0.00 0.00 62.75 64.30 1tm9 n ILE 126 Cb 0.76 -2.20 0.63 0.00 -0.71 0.00 0.00 39.64 38.12 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 -0.83 3.27 0.00 -1.39 0.00 -0.49 2.50 119.26 122.32 1tm9 h ALA 127 Ca -0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1tm9 h ALA 127 Cb 1.00 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1tm9 h ALA 127 CO -0.13 -1.91 -0.43 0.22 0.00 0.00 0.00 179.25 177.00 1tm9 h ASP 128 N 0.00 0.00 -0.94 0.00 1.82 -1.09 -3.27 116.42 112.94 1tm9 h ASP 128 Ca 0.65 0.00 0.22 0.00 -0.39 0.00 0.00 57.03 57.50 1tm9 h ASP 128 Cb 3.06 0.00 -0.07 0.00 0.68 0.00 0.00 39.33 43.00 1tm9 h ASP 128 CO -0.01 0.68 0.62 0.78 -1.61 0.00 0.00 179.24 179.70 1tm9 h ASN 129 N -0.93 0.42 0.48 2.28 4.21 -0.43 1.64 115.58 123.26 1tm9 h ASN 129 Ca 0.00 0.05 -0.02 0.00 1.21 0.00 0.00 56.30 57.54 1tm9 h ASN 129 Cb 0.43 -0.03 -0.00 0.00 -1.12 0.00 0.00 38.32 37.60 1tm9 h ASN 129 CO 0.00 0.15 -0.11 -0.29 -1.29 0.00 0.00 177.43 175.89 1tm9 h ILE 130 N 0.41 0.46 0.00 2.81 2.10 0.40 0.17 117.51 123.86 1tm9 h ILE 130 Ca 0.50 -0.57 0.00 0.00 1.08 0.00 0.00 64.86 65.87 1tm9 h ILE 130 Cb 1.24 1.39 0.00 0.00 -1.09 0.00 0.00 36.82 38.36 1tm9 h ILE 130 CO -0.20 0.11 0.00 0.00 -1.08 0.00 0.00 178.15 176.98 1tm9 n ALA 131 N -2.24 2.40 -0.06 0.18 0.00 0.56 -2.78 120.51 118.57 1tm9 n ALA 131 Ca -0.01 -0.12 -0.16 0.00 0.00 0.00 0.00 53.44 53.15 1tm9 n ALA 131 Cb 0.26 -1.32 -0.13 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 0.00 0.04 -0.82 0.00 3.58 -0.93 -3.36 116.42 114.94 1tm9 h ASP 132 Ca 0.00 -0.92 -0.55 0.00 0.42 0.00 0.00 57.03 55.98 1tm9 h ASP 132 Cb 0.00 -0.01 -0.31 0.00 1.72 0.00 0.00 39.33 40.72 1tm9 h ASP 132 CO 0.00 1.12 0.16 0.00 -2.88 0.00 0.00 179.24 177.63 1tm9 n TYR 133 N -4.53 2.75 0.00 0.28 0.18 -1.16 -4.73 117.16 109.95 1tm9 n TYR 133 Ca -0.14 -2.47 0.00 0.00 1.88 0.00 0.00 57.90 57.17 1tm9 n TYR 133 Cb 0.55 -0.91 0.00 0.00 -0.38 0.00 0.00 39.34 38.60 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 -0.90 1.19 -2.85 -3.48 4.77 -1.12 -5.05 117.00 109.57 1tm9 n LEU 134 Ca 0.52 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.53 1tm9 n LEU 134 Cb 0.90 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.99 1tm9 n LEU 134 CO 0.56 0.00 0.56 0.21 -1.33 0.00 0.00 177.39 177.40 1tm9 s ASN 135 N -1.00 -0.12 -0.47 -1.43 3.84 -1.26 -5.09 114.94 109.41 1tm9 s ASN 135 Ca 0.00 -0.03 0.06 0.00 0.21 0.00 0.00 52.86 53.10 1tm9 s ASN 135 Cb 0.00 0.47 0.26 0.00 -0.55 0.00 0.00 41.25 41.42 1tm9 s ASN 135 CO 0.00 -0.02 0.89 -0.62 -2.79 0.00 0.00 177.10 174.56 1tm9 n GLU 136 N 4.07 0.82 0.00 0.43 -0.58 -1.26 -5.14 120.64 118.98 1tm9 n GLU 136 Ca 0.07 -1.98 0.16 0.00 -0.42 0.00 0.00 57.16 54.98 1tm9 n GLU 136 Cb 0.62 -1.37 0.91 0.00 -0.57 0.00 0.00 31.44 31.04 1tm9 n GLU 136 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92