#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 -1.34 -3.62 3.17 1.02 -1.26 -4.72 120.64 113.89 1tm9 n GLU 2 Ca 0.00 -0.34 -0.03 0.00 -0.02 0.00 0.00 57.16 56.77 1tm9 n GLU 2 Cb 0.00 -0.55 -0.02 0.00 -0.02 0.00 0.00 31.44 30.84 1tm9 n GLU 2 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1tm9 s GLN 3 N -2.70 0.16 -0.29 3.49 0.00 -1.26 -4.73 119.66 114.33 1tm9 s GLN 3 Ca 0.15 -0.05 -0.19 0.00 -0.00 0.00 0.00 55.36 55.28 1tm9 s GLN 3 Cb -0.03 0.07 0.16 0.00 0.00 0.00 0.00 33.01 33.22 1tm9 s GLN 3 CO 0.13 -0.07 1.11 0.54 0.00 0.00 0.00 175.29 177.00 1tm9 s ASN 4 N -1.93 -0.34 0.00 12.60 2.20 -1.26 -4.78 114.94 121.43 1tm9 s ASN 4 Ca 0.10 0.57 0.00 0.00 -0.94 0.00 0.00 52.86 52.59 1tm9 s ASN 4 Cb -0.01 0.97 0.00 0.00 -2.00 0.00 0.00 41.25 40.21 1tm9 s ASN 4 CO -0.04 -0.09 0.00 -3.20 -2.94 0.00 0.00 177.10 170.83 1tm9 n ASN 5 N 3.04 0.00 0.00 3.54 5.15 -1.26 -4.13 115.26 121.60 1tm9 n ASN 5 Ca -0.16 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.82 1tm9 n ASN 5 Cb 0.57 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.82 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 0.00 -0.33 -1.44 2.08 -1.26 0.45 119.36 118.87 1tm9 n ILE 6 Ca 0.00 1.00 -0.08 0.00 0.56 0.00 0.00 62.75 64.24 1tm9 n ILE 6 Cb 0.00 -1.36 -0.06 0.00 -0.75 0.00 0.00 39.64 37.47 1tm9 n ILE 6 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1tm9 n LYS 7 N -2.40 -0.32 -0.13 0.38 4.76 -1.26 0.14 118.16 119.32 1tm9 n LYS 7 Ca 0.00 1.19 -0.05 0.00 -2.87 0.00 0.00 58.31 56.57 1tm9 n LYS 7 Cb 0.00 -1.74 0.01 0.00 -1.84 0.00 0.00 35.03 31.46 1tm9 n LYS 7 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1tm9 h GLU 8 N 0.00 -0.13 -0.97 1.97 4.81 -0.15 0.25 114.58 120.35 1tm9 h GLU 8 Ca 0.14 0.01 0.21 0.00 -0.13 0.00 0.00 59.36 59.59 1tm9 h GLU 8 Cb 0.34 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.64 1tm9 h GLU 8 CO -0.74 -0.09 0.55 1.96 -0.73 0.00 0.00 179.01 179.97 1tm9 h GLN 9 N -0.13 0.62 0.55 1.92 4.20 0.59 0.20 115.11 123.06 1tm9 h GLN 9 Ca 0.20 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 1tm9 h GLN 9 Cb 0.45 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 28.10 1tm9 h GLN 9 CO -0.51 0.41 -0.27 -0.07 -0.67 0.00 0.00 178.83 177.72 1tm9 h LEU 10 N 0.64 -0.63 -0.72 1.46 3.38 0.18 -2.86 115.31 116.76 1tm9 h LEU 10 Ca 0.58 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.64 1tm9 h LEU 10 Cb 1.00 0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.83 1tm9 h LEU 10 CO -0.43 -0.31 -0.42 -0.38 0.09 0.00 0.00 178.44 176.98 1tm9 n ILE 11 N -4.76 -0.49 -0.07 1.22 -0.00 0.31 -0.75 119.36 114.83 1tm9 n ILE 11 Ca -0.09 2.12 -0.02 0.00 -0.00 0.00 0.00 62.75 64.76 1tm9 n ILE 11 Cb 0.29 -2.66 -0.02 0.00 -0.00 0.00 0.00 39.64 37.26 1tm9 n ILE 11 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 1tm9 n SER 12 N -4.63 -0.17 -0.14 4.38 2.88 -0.01 0.21 113.62 116.15 1tm9 n SER 12 Ca 0.01 1.04 -0.07 0.00 -1.33 0.00 0.00 58.87 58.52 1tm9 n SER 12 Cb 0.19 -0.42 -0.06 0.00 -0.75 0.00 0.00 64.21 63.17 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 -1.03 0.00 0.66 0.04 -0.91 1.20 116.94 116.90 1tm9 h PHE 13 Ca 0.03 0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.85 1tm9 h PHE 13 Cb 0.06 0.50 0.00 0.00 2.20 0.00 0.00 35.95 38.71 1tm9 h PHE 13 CO -0.88 -0.26 0.08 0.34 -0.60 0.00 0.00 178.31 176.99 1tm9 n PHE 14 N -4.27 0.64 0.06 -0.55 7.35 0.07 -0.27 117.46 120.49 1tm9 n PHE 14 Ca -0.01 0.33 -0.15 0.00 -0.76 0.00 0.00 57.45 56.86 1tm9 n PHE 14 Cb 0.18 -0.98 -0.06 0.00 0.35 0.00 0.00 39.48 38.97 1tm9 n PHE 14 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 1tm9 h ASN 15 N 0.00 0.63 0.22 -2.13 -0.73 1.18 -1.90 115.58 112.86 1tm9 h ASN 15 Ca 0.00 -0.51 0.00 0.00 1.87 0.00 0.00 56.30 57.66 1tm9 h ASN 15 Cb 0.15 -0.19 0.00 0.00 0.27 0.00 0.00 38.32 38.55 1tm9 h ASN 15 CO 0.00 1.32 0.00 0.00 -0.37 0.00 0.00 177.43 178.38 1tm9 n GLN 16 N -3.77 0.43 0.00 6.67 1.13 0.63 -4.09 117.38 118.38 1tm9 n GLN 16 Ca -0.08 0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1tm9 n GLN 16 Cb 0.86 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.71 1tm9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1tm9 n ALA 17 N -1.17 0.49 -3.44 -1.58 0.00 -1.09 -4.78 120.51 108.94 1tm9 n ALA 17 Ca 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.50 1tm9 n ALA 17 Cb 0.12 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.51 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 5.39 0.00 0.00 0.00 7.64 -1.26 -4.76 113.62 120.64 1tm9 n SER 19 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1tm9 n SER 19 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 0.00 0.00 0.00 0.44 -2.24 -1.26 -4.27 114.28 106.95 1tm9 n THR 20 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1tm9 n THR 20 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 0.00 0.00 -0.28 4.78 8.25 -1.26 -4.72 115.22 121.99 1tm9 n HIS 21 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.61 1tm9 n HIS 21 Cb 0.00 0.00 0.28 0.00 1.12 0.00 0.00 29.99 31.39 1tm9 n HIS 21 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1tm9 n GLN 22 N -1.48 -0.06 -0.26 -0.41 1.13 -1.26 0.14 117.38 115.17 1tm9 n GLN 22 Ca 0.00 1.20 0.19 0.00 -1.94 0.00 0.00 57.00 56.44 1tm9 n GLN 22 Cb 0.00 -1.94 0.35 0.00 0.11 0.00 0.00 30.24 28.76 1tm9 n GLN 22 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1tm9 n GLU 23 N -5.09 -0.06 0.06 -1.09 4.71 -1.26 0.14 120.64 118.04 1tm9 n GLU 23 Ca 0.21 1.14 -0.03 0.00 -0.01 0.00 0.00 57.16 58.48 1tm9 n GLU 23 Cb 0.70 -1.93 -0.01 0.00 -1.01 0.00 0.00 31.44 29.18 1tm9 n GLU 23 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1tm9 h ARG 24 N 0.00 -0.16 -0.39 3.49 3.08 0.10 1.53 114.38 122.04 1tm9 h ARG 24 Ca 0.58 0.01 0.11 0.00 0.07 0.00 0.00 59.98 60.75 1tm9 h ARG 24 Cb 1.40 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.47 1tm9 h ARG 24 CO -0.68 -0.11 0.28 -0.07 -1.07 0.00 0.00 179.97 178.32 1tm9 h LEU 25 N -0.17 0.01 -0.73 3.04 3.38 -0.70 0.68 115.31 120.82 1tm9 h LEU 25 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1tm9 h LEU 25 Cb 0.14 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1tm9 h LEU 25 CO 0.00 0.00 -0.45 0.44 0.09 0.00 0.00 178.44 178.53 1tm9 h ASP 26 N 0.01 0.00 0.34 -0.43 5.19 0.17 -3.24 116.42 118.46 1tm9 h ASP 26 Ca 0.18 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.58 1tm9 h ASP 26 Cb 0.73 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.24 1tm9 h ASP 26 CO -0.00 0.45 -0.16 0.15 -3.12 0.00 0.00 179.24 176.55 1tm9 h PHE 27 N 0.00 -0.42 -1.93 4.55 3.04 0.84 0.78 116.94 123.80 1tm9 h PHE 27 Ca -0.00 -0.01 0.56 0.00 3.98 0.00 0.00 57.97 62.50 1tm9 h PHE 27 Cb 1.03 0.14 -0.08 0.00 2.56 0.00 0.00 35.95 39.60 1tm9 h PHE 27 CO 0.00 -0.26 1.39 0.44 -2.02 0.00 0.00 178.31 177.85 1tm9 n ILE 28 N -4.24 -0.00 -0.06 1.41 -5.35 -0.82 0.19 119.36 110.49 1tm9 n ILE 28 Ca -0.06 1.46 -0.04 0.00 -0.27 0.00 0.00 62.75 63.85 1tm9 n ILE 28 Cb 0.18 -2.43 -0.01 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 h SER 30 N -0.97 -0.38 0.00 0.00 4.64 0.48 0.51 113.55 117.83 1tm9 h SER 30 Ca 0.00 0.21 -0.31 0.00 -0.47 0.00 0.00 61.79 61.21 1tm9 h SER 30 Cb 0.39 0.36 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 1tm9 h SER 30 CO 0.00 -0.20 1.21 0.41 -0.87 0.00 0.00 176.83 177.38 1tm9 n THR 31 N -5.37 2.91 0.00 2.95 -1.04 0.51 -2.76 114.28 111.49 1tm9 n THR 31 Ca 0.14 -1.59 0.00 0.00 -2.04 0.00 0.00 64.05 60.56 1tm9 n THR 31 Cb 0.49 -2.12 0.00 0.00 -1.82 0.00 0.00 70.33 66.89 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 3.09 0.00 -0.76 -2.82 0.00 -0.30 -4.89 116.66 110.98 1tm9 n ARG 32 Ca 0.47 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 58.18 1tm9 n ARG 32 Cb 0.53 0.00 0.11 0.00 0.00 0.00 0.00 32.46 33.10 1tm9 n ARG 32 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1tm9 n GLU 33 N 0.00 1.77 0.00 -0.14 -0.58 0.16 -4.64 120.64 117.21 1tm9 n GLU 33 Ca 0.00 -1.84 0.00 0.00 -0.42 0.00 0.00 57.16 54.90 1tm9 n GLU 33 Cb 0.00 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.15 1tm9 n GLU 33 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1tm9 n SER 34 N -0.50 0.00 0.04 1.62 2.88 -1.23 -4.94 113.62 111.50 1tm9 n SER 34 Ca 0.37 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.91 1tm9 n SER 34 Cb 1.21 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.67 1tm9 n SER 34 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1tm9 n ASP 35 N 0.00 -0.75 0.00 -3.46 2.03 -1.26 -5.14 116.55 107.96 1tm9 n ASP 35 Ca 0.00 0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.57 1tm9 n ASP 35 Cb 0.00 0.94 0.00 0.00 -0.72 0.00 0.00 41.12 41.34 1tm9 n ASP 35 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1tm9 n THR 36 N -2.60 0.00 -0.10 5.18 5.66 -1.26 -5.06 114.28 116.11 1tm9 n THR 36 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1tm9 n THR 36 Cb 0.00 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.64 1tm9 n THR 36 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 175.07 174.24 1tm9 n PHE 37 N 0.00 0.00 1.71 1.09 -1.74 -1.26 -4.21 117.46 113.05 1tm9 n PHE 37 Ca 0.00 0.00 0.05 0.00 -0.56 0.00 0.00 57.45 56.94 1tm9 n PHE 37 Cb 0.00 -0.92 0.26 0.00 1.52 0.00 0.00 39.48 40.34 1tm9 n PHE 37 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1tm9 n SER 38 N -2.75 0.54 -0.05 5.98 2.88 -1.26 -3.00 113.62 115.96 1tm9 n SER 38 Ca -0.32 -1.77 -0.01 0.00 -1.33 0.00 0.00 58.87 55.45 1tm9 n SER 38 Cb 1.09 -0.05 -0.13 0.00 -0.75 0.00 0.00 64.21 64.36 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 -0.31 0.96 -4.42 -3.46 7.64 -1.26 -5.00 113.62 107.77 1tm9 n SER 39 Ca 0.09 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.63 1tm9 n SER 39 Cb 0.12 1.29 0.11 0.00 -1.01 0.00 0.00 64.21 64.71 1tm9 n SER 39 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1tm9 n VAL 40 N -2.40 0.45 0.35 0.44 0.31 -1.16 -4.91 118.33 111.41 1tm9 n VAL 40 Ca -0.17 -0.25 -0.17 0.00 -0.01 0.00 0.00 64.34 63.75 1tm9 n VAL 40 Cb 0.79 -0.64 -0.09 0.00 -0.91 0.00 0.00 33.84 32.99 1tm9 n VAL 40 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1tm9 h ASP 41 N -1.26 -0.73 -0.91 4.52 5.19 -1.93 -3.44 116.42 117.86 1tm9 h ASP 41 Ca -0.44 -0.01 -0.65 0.00 -0.62 0.00 0.00 57.03 55.32 1tm9 h ASP 41 Cb 1.30 0.19 0.08 0.00 0.18 0.00 0.00 39.33 41.08 1tm9 h ASP 41 CO 0.36 -0.46 -0.31 0.55 -3.12 0.00 0.00 179.24 176.27 1tm9 n VAL 42 N -5.42 1.24 -2.53 -1.35 3.14 -1.26 -4.86 118.33 107.28 1tm9 n VAL 42 Ca -0.13 -0.31 -0.36 0.00 -2.96 0.00 0.00 64.34 60.58 1tm9 n VAL 42 Cb 0.36 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.11 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 -0.62 4.10 0.33 1.45 0.04 -1.26 -4.95 135.00 134.10 1tm9 s PRO 43 Ca 0.66 1.50 0.21 0.00 0.04 0.00 0.00 61.00 63.41 1tm9 s PRO 43 Cb -0.95 -2.48 0.18 0.00 0.04 0.00 0.00 34.50 31.29 1tm9 s PRO 43 CO 0.51 -0.19 1.41 -0.07 0.04 0.00 0.00 177.00 178.70 1tm9 h LEU 44 N 2.36 0.00 0.04 -3.56 3.38 -1.93 -2.99 115.31 112.61 1tm9 h LEU 44 Ca -0.48 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.51 1tm9 h LEU 44 Cb 1.22 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 1tm9 h LEU 44 CO 0.62 0.15 -0.43 -0.33 0.09 0.00 0.00 178.44 178.54 1tm9 h GLU 45 N 0.00 -0.59 -0.02 1.13 4.39 -1.97 0.47 114.58 117.99 1tm9 h GLU 45 Ca -0.01 0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.63 1tm9 h GLU 45 Cb 1.12 0.13 0.01 0.00 -0.10 0.00 0.00 28.75 29.91 1tm9 h GLU 45 CO 0.02 -0.39 -0.35 -1.00 -1.16 0.00 0.00 179.01 176.12 1tm9 h PRO 46 N -0.61 0.28 -0.90 2.33 0.13 -1.87 -3.24 132.00 128.12 1tm9 h PRO 46 Ca 0.04 -0.27 0.22 0.00 -0.87 0.00 0.00 66.00 65.12 1tm9 h PRO 46 Cb 0.67 0.07 -0.12 0.00 0.13 0.00 0.00 31.00 31.75 1tm9 h PRO 46 CO -0.30 0.96 0.41 0.82 -0.23 0.00 0.00 178.00 179.66 1tm9 h ILE 47 N -0.30 0.49 -0.59 -3.56 1.08 -1.41 1.56 117.51 114.77 1tm9 h ILE 47 Ca -0.04 -0.14 0.17 0.00 -0.39 0.00 0.00 64.86 64.46 1tm9 h ILE 47 Cb 1.06 0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 1tm9 h ILE 47 CO 0.07 0.08 0.53 0.11 -0.69 0.00 0.00 178.15 178.25 1tm9 h LYS 48 N 0.42 0.00 -0.01 2.37 6.56 -0.07 0.65 116.57 126.49 1tm9 h LYS 48 Ca 0.56 0.00 -0.19 0.00 -1.06 0.00 0.00 60.65 59.96 1tm9 h LYS 48 Cb 1.05 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.73 1tm9 h LYS 48 CO -0.52 0.00 -0.75 -0.97 -2.06 0.00 0.00 179.45 175.15 1tm9 h ASN 49 N 0.00 0.67 -0.05 0.86 -0.73 0.21 -2.85 115.58 113.70 1tm9 h ASN 49 Ca 0.28 -0.74 0.00 0.00 1.87 0.00 0.00 56.30 57.70 1tm9 h ASN 49 Cb 1.34 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 39.73 1tm9 h ASN 49 CO -0.00 1.33 0.00 2.30 -0.37 0.00 0.00 177.43 180.69 1tm9 n ILE 50 N -4.09 0.06 -0.05 2.57 -5.35 0.18 -2.84 119.36 109.84 1tm9 n ILE 50 Ca -0.10 -0.09 0.01 0.00 -0.27 0.00 0.00 62.75 62.29 1tm9 n ILE 50 Cb 0.74 -0.09 -0.16 0.00 -1.74 0.00 0.00 39.64 38.40 1tm9 n ILE 50 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1tm9 n ILE 51 N -0.46 0.73 -0.60 7.28 5.41 0.16 -4.26 119.36 127.61 1tm9 n ILE 51 Ca 0.13 -0.68 -0.14 0.00 1.00 0.00 0.00 62.75 63.06 1tm9 n ILE 51 Cb 0.12 -0.27 0.05 0.00 -0.71 0.00 0.00 39.64 38.83 1tm9 n ILE 51 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1tm9 n GLU 52 N -2.53 1.68 -0.04 0.38 1.02 -1.09 -3.63 120.64 116.42 1tm9 n GLU 52 Ca -0.18 -1.40 -0.04 0.00 -0.02 0.00 0.00 57.16 55.53 1tm9 n GLU 52 Cb 0.86 -1.55 -0.08 0.00 -0.02 0.00 0.00 31.44 30.65 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 0.25 0.60 -0.97 -3.67 0.13 -1.26 -4.48 119.36 109.95 1tm9 n ILE 53 Ca 0.27 -0.40 0.05 0.00 -1.10 0.00 0.00 62.75 61.58 1tm9 n ILE 53 Cb 0.70 -0.63 0.34 0.00 -0.84 0.00 0.00 39.64 39.21 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 -2.31 2.64 0.32 9.51 -2.24 -1.24 -4.56 114.28 116.41 1tm9 n THR 54 Ca -0.14 -1.63 -0.16 0.00 -2.27 0.00 0.00 64.05 59.84 1tm9 n THR 54 Cb 0.76 -0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 68.62 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 3.04 -0.76 -7.08 -0.78 2.10 -1.79 -3.38 116.57 107.92 1tm9 h LYS 55 Ca 0.04 0.05 -0.54 0.00 -2.00 0.00 0.00 60.65 58.21 1tm9 h LYS 55 Cb 1.86 0.17 0.12 0.00 -0.90 0.00 0.00 32.23 33.49 1tm9 h LYS 55 CO 0.44 -0.47 0.52 -0.51 -2.00 0.00 0.00 179.45 177.43 1tm9 s ASP 56 N -4.56 5.17 0.05 7.07 1.11 -1.26 -4.90 116.67 119.34 1tm9 s ASP 56 Ca -0.16 2.52 -0.23 0.00 0.18 0.00 0.00 52.55 54.86 1tm9 s ASP 56 Cb 0.03 -2.61 -0.15 0.00 1.07 0.00 0.00 42.92 41.25 1tm9 s ASP 56 CO 0.58 -1.61 1.51 1.05 1.18 0.00 0.00 175.17 177.88 1tm9 h GLU 57 N 1.06 0.10 -1.05 8.23 4.11 -1.98 -2.43 114.58 122.62 1tm9 h GLU 57 Ca -0.51 -0.03 0.28 0.00 0.07 0.00 0.00 59.36 59.17 1tm9 h GLU 57 Cb 1.30 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 30.46 1tm9 h GLU 57 CO 0.56 0.32 0.70 -0.91 0.07 0.00 0.00 179.01 179.74 1tm9 h ASN 58 N -0.13 0.34 0.60 3.06 2.35 -1.95 -0.17 115.58 119.68 1tm9 h ASN 58 Ca 0.02 0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1tm9 h ASN 58 Cb 0.27 0.01 0.01 0.00 0.05 0.00 0.00 38.32 38.65 1tm9 h ASN 58 CO 0.00 0.07 -0.29 1.56 -1.65 0.00 0.00 177.43 177.12 1tm9 h GLN 59 N 0.30 -0.78 -0.88 0.81 1.08 -1.77 0.21 115.11 114.09 1tm9 h GLN 59 Ca 0.58 0.05 0.24 0.00 -1.45 0.00 0.00 58.65 58.07 1tm9 h GLN 59 Cb 1.64 0.18 -0.14 0.00 -0.05 0.00 0.00 27.48 29.10 1tm9 h GLN 59 CO -0.23 -0.47 0.23 1.96 -0.95 0.00 0.00 178.83 179.36 1tm9 h GLN 60 N -1.11 0.19 0.44 1.46 4.20 -0.67 1.47 115.11 121.09 1tm9 h GLN 60 Ca -0.08 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 1tm9 h GLN 60 Cb 0.67 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.41 1tm9 h GLN 60 CO 0.14 0.12 -0.21 0.82 -0.67 0.00 0.00 178.83 179.03 1tm9 h ILE 61 N 0.19 0.00 -0.68 2.54 2.04 -1.17 -1.49 117.51 118.95 1tm9 h ILE 61 Ca 0.56 -0.27 0.20 0.00 1.00 0.00 0.00 64.86 66.34 1tm9 h ILE 61 Cb 1.13 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1tm9 h ILE 61 CO -0.67 0.00 0.67 -0.33 0.00 0.00 0.00 178.15 177.81 1tm9 h GLU 62 N -0.86 0.00 -0.08 2.37 5.08 0.47 0.52 114.58 122.08 1tm9 h GLU 62 Ca -0.06 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1tm9 h GLU 62 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1tm9 h GLU 62 CO 0.10 0.00 -0.23 0.82 -1.00 0.00 0.00 179.01 178.70 1tm9 h ILE 63 N 0.00 1.42 -0.45 3.13 2.04 0.22 -0.05 117.51 123.81 1tm9 h ILE 63 Ca 0.32 -1.59 0.09 0.00 1.00 0.00 0.00 64.86 64.69 1tm9 h ILE 63 Cb 1.65 2.24 -0.10 0.00 -0.74 0.00 0.00 36.82 39.87 1tm9 h ILE 63 CO -0.00 0.45 -0.24 0.74 0.00 0.00 0.00 178.15 179.10 1tm9 h THR 64 N -0.19 0.33 -0.35 -0.27 2.02 0.11 0.94 112.91 115.51 1tm9 h THR 64 Ca -0.01 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.09 1tm9 h THR 64 Cb 0.85 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1tm9 h THR 64 CO 0.05 0.00 -0.11 0.11 0.37 0.00 0.00 175.52 175.94 1tm9 h LYS 65 N -0.15 0.69 -0.15 6.66 1.57 -1.52 -2.44 116.57 121.23 1tm9 h LYS 65 Ca 0.21 -0.27 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1tm9 h LYS 65 Cb 0.48 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.70 1tm9 h LYS 65 CO -0.54 0.86 -0.24 0.82 -0.57 0.00 0.00 179.45 179.78 1tm9 h ILE 66 N 0.47 0.42 -0.73 1.86 2.04 0.61 1.49 117.51 123.68 1tm9 h ILE 66 Ca 0.08 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.07 1tm9 h ILE 66 Cb 0.62 0.42 -0.09 0.00 -0.74 0.00 0.00 36.82 37.04 1tm9 h ILE 66 CO 0.04 0.00 0.30 0.00 0.00 0.00 0.00 178.15 178.49 1tm9 h ALA 67 N 0.68 1.01 -0.06 1.87 0.00 0.92 -0.99 119.26 122.69 1tm9 h ALA 67 Ca 0.11 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1tm9 h ALA 67 Cb 0.45 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1tm9 h ALA 67 CO -0.32 -0.17 0.00 0.28 0.00 0.00 0.00 179.25 179.04 1tm9 h VAL 68 N 0.47 1.25 -0.86 0.00 2.07 -0.57 0.19 116.25 118.81 1tm9 h VAL 68 Ca 0.39 -0.76 0.35 0.00 0.82 0.00 0.00 66.70 67.50 1tm9 h VAL 68 Cb 0.54 1.64 -0.15 0.00 -1.52 0.00 0.00 31.29 31.80 1tm9 h VAL 68 CO -0.36 0.21 0.47 -3.20 0.02 0.00 0.00 177.57 174.71 1tm9 n ASN 69 N -4.87 0.28 -0.07 0.57 5.15 0.49 0.20 115.26 117.01 1tm9 n ASN 69 Ca -0.07 1.35 -0.05 0.00 -0.60 0.00 0.00 54.58 55.21 1tm9 n ASN 69 Cb 0.19 -0.66 -0.02 0.00 -0.53 0.00 0.00 39.78 38.76 1tm9 n ASN 69 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 1tm9 h ASN 70 N 0.00 0.00 -0.96 1.20 -0.73 -1.18 -3.34 115.58 110.57 1tm9 h ASN 70 Ca 0.70 -0.04 0.17 0.00 1.87 0.00 0.00 56.30 59.00 1tm9 h ASN 70 Cb 1.91 0.00 -0.17 0.00 0.27 0.00 0.00 38.32 40.33 1tm9 h ASN 70 CO -0.61 0.76 -0.33 0.40 -0.37 0.00 0.00 177.43 177.28 1tm9 h ILE 71 N -1.00 0.02 -0.88 2.57 1.08 0.17 1.53 117.51 121.01 1tm9 h ILE 71 Ca -0.02 0.00 0.23 0.00 -0.39 0.00 0.00 64.86 64.68 1tm9 h ILE 71 Cb 0.49 0.02 -0.15 0.00 -3.07 0.00 0.00 36.82 34.11 1tm9 h ILE 71 CO -0.01 0.00 0.18 0.50 -0.69 0.00 0.00 178.15 178.13 1tm9 h LYS 72 N -0.01 0.16 -0.24 2.37 3.11 0.20 1.39 116.57 123.55 1tm9 h LYS 72 Ca 0.39 -0.01 -0.09 0.00 -2.81 0.00 0.00 60.65 58.13 1tm9 h LYS 72 Cb 0.64 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.82 1tm9 h LYS 72 CO -0.98 0.11 -0.23 1.15 -2.81 0.00 0.00 179.45 176.69 1tm9 h THR 73 N 0.16 1.26 0.00 1.00 2.02 0.20 -1.54 112.91 116.00 1tm9 h THR 73 Ca 0.54 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 66.52 1tm9 h THR 73 Cb 1.10 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.83 1tm9 h THR 73 CO -0.69 0.38 0.00 -0.07 0.37 0.00 0.00 175.52 175.51 1tm9 h LEU 74 N 0.40 0.00 -4.26 2.58 3.38 0.36 -3.11 115.31 114.67 1tm9 h LEU 74 Ca 0.06 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.73 1tm9 h LEU 74 Cb 0.62 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1tm9 h LEU 74 CO 0.04 0.00 0.64 -1.20 0.09 0.00 0.00 178.44 178.01 1tm9 n SER 75 N -2.32 5.98 0.07 -0.43 7.64 -0.58 -3.77 113.62 120.20 1tm9 n SER 75 Ca -0.01 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.38 1tm9 n SER 75 Cb 0.06 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 61.83 1tm9 n SER 75 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1tm9 n SER 76 N 2.78 -1.17 -3.48 6.43 2.88 -1.17 -5.09 113.62 114.80 1tm9 n SER 76 Ca 0.51 0.39 -0.38 0.00 -1.33 0.00 0.00 58.87 58.06 1tm9 n SER 76 Cb 0.74 1.33 0.04 0.00 -0.75 0.00 0.00 64.21 65.56 1tm9 n SER 76 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1tm9 n VAL 77 N -2.66 -3.71 -3.27 2.46 0.31 -1.25 -4.98 118.33 105.24 1tm9 n VAL 77 Ca 0.00 0.09 -0.04 0.00 -0.01 0.00 0.00 64.34 64.38 1tm9 n VAL 77 Cb 0.00 -3.44 -0.05 0.00 -0.91 0.00 0.00 33.84 29.44 1tm9 n VAL 77 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1tm9 s GLY 78 N -1.42 -0.68 0.00 2.92 0.00 -1.26 -4.93 107.32 101.96 1tm9 s GLY 78 Ca 0.37 1.08 0.00 0.00 0.00 0.00 0.00 44.72 46.17 1tm9 s GLY 78 CO 0.83 3.01 0.00 0.00 0.00 0.00 0.00 173.10 176.94 1tm9 n ALA 79 N 5.39 0.00 -3.20 3.20 0.00 -1.26 -5.04 120.51 119.59 1tm9 n ALA 79 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.19 1tm9 n ALA 79 Cb 0.51 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.97 -0.40 0.00 0.00 5.66 -1.26 -5.09 114.28 112.22 1tm9 n THR 80 Ca 0.00 -4.17 0.00 0.00 -3.05 0.00 0.00 64.05 56.83 1tm9 n THR 80 Cb 0.00 -1.78 0.00 0.00 -1.55 0.00 0.00 70.33 67.00 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 1.24 -0.33 0.84 1.09 0.00 -1.26 -4.96 105.19 101.80 1tm9 n GLY 81 Ca 0.22 -1.28 -0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.99 0.03 -1.40 1.61 7.27 -1.26 -4.84 117.38 117.80 1tm9 n GLN 82 Ca 0.00 0.01 -0.36 0.00 0.07 0.00 0.00 57.00 56.72 1tm9 n GLN 82 Cb 0.00 -0.24 0.09 0.00 2.41 0.00 0.00 30.24 32.49 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1tm9 n TYR 83 N -2.82 0.96 1.60 3.69 4.01 -1.26 -4.86 117.16 118.49 1tm9 n TYR 83 Ca -0.01 0.40 0.11 0.00 -0.16 0.00 0.00 57.90 58.25 1tm9 n TYR 83 Cb 0.02 -2.12 0.67 0.00 -0.31 0.00 0.00 39.34 37.61 1tm9 n TYR 83 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1tm9 n MET 84 N -2.02 0.80 0.03 -0.72 2.81 -1.26 -3.01 117.12 113.74 1tm9 n MET 84 Ca 0.14 0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.83 1tm9 n MET 84 Cb 0.49 -1.44 -0.14 0.00 -0.71 0.00 0.00 33.22 31.42 1tm9 n MET 84 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1tm9 h ALA 85 N 3.48 -0.03 -0.01 3.04 0.00 -1.94 -3.24 119.26 120.56 1tm9 h ALA 85 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1tm9 h ALA 85 Cb 0.00 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1tm9 h ALA 85 CO 0.00 0.41 0.02 0.77 0.00 0.00 0.00 179.25 180.46 1tm9 h SER 86 N -0.45 0.00 -0.66 0.00 0.02 -1.91 -2.49 113.55 108.06 1tm9 h SER 86 Ca -0.16 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.42 1tm9 h SER 86 Cb 1.58 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.98 1tm9 h SER 86 CO 0.11 0.00 0.22 0.33 -1.14 0.00 0.00 176.83 176.35 1tm9 n PHE 87 N -3.56 1.18 0.00 3.45 -0.00 -1.22 -3.76 117.46 113.55 1tm9 n PHE 87 Ca -0.03 -1.81 0.00 0.00 -0.00 0.00 0.00 57.45 55.62 1tm9 n PHE 87 Cb 0.10 -1.27 0.00 0.00 -0.00 0.00 0.00 39.48 38.31 1tm9 n PHE 87 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1tm9 n PHE 88 N 1.10 -0.63 -0.32 -5.13 3.72 -0.94 -4.76 117.46 110.50 1tm9 n PHE 88 Ca 0.40 0.00 0.31 0.00 -0.05 0.00 0.00 57.45 58.11 1tm9 n PHE 88 Cb 0.63 0.18 0.57 0.00 -0.94 0.00 0.00 39.48 39.92 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 0.32 0.00 4.37 0.87 -1.65 -1.20 113.55 116.26 1tm9 h SER 89 Ca 0.00 0.25 -0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1tm9 h SER 89 Cb 0.00 0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1tm9 h SER 89 CO 0.00 -0.41 -0.23 0.71 -0.53 0.00 0.00 176.83 176.37 1tm9 h THR 90 N 0.03 0.06 -1.14 2.23 1.35 -1.91 -3.42 112.91 110.12 1tm9 h THR 90 Ca 0.83 -1.05 -0.61 0.00 -0.55 0.00 0.00 66.41 65.03 1tm9 h THR 90 Cb 2.17 0.12 -0.10 0.00 -1.73 0.00 0.00 68.15 68.61 1tm9 h THR 90 CO -0.76 0.02 1.53 0.21 -0.25 0.00 0.00 175.52 176.27 1tm9 s ASN 91 N -5.66 6.53 -0.17 5.36 3.84 -0.46 -4.11 114.94 120.26 1tm9 s ASN 91 Ca -0.07 -1.54 -0.22 0.00 0.21 0.00 0.00 52.86 51.25 1tm9 s ASN 91 Cb 0.01 -2.56 -0.22 0.00 -0.55 0.00 0.00 41.25 37.92 1tm9 s ASN 91 CO 0.11 -1.47 0.40 0.77 -2.79 0.00 0.00 177.10 174.12 1tm9 h SER 92 N 9.62 0.07 -0.88 -4.21 4.64 -1.79 -2.75 113.55 118.26 1tm9 h SER 92 Ca 0.22 -0.69 0.14 0.00 -0.47 0.00 0.00 61.79 60.99 1tm9 h SER 92 Cb 1.00 -0.02 -0.15 0.00 -0.31 0.00 0.00 62.40 62.92 1tm9 h SER 92 CO 1.42 1.42 -0.32 1.21 -0.87 0.00 0.00 176.83 179.69 1tm9 n GLU 93 N -4.36 -0.18 -0.03 4.77 2.13 -1.26 0.23 120.64 121.93 1tm9 n GLU 93 Ca -0.26 1.35 -0.14 0.00 0.66 0.00 0.00 57.16 58.77 1tm9 n GLU 93 Cb 0.68 -2.01 -0.11 0.00 0.27 0.00 0.00 31.44 30.27 1tm9 n GLU 93 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1tm9 h PRO 94 N 0.00 0.10 -0.08 5.31 0.13 -1.97 -2.82 132.00 132.67 1tm9 h PRO 94 Ca 0.33 -0.10 0.02 0.00 -0.87 0.00 0.00 66.00 65.38 1tm9 h PRO 94 Cb 0.55 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.70 1tm9 h PRO 94 CO -0.88 0.82 0.31 0.00 -0.23 0.00 0.00 178.00 178.03 1tm9 h ALA 95 N 0.28 1.47 0.02 -0.56 0.00 -0.59 0.12 119.26 120.00 1tm9 h ALA 95 Ca -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1tm9 h ALA 95 Cb 0.86 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1tm9 h ALA 95 CO 0.02 -0.35 -0.01 0.82 0.00 0.00 0.00 179.25 179.73 1tm9 h ILE 96 N 0.00 1.16 -0.61 0.00 2.04 0.29 -2.19 117.51 118.19 1tm9 h ILE 96 Ca 0.04 -1.76 0.08 0.00 1.00 0.00 0.00 64.86 64.21 1tm9 h ILE 96 Cb 0.66 2.15 -0.06 0.00 -0.74 0.00 0.00 36.82 38.83 1tm9 h ILE 96 CO -0.00 0.38 0.28 0.40 0.00 0.00 0.00 178.15 179.21 1tm9 h ILE 97 N -0.96 0.85 -0.50 -0.67 5.03 -0.73 0.39 117.51 120.92 1tm9 h ILE 97 Ca -0.00 -0.17 -0.04 0.00 -0.12 0.00 0.00 64.86 64.53 1tm9 h ILE 97 Cb 0.64 0.30 -0.02 0.00 -3.03 0.00 0.00 36.82 34.71 1tm9 h ILE 97 CO 0.01 0.09 0.16 0.15 -0.68 0.00 0.00 178.15 177.88 1tm9 h PHE 98 N 0.50 0.75 0.57 1.37 3.57 -0.97 0.42 116.94 123.15 1tm9 h PHE 98 Ca 0.30 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.72 1tm9 h PHE 98 Cb 0.30 -0.23 0.01 0.00 2.79 0.00 0.00 35.95 38.82 1tm9 h PHE 98 CO -0.13 0.61 -0.27 0.00 -2.23 0.00 0.00 178.31 176.29 1tm9 h VAL 100 N -1.17 0.82 0.23 0.00 2.07 -0.20 -1.65 116.25 116.36 1tm9 h VAL 100 Ca -0.08 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1tm9 h VAL 100 Cb 0.61 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1tm9 h VAL 100 CO 0.13 0.15 -0.11 0.40 0.02 0.00 0.00 177.57 178.16 1tm9 h ILE 101 N 0.83 0.69 0.00 4.57 1.08 -0.08 -2.62 117.51 121.99 1tm9 h ILE 101 Ca 0.51 -0.92 0.00 0.00 -0.39 0.00 0.00 64.86 64.06 1tm9 h ILE 101 Cb 0.70 1.12 0.00 0.00 -3.07 0.00 0.00 36.82 35.58 1tm9 h ILE 101 CO -0.28 0.16 0.00 0.00 -0.69 0.00 0.00 178.15 177.34 1tm9 n TYR 102 N -5.01 0.00 -0.14 1.37 9.36 0.54 0.28 117.16 123.56 1tm9 n TYR 102 Ca -0.08 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.08 1tm9 n TYR 102 Cb 0.26 -0.44 -0.00 0.00 -0.63 0.00 0.00 39.34 38.52 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 -0.80 -0.71 2.98 3.04 -1.47 0.72 116.94 120.71 1tm9 h PHE 103 Ca 0.00 0.06 0.13 0.00 3.98 0.00 0.00 57.97 62.14 1tm9 h PHE 103 Cb 0.00 0.42 -0.13 0.00 2.56 0.00 0.00 35.95 38.80 1tm9 h PHE 103 CO -0.83 -0.36 -0.25 -0.07 -2.02 0.00 0.00 178.31 174.77 1tm9 h LEU 104 N -0.20 -0.92 -0.18 0.59 3.38 -0.70 0.66 115.31 117.94 1tm9 h LEU 104 Ca 0.20 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.37 1tm9 h LEU 104 Cb 0.52 0.52 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1tm9 h LEU 104 CO -0.56 -0.27 0.00 1.88 0.09 0.00 0.00 178.44 179.58 1tm9 h TYR 105 N -0.06 0.34 -0.92 1.13 0.05 0.17 0.72 116.97 118.40 1tm9 h TYR 105 Ca 0.31 -0.06 0.08 0.00 0.05 0.00 0.00 58.73 59.12 1tm9 h TYR 105 Cb 0.55 -0.09 -0.11 0.00 1.01 0.00 0.00 36.73 38.09 1tm9 h TYR 105 CO -0.63 0.51 -0.56 1.25 -1.05 0.00 0.00 178.16 177.68 1tm9 h HIS 106 N 0.07 -1.81 0.00 4.88 2.76 0.26 -3.39 115.15 117.92 1tm9 h HIS 106 Ca 0.05 0.12 -0.16 0.00 -2.20 0.00 0.00 60.37 58.18 1tm9 h HIS 106 Cb 0.37 0.91 -0.12 0.00 1.55 0.00 0.00 27.41 30.12 1tm9 h HIS 106 CO 0.03 -0.36 -0.13 1.97 -1.30 0.00 0.00 177.93 178.14 1tm9 n PHE 107 N -5.16 -1.42 0.00 5.26 1.16 -0.47 -5.03 117.46 111.79 1tm9 n PHE 107 Ca 0.02 -1.29 0.00 0.00 -1.87 0.00 0.00 57.45 54.30 1tm9 n PHE 107 Cb 0.26 1.36 0.00 0.00 -1.61 0.00 0.00 39.48 39.49 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 0.48 1.29 0.00 4.97 0.00 0.25 -4.59 105.19 107.59 1tm9 n GLY 108 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.35 1.61 3.01 -1.17 -5.02 117.46 114.54 1tm9 n PHE 109 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 1tm9 n PHE 109 Cb 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.52 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 -2.03 0.59 -3.61 4.37 4.77 -1.23 -5.01 117.00 114.85 1tm9 n LEU 110 Ca 0.00 0.65 -0.16 0.00 -0.03 0.00 0.00 56.01 56.47 1tm9 n LEU 110 Cb 0.48 -1.18 -0.07 0.00 -2.33 0.00 0.00 43.42 40.32 1tm9 n LEU 110 CO 0.00 -3.18 0.32 -1.59 -1.33 0.00 0.00 177.39 171.61 1tm9 s LYS 111 N -2.41 0.89 -0.43 3.23 0.00 -1.26 -4.72 119.74 115.03 1tm9 s LYS 111 Ca 0.66 0.32 0.02 0.00 0.00 0.00 0.00 55.97 56.97 1tm9 s LYS 111 Cb -0.39 0.42 0.23 0.00 0.00 0.00 0.00 37.83 38.09 1tm9 s LYS 111 CO 0.57 -0.24 0.97 -3.47 0.00 0.00 0.00 175.35 173.18 1tm9 n ASP 112 N 1.46 -2.39 -2.69 0.03 -0.08 -1.26 -4.96 116.55 106.66 1tm9 n ASP 112 Ca -0.18 -2.33 -0.03 0.00 -1.51 0.00 0.00 54.79 50.74 1tm9 n ASP 112 Cb 0.56 1.32 -0.03 0.00 2.34 0.00 0.00 41.12 45.32 1tm9 n ASP 112 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1tm9 n ASN 113 N 2.20 -3.37 -0.39 1.67 4.13 -1.26 -4.64 115.26 113.61 1tm9 n ASN 113 Ca 0.11 1.27 0.00 0.00 1.68 0.00 0.00 54.58 57.64 1tm9 n ASN 113 Cb 0.63 -3.97 0.00 0.00 -1.54 0.00 0.00 39.78 34.90 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 2.00 -2.46 -4.31 6.41 4.13 -1.26 -4.67 115.26 115.09 1tm9 n ASN 114 Ca -0.24 0.00 -0.16 0.00 1.68 0.00 0.00 54.58 55.86 1tm9 n ASN 114 Cb 0.37 0.00 -0.10 0.00 -1.54 0.00 0.00 39.78 38.51 1tm9 n ASN 114 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1tm9 s LYS 115 N 0.00 1.31 -1.46 3.52 1.02 -1.26 -4.80 119.74 118.06 1tm9 s LYS 115 Ca 0.00 -1.66 -0.11 0.00 0.02 0.00 0.00 55.97 54.22 1tm9 s LYS 115 Cb 0.00 -0.53 0.05 0.00 -0.52 0.00 0.00 37.83 36.83 1tm9 s LYS 115 CO 0.00 -0.12 1.03 1.17 -0.92 0.00 0.00 175.35 176.51 1tm9 n LYS 116 N -0.39 -6.40 0.00 1.68 4.81 -1.26 -4.79 118.16 111.81 1tm9 n LYS 116 Ca -0.05 0.70 0.00 0.00 -0.87 0.00 0.00 58.31 58.09 1tm9 n LYS 116 Cb 0.64 -5.66 0.00 0.00 0.02 0.00 0.00 35.03 30.03 1tm9 n LYS 116 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1tm9 n GLN 117 N -4.75 0.00 0.00 1.64 6.02 -1.26 -4.66 117.38 114.36 1tm9 n GLN 117 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1tm9 n GLN 117 Cb 0.54 -0.26 0.00 0.00 1.02 0.00 0.00 30.24 31.55 1tm9 n GLN 117 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 1tm9 n ILE 118 N -2.21 0.00 -0.39 5.09 0.13 -1.26 -4.62 119.36 116.11 1tm9 n ILE 118 Ca 0.00 0.00 -0.08 0.00 -1.10 0.00 0.00 62.75 61.57 1tm9 n ILE 118 Cb 0.06 0.00 -0.06 0.00 -0.84 0.00 0.00 39.64 38.80 1tm9 n ILE 118 CO 0.00 0.00 0.00 -0.38 2.80 0.00 0.00 176.55 178.97 1tm9 n ILE 119 N 0.00 -0.60 -0.33 9.51 2.08 -1.26 0.19 119.36 128.96 1tm9 n ILE 119 Ca 0.00 2.26 0.17 0.00 0.56 0.00 0.00 62.75 65.74 1tm9 n ILE 119 Cb 0.00 -2.84 0.34 0.00 -0.75 0.00 0.00 39.64 36.39 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 -5.23 -0.07 0.37 0.38 0.00 -1.26 0.69 118.16 113.04 1tm9 n LYS 120 Ca 0.04 1.41 -0.16 0.00 0.00 0.00 0.00 58.31 59.60 1tm9 n LYS 120 Cb 0.28 -2.30 -0.08 0.00 0.00 0.00 0.00 35.03 32.93 1tm9 n LYS 120 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1tm9 h LYS 121 N 0.00 -0.96 0.06 1.64 3.64 0.19 0.51 116.57 121.65 1tm9 h LYS 121 Ca 0.63 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 60.08 1tm9 h LYS 121 Cb 1.38 0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 33.40 1tm9 h LYS 121 CO -0.87 -0.64 -0.21 0.00 -2.27 0.00 0.00 179.45 175.46 1tm9 h ALA 122 N -1.40 -0.75 -1.77 5.00 0.00 0.51 0.82 119.26 121.68 1tm9 h ALA 122 Ca -0.09 -0.05 0.51 0.00 0.00 0.00 0.00 54.91 55.28 1tm9 h ALA 122 Cb 0.78 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 1tm9 h ALA 122 CO 0.12 -0.80 1.27 1.88 0.00 0.00 0.00 179.25 181.72 1tm9 h TYR 123 N -0.31 0.01 0.23 0.00 -1.99 0.23 1.61 116.97 116.76 1tm9 h TYR 123 Ca -0.01 0.00 -0.34 0.00 2.00 0.00 0.00 58.73 60.38 1tm9 h TYR 123 Cb 0.30 -0.00 0.03 0.00 2.00 0.00 0.00 36.73 39.06 1tm9 h TYR 123 CO -0.33 -0.00 -1.60 1.49 -0.00 0.00 0.00 178.16 177.72 1tm9 h GLU 124 N 0.00 0.49 -1.00 4.88 4.57 0.14 -2.58 114.58 121.08 1tm9 h GLU 124 Ca 0.84 -0.83 0.27 0.00 -1.18 0.00 0.00 59.36 58.46 1tm9 h GLU 124 Cb 3.38 0.31 -0.06 0.00 -0.16 0.00 0.00 28.75 32.22 1tm9 h GLU 124 CO -0.02 1.40 0.68 0.00 -1.18 0.00 0.00 179.01 179.89 1tm9 h THR 125 N 0.13 0.54 0.00 0.32 1.03 0.91 0.37 112.91 116.21 1tm9 h THR 125 Ca -0.29 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.04 1tm9 h THR 125 Cb 2.15 0.32 0.00 0.00 -1.07 0.00 0.00 68.15 69.55 1tm9 h THR 125 CO 0.24 0.04 -0.24 0.40 -0.01 0.00 0.00 175.52 175.95 1tm9 h ILE 126 N 0.20 0.00 -1.51 0.00 2.04 -1.49 -2.23 117.51 114.52 1tm9 h ILE 126 Ca 0.51 -0.87 0.44 0.00 1.00 0.00 0.00 64.86 65.94 1tm9 h ILE 126 Cb 1.65 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.67 1tm9 h ILE 126 CO -0.13 0.00 1.24 0.00 0.00 0.00 0.00 178.15 179.26 1tm9 h ALA 127 N -1.13 3.42 0.00 1.87 0.00 -1.02 1.64 119.26 124.04 1tm9 h ALA 127 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1tm9 h ALA 127 Cb 0.24 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1tm9 h ALA 127 CO 0.00 -2.01 -0.07 -0.44 0.00 0.00 0.00 179.25 176.73 1tm9 h ASP 128 N 0.00 0.00 -0.42 0.00 3.32 -0.39 -3.16 116.42 115.77 1tm9 h ASP 128 Ca 0.72 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.86 1tm9 h ASP 128 Cb 3.18 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 42.64 1tm9 h ASP 128 CO -0.01 0.29 -0.20 0.78 -1.72 0.00 0.00 179.24 178.38 1tm9 h ASN 129 N -0.50 -0.67 -0.04 6.45 4.21 -0.18 1.23 115.58 126.08 1tm9 h ASN 129 Ca 0.00 0.16 0.01 0.00 1.21 0.00 0.00 56.30 57.68 1tm9 h ASN 129 Cb 0.07 0.37 -0.00 0.00 -1.12 0.00 0.00 38.32 37.63 1tm9 h ASN 129 CO 0.00 -0.23 0.32 -0.29 -1.29 0.00 0.00 177.43 175.94 1tm9 h ILE 130 N -0.11 0.05 -0.36 2.81 2.10 0.21 1.22 117.51 123.43 1tm9 h ILE 130 Ca 0.20 0.00 -0.07 0.00 1.08 0.00 0.00 64.86 66.07 1tm9 h ILE 130 Cb 0.43 0.69 -0.04 0.00 -1.09 0.00 0.00 36.82 36.81 1tm9 h ILE 130 CO -0.49 0.00 0.09 0.00 -1.08 0.00 0.00 178.15 176.67 1tm9 n ALA 131 N -1.96 3.47 -0.08 0.18 0.00 0.42 -3.76 120.51 118.79 1tm9 n ALA 131 Ca -0.01 -1.15 -0.12 0.00 0.00 0.00 0.00 53.44 52.16 1tm9 n ALA 131 Cb 0.38 -1.11 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 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 1.72 0.00 1.95 0.00 1.82 0.16 -3.38 116.42 118.70 1tm9 h ASP 132 Ca 0.09 -0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 1tm9 h ASP 132 Cb 1.47 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.48 1tm9 h ASP 132 CO 0.35 1.07 0.00 0.10 -1.61 0.00 0.00 179.24 179.15 1tm9 h TYR 133 N -1.00 0.00 0.00 0.28 -0.00 -1.74 -3.37 116.97 111.14 1tm9 h TYR 133 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.58 1tm9 h TYR 133 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.58 1tm9 h TYR 133 CO -0.06 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.38 1tm9 n LEU 134 N -3.04 0.00 -2.45 0.10 4.77 -1.25 -4.98 117.00 110.16 1tm9 n LEU 134 Ca 0.04 0.38 -0.05 0.00 -0.03 0.00 0.00 56.01 56.35 1tm9 n LEU 134 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1tm9 n LEU 134 CO 0.34 0.00 0.05 0.59 -1.33 0.00 0.00 177.39 177.04 1tm9 n ASN 135 N -0.45 -6.15 -4.06 -1.43 3.02 -1.26 -4.01 115.26 100.92 1tm9 n ASN 135 Ca 0.00 0.34 -0.45 0.00 -0.03 0.00 0.00 54.58 54.44 1tm9 n ASN 135 Cb 0.00 -4.07 0.02 0.00 -0.61 0.00 0.00 39.78 35.12 1tm9 n ASN 135 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1tm9 n GLU 136 N -0.45 -0.35 0.00 3.52 0.28 -1.26 -5.18 120.64 117.20 1tm9 n GLU 136 Ca 0.08 0.13 0.14 0.00 -0.16 0.00 0.00 57.16 57.35 1tm9 n GLU 136 Cb 0.33 -2.47 0.43 0.00 1.43 0.00 0.00 31.44 31.17 1tm9 n GLU 136 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26