#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tm9 s GLU 2 N 0.00 0.46 0.91 0.03 2.12 -1.26 -5.15 118.70 115.80 1tm9 s GLU 2 Ca 0.00 -0.29 -0.15 0.00 0.36 0.00 0.00 54.97 54.89 1tm9 s GLU 2 Cb 0.00 0.13 -0.04 0.00 0.26 0.00 0.00 34.13 34.48 1tm9 s GLU 2 CO 0.00 -0.21 0.05 1.04 -0.54 0.00 0.00 175.26 175.59 1tm9 n GLN 3 N -0.79 -0.09 0.00 4.30 6.02 -1.26 -4.99 117.38 120.57 1tm9 n GLN 3 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1tm9 n GLN 3 Cb 0.60 -1.56 0.00 0.00 1.02 0.00 0.00 30.24 30.29 1tm9 n GLN 3 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1tm9 n ASN 4 N 0.43 0.00 0.00 1.08 0.23 -1.26 -5.06 115.26 110.68 1tm9 n ASN 4 Ca 0.05 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.10 1tm9 n ASN 4 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 1tm9 n ASN 4 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1tm9 n ASN 5 N 0.00 0.00 -0.09 0.53 6.94 -1.26 -4.95 115.26 116.43 1tm9 n ASN 5 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 54.58 54.54 1tm9 n ASN 5 Cb 0.00 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 1tm9 n ASN 5 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1tm9 n ILE 6 N 1.19 -0.15 -0.34 1.53 2.08 -1.26 0.80 119.36 123.21 1tm9 n ILE 6 Ca 0.00 1.50 -0.03 0.00 0.56 0.00 0.00 62.75 64.77 1tm9 n ILE 6 Cb 0.00 -1.94 -0.00 0.00 -0.75 0.00 0.00 39.64 36.95 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 -3.42 -0.25 -0.01 0.38 3.00 -1.26 0.11 118.16 116.71 1tm9 n LYS 7 Ca 0.00 1.32 -0.09 0.00 -0.00 0.00 0.00 58.31 59.54 1tm9 n LYS 7 Cb 0.06 -1.95 -0.04 0.00 0.00 0.00 0.00 35.03 33.10 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 -0.08 -1.01 1.64 4.22 -0.35 -0.99 114.58 118.01 1tm9 h GLU 8 Ca 0.25 0.01 0.28 0.00 0.08 0.00 0.00 59.36 59.98 1tm9 h GLU 8 Cb 0.47 0.02 -0.13 0.00 0.50 0.00 0.00 28.75 29.60 1tm9 h GLU 8 CO -0.84 -0.05 0.59 1.96 -2.18 0.00 0.00 179.01 178.49 1tm9 h GLN 9 N -0.08 0.44 0.51 1.92 4.20 0.71 0.40 115.11 123.21 1tm9 h GLN 9 Ca 0.08 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 1tm9 h GLN 9 Cb 0.20 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 27.88 1tm9 h GLN 9 CO -0.18 0.29 -0.25 -0.07 -0.67 0.00 0.00 178.83 177.96 1tm9 h LEU 10 N 0.45 -0.58 -0.15 1.46 3.38 0.29 -2.73 115.31 117.43 1tm9 h LEU 10 Ca 0.69 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.63 1tm9 h LEU 10 Cb 1.47 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 42.32 1tm9 h LEU 10 CO -0.52 -0.18 -0.36 0.40 0.09 0.00 0.00 178.44 177.86 1tm9 h ILE 11 N -1.08 0.00 0.00 1.22 5.03 0.16 0.39 117.51 123.23 1tm9 h ILE 11 Ca -0.07 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.67 1tm9 h ILE 11 Cb 0.59 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.38 1tm9 h ILE 11 CO 0.12 0.00 0.00 -0.24 -0.68 0.00 0.00 178.15 177.35 1tm9 n SER 12 N -4.46 0.00 -0.08 1.72 2.88 0.12 0.19 113.62 113.99 1tm9 n SER 12 Ca -0.03 0.68 -0.02 0.00 -1.33 0.00 0.00 58.87 58.16 1tm9 n SER 12 Cb 0.24 -0.24 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 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 -0.38 -0.73 0.66 0.04 -1.26 1.18 116.94 116.45 1tm9 h PHE 13 Ca 0.00 0.03 0.13 0.00 2.80 0.00 0.00 57.97 60.93 1tm9 h PHE 13 Cb 0.00 0.19 -0.13 0.00 2.20 0.00 0.00 35.95 38.21 1tm9 h PHE 13 CO -0.46 -0.08 -0.30 0.35 -0.60 0.00 0.00 178.31 177.22 1tm9 h PHE 14 N -0.01 -0.79 -0.09 -0.55 3.57 -0.19 1.42 116.94 120.31 1tm9 h PHE 14 Ca 0.03 0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1tm9 h PHE 14 Cb 0.09 0.45 -0.00 0.00 2.79 0.00 0.00 35.95 39.28 1tm9 h PHE 14 CO -0.92 -0.37 0.06 -0.97 -2.23 0.00 0.00 178.31 173.88 1tm9 h ASN 15 N -0.08 0.07 -0.52 0.41 -1.24 0.39 0.50 115.58 115.11 1tm9 h ASN 15 Ca 0.30 -0.00 -0.28 0.00 0.71 0.00 0.00 56.30 57.03 1tm9 h ASN 15 Cb 0.57 -0.02 -0.16 0.00 0.73 0.00 0.00 38.32 39.44 1tm9 h ASN 15 CO -0.78 0.05 0.36 0.00 -1.29 0.00 0.00 177.43 175.77 1tm9 n GLN 16 N -4.52 1.68 0.00 6.67 1.13 0.48 -4.32 117.38 118.50 1tm9 n GLN 16 Ca -0.01 -1.59 0.00 0.00 -1.94 0.00 0.00 57.00 53.45 1tm9 n GLN 16 Cb 0.11 -1.62 0.00 0.00 0.11 0.00 0.00 30.24 28.84 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 -0.28 2.74 -1.00 -1.58 0.00 0.13 -4.69 120.51 115.83 1tm9 n ALA 17 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1tm9 n ALA 17 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.49 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 -1.16 0.00 -2.20 0.00 7.64 -1.26 -4.97 113.62 111.66 1tm9 n SER 19 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1tm9 n SER 19 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 -0.03 0.00 -0.08 0.44 -2.24 -1.26 -5.04 114.28 106.08 1tm9 n THR 20 Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1tm9 n THR 20 Cb 0.00 -1.97 -0.03 0.00 -2.10 0.00 0.00 70.33 66.22 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 -1.63 0.96 -0.42 4.78 8.25 -1.26 -4.07 115.22 121.83 1tm9 n HIS 21 Ca 0.00 0.42 0.39 0.00 -0.26 0.00 0.00 57.72 58.27 1tm9 n HIS 21 Cb 0.00 -0.84 0.65 0.00 1.12 0.00 0.00 29.99 30.91 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 -1.00 0.00 -0.85 -0.41 4.20 -2.01 0.13 115.11 115.16 1tm9 h GLN 22 Ca -0.07 0.00 0.16 0.00 0.06 0.00 0.00 58.65 58.80 1tm9 h GLN 22 Cb 0.66 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.29 1tm9 h GLN 22 CO -0.04 0.00 -0.26 -1.91 -0.67 0.00 0.00 178.83 175.95 1tm9 n GLU 23 N -3.64 -0.12 -0.06 1.46 4.07 -1.26 -0.35 120.64 120.74 1tm9 n GLU 23 Ca 0.32 1.33 -0.06 0.00 -0.06 0.00 0.00 57.16 58.68 1tm9 n GLU 23 Cb 1.67 -1.98 -0.04 0.00 -0.06 0.00 0.00 31.44 31.03 1tm9 n GLU 23 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1tm9 h ARG 24 N 0.00 -0.17 -0.25 5.31 3.08 -1.24 1.49 114.38 122.61 1tm9 h ARG 24 Ca 0.37 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.50 1tm9 h ARG 24 Cb 0.58 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1tm9 h ARG 24 CO -0.87 -0.11 0.53 -0.07 -1.07 0.00 0.00 179.97 178.38 1tm9 h LEU 25 N -0.17 0.00 0.10 3.04 3.38 -0.89 1.46 115.31 122.23 1tm9 h LEU 25 Ca 0.03 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.71 1tm9 h LEU 25 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1tm9 h LEU 25 CO -0.25 0.00 -1.43 -0.78 0.09 0.00 0.00 178.44 176.06 1tm9 h ASP 26 N 0.00 0.33 0.67 -0.43 3.58 0.25 -3.36 116.42 117.46 1tm9 h ASP 26 Ca 0.12 -0.43 -0.03 0.00 0.42 0.00 0.00 57.03 57.10 1tm9 h ASP 26 Cb 1.17 -0.11 0.01 0.00 1.72 0.00 0.00 39.33 42.12 1tm9 h ASP 26 CO -0.00 1.36 -0.32 -0.26 -2.88 0.00 0.00 179.24 177.13 1tm9 h PHE 27 N 0.06 -0.83 -0.64 0.28 -1.00 1.18 1.56 116.94 117.54 1tm9 h PHE 27 Ca -0.20 -0.02 0.27 0.00 2.81 0.00 0.00 57.97 60.82 1tm9 h PHE 27 Cb 1.98 0.28 -0.11 0.00 3.61 0.00 0.00 35.95 41.70 1tm9 h PHE 27 CO 0.05 -0.52 0.34 0.44 -1.61 0.00 0.00 178.31 177.01 1tm9 n ILE 28 N -5.05 -0.27 0.00 -0.55 -5.35 -0.51 0.27 119.36 107.91 1tm9 n ILE 28 Ca -0.11 1.29 0.00 0.00 -0.27 0.00 0.00 62.75 63.66 1tm9 n ILE 28 Cb 0.35 -2.10 0.00 0.00 -1.74 0.00 0.00 39.64 36.16 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 -2.14 -0.21 0.20 0.00 2.88 0.53 0.61 113.62 115.49 1tm9 n SER 30 Ca 0.00 1.29 -0.15 0.00 -1.33 0.00 0.00 58.87 58.69 1tm9 n SER 30 Cb 0.00 -0.42 -0.08 0.00 -0.75 0.00 0.00 64.21 62.96 1tm9 n SER 30 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1tm9 h THR 31 N 0.00 0.00 -0.43 2.46 2.02 0.37 -2.08 112.91 115.24 1tm9 h THR 31 Ca 0.39 0.00 -0.29 0.00 0.77 0.00 0.00 66.41 67.29 1tm9 h THR 31 Cb 0.68 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.98 1tm9 h THR 31 CO -0.76 0.00 0.06 -1.14 0.37 0.00 0.00 175.52 174.05 1tm9 n ARG 32 N -4.99 1.96 -1.77 6.66 0.00 0.20 -3.47 116.66 115.24 1tm9 n ARG 32 Ca -0.09 -1.40 -0.01 0.00 -0.00 0.00 0.00 57.85 56.34 1tm9 n ARG 32 Cb 0.38 -1.85 0.04 0.00 0.00 0.00 0.00 32.46 31.03 1tm9 n ARG 32 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1tm9 n GLU 33 N 1.47 0.49 0.00 -0.14 -0.00 -0.54 -4.91 120.64 117.01 1tm9 n GLU 33 Ca 0.37 -0.51 0.00 0.00 -0.00 0.00 0.00 57.16 57.02 1tm9 n GLU 33 Cb 0.68 0.24 0.00 0.00 -0.00 0.00 0.00 31.44 32.37 1tm9 n GLU 33 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1tm9 n SER 34 N -0.56 0.00 0.01 -1.84 2.88 -1.07 -4.82 113.62 108.22 1tm9 n SER 34 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1tm9 n SER 34 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 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 -0.25 -0.01 -3.46 -0.08 -1.26 -4.94 116.55 106.55 1tm9 n ASP 35 Ca 0.00 0.09 0.09 0.00 -1.51 0.00 0.00 54.79 53.46 1tm9 n ASP 35 Cb 0.00 0.46 -0.13 0.00 2.34 0.00 0.00 41.12 43.79 1tm9 n ASP 35 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1tm9 n THR 36 N -2.35 0.00 -1.10 5.18 5.66 -1.26 -4.97 114.28 115.45 1tm9 n THR 36 Ca 0.00 -0.37 -0.03 0.00 -3.05 0.00 0.00 64.05 60.60 1tm9 n THR 36 Cb 0.00 0.19 -0.01 0.00 -1.55 0.00 0.00 70.33 68.96 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 -2.03 0.00 -0.12 1.09 3.72 -1.26 -4.70 117.46 114.16 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 0.44 -1.97 0.00 0.00 -0.94 0.00 0.00 39.48 37.00 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 -0.87 0.73 -0.73 4.37 2.88 -1.26 -4.57 113.62 114.17 1tm9 n SER 38 Ca -0.03 -0.91 0.09 0.00 -1.33 0.00 0.00 58.87 56.69 1tm9 n SER 38 Cb 0.46 0.13 0.08 0.00 -0.75 0.00 0.00 64.21 64.13 1tm9 n SER 38 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1tm9 n SER 39 N -0.13 2.52 -4.10 -3.46 3.41 -1.26 -4.82 113.62 105.78 1tm9 n SER 39 Ca 0.00 -1.76 -0.36 0.00 -0.26 0.00 0.00 58.87 56.49 1tm9 n SER 39 Cb 0.03 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.05 1tm9 n SER 39 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1tm9 n VAL 40 N 1.02 0.00 -0.85 -3.33 0.31 -1.26 -4.56 118.33 109.65 1tm9 n VAL 40 Ca 0.11 -0.25 -0.31 0.00 -0.01 0.00 0.00 64.34 63.88 1tm9 n VAL 40 Cb 0.46 -0.18 -0.04 0.00 -0.91 0.00 0.00 33.84 33.17 1tm9 n VAL 40 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1tm9 n ASP 41 N 2.05 3.29 -3.64 4.52 -0.08 -1.26 -4.67 116.55 116.76 1tm9 n ASP 41 Ca -0.00 -2.47 -0.09 0.00 -1.51 0.00 0.00 54.79 50.72 1tm9 n ASP 41 Cb 0.64 -1.03 -0.07 0.00 2.34 0.00 0.00 41.12 43.00 1tm9 n ASP 41 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1tm9 s VAL 42 N 4.42 0.00 0.34 5.18 0.11 -1.26 -4.65 120.40 124.53 1tm9 s VAL 42 Ca 0.46 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.24 1tm9 s VAL 42 Cb 0.12 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.87 1tm9 s VAL 42 CO 0.06 0.00 1.07 -2.16 -3.33 0.00 0.00 175.10 170.73 1tm9 s PRO 43 N 0.15 4.42 0.34 1.54 0.04 -1.26 -4.86 135.00 135.37 1tm9 s PRO 43 Ca 0.03 1.65 0.20 0.00 0.04 0.00 0.00 61.00 62.93 1tm9 s PRO 43 Cb -0.05 -2.88 0.18 0.00 0.04 0.00 0.00 34.50 31.79 1tm9 s PRO 43 CO -0.07 0.06 1.43 -0.07 0.04 0.00 0.00 177.00 178.39 1tm9 h LEU 44 N 3.20 0.00 0.07 -3.56 3.38 -1.95 -2.94 115.31 113.52 1tm9 h LEU 44 Ca -0.47 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.52 1tm9 h LEU 44 Cb 1.21 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 1tm9 h LEU 44 CO 0.65 0.18 -0.44 -0.33 0.09 0.00 0.00 178.44 178.58 1tm9 h GLU 45 N 0.00 -0.62 -0.02 1.13 3.07 -1.97 0.62 114.58 116.79 1tm9 h GLU 45 Ca -0.01 0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 58.82 1tm9 h GLU 45 Cb 1.14 0.14 0.01 0.00 -0.84 0.00 0.00 28.75 29.20 1tm9 h GLU 45 CO 0.02 -0.42 -0.29 -1.00 -1.40 0.00 0.00 179.01 175.93 1tm9 h PRO 46 N -0.65 0.22 -0.97 2.33 0.13 -1.84 -3.18 132.00 128.04 1tm9 h PRO 46 Ca 0.03 -0.22 0.25 0.00 -0.87 0.00 0.00 66.00 65.18 1tm9 h PRO 46 Cb 0.69 0.06 -0.07 0.00 0.13 0.00 0.00 31.00 31.81 1tm9 h PRO 46 CO -0.28 0.92 0.65 0.82 -0.23 0.00 0.00 178.00 179.88 1tm9 h ILE 47 N -0.39 0.58 -0.06 -3.56 1.08 -1.43 1.44 117.51 115.17 1tm9 h ILE 47 Ca -0.03 -0.10 0.02 0.00 -0.39 0.00 0.00 64.86 64.35 1tm9 h ILE 47 Cb 1.01 0.26 -0.00 0.00 -3.07 0.00 0.00 36.82 35.01 1tm9 h ILE 47 CO 0.06 0.05 0.05 0.11 -0.69 0.00 0.00 178.15 177.73 1tm9 h LYS 48 N 0.30 0.00 0.06 2.37 1.57 0.28 0.39 116.57 121.55 1tm9 h LYS 48 Ca 0.51 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 59.03 1tm9 h LYS 48 Cb 1.47 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.79 1tm9 h LYS 48 CO -0.17 0.00 -1.12 -0.91 -0.57 0.00 0.00 179.45 176.68 1tm9 h ASN 49 N 0.00 0.70 -0.01 0.86 4.21 0.19 -1.74 115.58 119.78 1tm9 h ASN 49 Ca 0.03 -0.62 0.00 0.00 1.21 0.00 0.00 56.30 56.92 1tm9 h ASN 49 Cb 0.13 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.11 1tm9 h ASN 49 CO -0.00 1.43 0.00 2.30 -1.29 0.00 0.00 177.43 179.87 1tm9 n ILE 50 N -3.75 0.01 -0.10 2.81 -5.35 -0.01 -3.24 119.36 109.73 1tm9 n ILE 50 Ca -0.10 -0.10 -0.12 0.00 -0.27 0.00 0.00 62.75 62.16 1tm9 n ILE 50 Cb 0.93 -0.13 -0.13 0.00 -1.74 0.00 0.00 39.64 38.57 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 -0.55 1.31 -0.97 7.28 5.41 0.12 -4.40 119.36 127.56 1tm9 n ILE 51 Ca 0.21 -0.68 -0.16 0.00 1.00 0.00 0.00 62.75 63.11 1tm9 n ILE 51 Cb 0.19 -0.83 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 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 -2.88 1.83 -0.03 0.38 1.02 -0.67 -3.69 120.64 116.60 1tm9 n GLU 52 Ca -0.35 -1.49 -0.03 0.00 -0.02 0.00 0.00 57.16 55.27 1tm9 n GLU 52 Cb 1.04 -1.66 -0.03 0.00 -0.02 0.00 0.00 31.44 30.77 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 0.71 0.32 -0.68 -3.67 0.13 -1.26 -4.58 119.36 110.33 1tm9 n ILE 53 Ca 0.31 -0.16 -0.04 0.00 -1.10 0.00 0.00 62.75 61.76 1tm9 n ILE 53 Cb 0.58 -0.78 0.27 0.00 -0.84 0.00 0.00 39.64 38.87 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 -2.46 2.51 -0.49 9.51 -2.24 -1.24 -4.33 114.28 115.54 1tm9 n THR 54 Ca -0.09 -1.33 -0.16 0.00 -2.27 0.00 0.00 64.05 60.20 1tm9 n THR 54 Cb 0.63 -0.41 0.11 0.00 -2.10 0.00 0.00 70.33 68.55 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 -0.01 1.83 -4.00 -0.78 5.02 -1.26 -4.39 118.16 114.56 1tm9 n LYS 55 Ca 0.33 -1.96 -0.12 0.00 -2.02 0.00 0.00 58.31 54.55 1tm9 n LYS 55 Cb 1.21 -1.77 -0.12 0.00 -0.02 0.00 0.00 35.03 34.33 1tm9 n LYS 55 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1tm9 s ASP 56 N -0.48 0.41 0.00 4.39 1.01 -1.26 -5.05 116.67 115.69 1tm9 s ASP 56 Ca 0.37 -0.36 0.00 0.00 0.71 0.00 0.00 52.55 53.27 1tm9 s ASP 56 Cb 0.31 0.04 0.00 0.00 1.01 0.00 0.00 42.92 44.28 1tm9 s ASP 56 CO 0.06 -0.16 0.33 -0.62 0.21 0.00 0.00 175.17 174.99 1tm9 n GLU 57 N 2.04 0.00 -0.37 8.23 1.02 -1.26 0.54 120.64 130.84 1tm9 n GLU 57 Ca -0.20 0.13 0.33 0.00 -0.02 0.00 0.00 57.16 57.40 1tm9 n GLU 57 Cb 0.56 -0.83 0.56 0.00 -0.02 0.00 0.00 31.44 31.71 1tm9 n GLU 57 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1tm9 n ASN 58 N -0.46 0.21 0.40 1.62 3.02 -1.26 0.88 115.26 119.68 1tm9 n ASN 58 Ca 0.00 1.26 -0.16 0.00 -0.03 0.00 0.00 54.58 55.65 1tm9 n ASN 58 Cb 0.00 -0.62 -0.08 0.00 -0.61 0.00 0.00 39.78 38.48 1tm9 n ASN 58 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1tm9 h GLN 59 N 0.00 -1.00 -0.84 3.52 1.08 -1.74 0.45 115.11 116.58 1tm9 h GLN 59 Ca 0.75 0.07 0.21 0.00 -1.45 0.00 0.00 58.65 58.23 1tm9 h GLN 59 Cb 2.30 0.23 -0.13 0.00 -0.05 0.00 0.00 27.48 29.83 1tm9 h GLN 59 CO -0.47 -0.67 0.20 -0.56 -0.95 0.00 0.00 178.83 176.38 1tm9 h GLN 60 N -1.04 0.21 0.00 1.46 3.07 0.59 0.63 115.11 120.03 1tm9 h GLN 60 Ca -0.10 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.62 1tm9 h GLN 60 Cb 0.80 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 28.31 1tm9 h GLN 60 CO 0.16 0.14 0.00 -0.89 0.09 0.00 0.00 178.83 178.33 1tm9 n ILE 61 N -5.22 0.00 -0.65 1.86 5.41 -0.64 -0.30 119.36 119.82 1tm9 n ILE 61 Ca 0.19 1.22 0.51 0.00 1.00 0.00 0.00 62.75 65.67 1tm9 n ILE 61 Cb 0.61 -2.19 0.81 0.00 -0.71 0.00 0.00 39.64 38.17 1tm9 n ILE 61 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1tm9 h GLU 62 N 0.00 0.00 -0.01 0.38 5.08 0.34 1.50 114.58 121.87 1tm9 h GLU 62 Ca 0.00 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1tm9 h GLU 62 Cb 0.00 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1tm9 h GLU 62 CO 0.00 0.00 -0.05 0.82 -1.00 0.00 0.00 179.01 178.78 1tm9 h ILE 63 N 0.00 1.53 -0.42 3.13 2.04 0.48 -2.05 117.51 122.23 1tm9 h ILE 63 Ca 0.88 -1.63 0.04 0.00 1.00 0.00 0.00 64.86 65.15 1tm9 h ILE 63 Cb 3.54 2.61 -0.07 0.00 -0.74 0.00 0.00 36.82 42.16 1tm9 h ILE 63 CO -0.02 0.43 -0.40 0.74 0.00 0.00 0.00 178.15 178.91 1tm9 h THR 64 N -0.61 0.00 -0.82 -0.27 2.02 0.52 0.78 112.91 114.53 1tm9 h THR 64 Ca -0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1tm9 h THR 64 Cb 0.73 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.08 1tm9 h THR 64 CO 0.01 0.00 0.50 0.07 0.37 0.00 0.00 175.52 176.47 1tm9 h LYS 65 N -0.18 0.88 -0.62 6.66 -0.00 -1.58 -0.64 116.57 121.09 1tm9 h LYS 65 Ca 0.07 -0.05 0.11 0.00 -0.00 0.00 0.00 60.65 60.78 1tm9 h LYS 65 Cb 0.37 -0.20 -0.08 0.00 -0.00 0.00 0.00 32.23 32.32 1tm9 h LYS 65 CO -0.50 0.58 0.19 0.82 -0.00 0.00 0.00 179.45 180.55 1tm9 h ILE 66 N 0.91 0.70 -0.46 0.07 2.04 0.09 1.26 117.51 122.11 1tm9 h ILE 66 Ca 0.36 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 66.08 1tm9 h ILE 66 Cb 0.19 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1tm9 h ILE 66 CO -0.18 0.06 0.21 0.00 0.00 0.00 0.00 178.15 178.24 1tm9 h ALA 67 N 1.46 0.60 -0.75 1.87 0.00 0.18 -2.46 119.26 120.16 1tm9 h ALA 67 Ca 0.32 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1tm9 h ALA 67 Cb 0.45 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1tm9 h ALA 67 CO -0.36 0.19 0.32 0.28 0.00 0.00 0.00 179.25 179.68 1tm9 h VAL 68 N 0.61 1.25 -1.27 0.00 2.07 0.41 -1.46 116.25 117.86 1tm9 h VAL 68 Ca 0.16 -0.76 0.37 0.00 0.82 0.00 0.00 66.70 67.29 1tm9 h VAL 68 Cb 0.16 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 1tm9 h VAL 68 CO -0.02 0.31 1.10 -1.13 0.02 0.00 0.00 177.57 177.86 1tm9 h ASN 69 N 1.07 0.00 0.05 0.57 -1.24 0.20 1.63 115.58 117.86 1tm9 h ASN 69 Ca 0.25 0.00 -0.31 0.00 0.71 0.00 0.00 56.30 56.95 1tm9 h ASN 69 Cb 0.18 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.20 1tm9 h ASN 69 CO -0.02 0.00 -1.70 -3.20 -1.29 0.00 0.00 177.43 171.22 1tm9 n ASN 70 N -3.71 1.97 0.04 1.15 4.05 -0.61 -3.75 115.26 114.41 1tm9 n ASN 70 Ca 0.28 0.31 -0.11 0.00 0.45 0.00 0.00 54.58 55.51 1tm9 n ASN 70 Cb 1.50 -0.89 -0.05 0.00 1.23 0.00 0.00 39.78 41.56 1tm9 n ASN 70 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 177.26 173.92 1tm9 h ILE 71 N -0.57 0.82 -0.36 -1.44 6.09 0.12 1.02 117.51 123.19 1tm9 h ILE 71 Ca -0.42 0.00 0.10 0.00 -1.37 0.00 0.00 64.86 63.17 1tm9 h ILE 71 Cb 1.62 0.82 -0.01 0.00 0.47 0.00 0.00 36.82 39.72 1tm9 h ILE 71 CO -0.12 0.00 0.39 0.11 -3.07 0.00 0.00 178.15 175.47 1tm9 h LYS 72 N -0.12 0.00 0.03 2.19 1.79 0.18 0.36 116.57 121.00 1tm9 h LYS 72 Ca 0.03 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.19 1tm9 h LYS 72 Cb 0.16 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.77 1tm9 h LYS 72 CO -0.08 0.00 -1.77 2.41 -1.08 0.00 0.00 179.45 178.93 1tm9 n THR 73 N -3.72 1.66 0.41 -0.16 -1.04 0.17 -3.69 114.28 107.90 1tm9 n THR 73 Ca 0.06 -0.76 0.05 0.00 -2.04 0.00 0.00 64.05 61.36 1tm9 n THR 73 Cb 0.56 -1.21 0.25 0.00 -1.82 0.00 0.00 70.33 68.10 1tm9 n THR 73 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1tm9 n LEU 74 N -3.15 0.00 -1.89 -4.42 4.77 0.33 -2.77 117.00 109.86 1tm9 n LEU 74 Ca -0.20 0.47 -0.15 0.00 -0.03 0.00 0.00 56.01 56.09 1tm9 n LEU 74 Cb 1.05 -0.47 0.02 0.00 -2.33 0.00 0.00 43.42 41.70 1tm9 n LEU 74 CO 0.45 -0.29 1.23 -1.20 -1.33 0.00 0.00 177.39 176.25 1tm9 n SER 75 N -1.47 6.29 0.12 -1.43 7.64 -0.53 -4.21 113.62 120.03 1tm9 n SER 75 Ca 0.03 -2.97 0.00 0.00 1.01 0.00 0.00 58.87 56.94 1tm9 n SER 75 Cb 0.12 -1.09 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 1tm9 n SER 75 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1tm9 n SER 76 N 0.60 -2.16 -3.45 6.43 7.64 -1.12 -5.08 113.62 116.49 1tm9 n SER 76 Ca 0.28 0.68 -0.37 0.00 1.01 0.00 0.00 58.87 60.47 1tm9 n SER 76 Cb 0.57 2.23 0.04 0.00 -1.01 0.00 0.00 64.21 66.04 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 -3.16 -3.64 -2.12 0.44 0.31 -1.17 -4.54 118.33 104.45 1tm9 n VAL 77 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1tm9 n VAL 77 Cb 0.00 -3.39 0.00 0.00 -0.91 0.00 0.00 33.84 29.54 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 -0.09 0.39 0.51 2.92 0.00 -1.26 -4.08 105.19 103.58 1tm9 n GLY 78 Ca -0.08 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 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 1.03 1.94 -1.48 4.61 0.00 -1.26 -4.64 120.51 120.70 1tm9 n ALA 79 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 53.44 52.56 1tm9 n ALA 79 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.70 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 -3.79 3.34 -2.98 0.00 5.66 -1.26 -4.95 114.28 110.30 1tm9 n THR 80 Ca -0.25 -3.09 -0.20 0.00 -3.05 0.00 0.00 64.05 57.46 1tm9 n THR 80 Cb 0.61 -1.41 0.02 0.00 -1.55 0.00 0.00 70.33 68.00 1tm9 n THR 80 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1tm9 s GLY 81 N -0.32 1.77 0.24 1.09 0.00 -1.26 -5.04 107.32 103.80 1tm9 s GLY 81 Ca 0.53 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1tm9 s GLY 81 CO -0.21 -1.21 0.00 -1.06 0.00 0.00 0.00 173.10 170.62 1tm9 n GLN 82 N -2.00 0.00 -3.53 2.90 6.02 -1.26 -5.09 117.38 114.41 1tm9 n GLN 82 Ca 0.05 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.67 1tm9 n GLN 82 Cb 0.59 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.79 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1tm9 s TYR 83 N -1.71 3.68 -0.07 1.08 2.02 -1.26 -4.98 117.35 116.10 1tm9 s TYR 83 Ca 0.00 0.92 0.19 0.00 -0.37 0.00 0.00 57.07 57.81 1tm9 s TYR 83 Cb 0.00 -2.24 0.40 0.00 -0.40 0.00 0.00 41.96 39.72 1tm9 s TYR 83 CO 0.00 0.60 1.60 0.52 -1.57 0.00 0.00 175.55 176.70 1tm9 h MET 84 N 4.37 0.00 -0.56 -0.62 2.86 -1.96 -3.21 114.93 115.81 1tm9 h MET 84 Ca -0.51 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.20 1tm9 h MET 84 Cb 1.21 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.81 1tm9 h MET 84 CO 0.63 0.36 0.24 0.00 1.06 0.00 0.00 176.91 179.20 1tm9 h ALA 85 N 1.64 0.71 -0.65 6.32 0.00 -1.96 0.20 119.26 125.53 1tm9 h ALA 85 Ca -0.00 0.05 0.19 0.00 0.00 0.00 0.00 54.91 55.15 1tm9 h ALA 85 Cb 1.12 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1tm9 h ALA 85 CO 0.05 -0.14 0.74 1.03 0.00 0.00 0.00 179.25 180.93 1tm9 h SER 86 N 0.46 0.00 -0.94 0.00 0.87 -1.99 0.18 113.55 112.13 1tm9 h SER 86 Ca 0.26 0.00 -0.46 0.00 -1.23 0.00 0.00 61.79 60.36 1tm9 h SER 86 Cb 0.25 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 62.04 1tm9 h SER 86 CO -0.23 0.00 0.36 0.33 -0.53 0.00 0.00 176.83 176.76 1tm9 n PHE 87 N -3.52 1.52 0.00 2.24 7.35 0.70 -3.91 117.46 121.83 1tm9 n PHE 87 Ca 0.13 -1.93 0.00 0.00 -0.76 0.00 0.00 57.45 54.90 1tm9 n PHE 87 Cb 0.97 -1.34 0.00 0.00 0.35 0.00 0.00 39.48 39.46 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 0.88 -0.81 -0.24 -5.13 3.72 0.04 -4.92 117.46 111.01 1tm9 n PHE 88 Ca 0.46 0.00 0.24 0.00 -0.05 0.00 0.00 57.45 58.10 1tm9 n PHE 88 Cb 0.57 0.16 0.59 0.00 -0.94 0.00 0.00 39.48 39.87 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 0.26 0.08 4.37 0.87 -1.65 -2.52 113.55 114.95 1tm9 h SER 89 Ca 0.00 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1tm9 h SER 89 Cb 0.00 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 61.95 1tm9 h SER 89 CO 0.00 0.09 -0.04 0.71 -0.53 0.00 0.00 176.83 177.06 1tm9 h THR 90 N 0.25 0.00 -3.54 2.23 1.35 -1.88 -3.41 112.91 107.91 1tm9 h THR 90 Ca 0.48 -0.06 -0.70 0.00 -0.55 0.00 0.00 66.41 65.59 1tm9 h THR 90 Cb 1.46 0.00 -0.19 0.00 -1.73 0.00 0.00 68.15 67.68 1tm9 h THR 90 CO -0.13 0.00 -0.27 0.20 -0.25 0.00 0.00 175.52 175.06 1tm9 s ASN 91 N -2.72 6.17 -0.08 5.36 0.01 -0.95 -4.92 114.94 117.81 1tm9 s ASN 91 Ca -0.01 -0.69 -0.16 0.00 -0.71 0.00 0.00 52.86 51.29 1tm9 s ASN 91 Cb 0.00 -2.20 -0.29 0.00 0.41 0.00 0.00 41.25 39.17 1tm9 s ASN 91 CO 0.04 -0.52 0.64 0.28 -1.51 0.00 0.00 177.10 176.03 1tm9 h SER 92 N 8.68 0.45 -0.96 -1.22 0.02 -1.81 -2.73 113.55 115.97 1tm9 h SER 92 Ca -0.27 -0.88 0.14 0.00 -0.84 0.00 0.00 61.79 59.94 1tm9 h SER 92 Cb 1.12 -0.14 -0.15 0.00 0.14 0.00 0.00 62.40 63.36 1tm9 h SER 92 CO 0.77 1.62 -0.41 -0.62 -1.14 0.00 0.00 176.83 177.04 1tm9 n GLU 93 N -3.90 -0.26 -0.03 3.45 1.02 -1.26 0.19 120.64 119.85 1tm9 n GLU 93 Ca -0.23 1.48 -0.14 0.00 -0.02 0.00 0.00 57.16 58.25 1tm9 n GLU 93 Cb 0.92 -2.19 -0.11 0.00 -0.02 0.00 0.00 31.44 30.04 1tm9 n GLU 93 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1tm9 h PRO 94 N 0.00 0.11 -0.29 3.49 0.13 -1.96 -2.85 132.00 130.64 1tm9 h PRO 94 Ca 0.31 -0.11 0.08 0.00 -0.87 0.00 0.00 66.00 65.41 1tm9 h PRO 94 Cb 0.55 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1tm9 h PRO 94 CO -0.95 0.83 0.47 0.00 -0.23 0.00 0.00 178.00 178.13 1tm9 h ALA 95 N 0.28 1.89 0.01 -0.56 0.00 -0.84 0.28 119.26 120.33 1tm9 h ALA 95 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1tm9 h ALA 95 Cb 0.88 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1tm9 h ALA 95 CO 0.03 -0.62 -0.01 0.82 0.00 0.00 0.00 179.25 179.47 1tm9 h ILE 96 N 0.00 0.00 -0.99 0.00 2.04 0.21 -1.68 117.51 117.09 1tm9 h ILE 96 Ca 0.14 -0.08 0.35 0.00 1.00 0.00 0.00 64.86 66.27 1tm9 h ILE 96 Cb 1.08 0.00 -0.18 0.00 -0.74 0.00 0.00 36.82 36.98 1tm9 h ILE 96 CO -0.00 0.00 0.32 0.40 0.00 0.00 0.00 178.15 178.87 1tm9 h ILE 97 N -0.09 0.03 0.39 -0.67 5.03 -1.15 0.52 117.51 121.57 1tm9 h ILE 97 Ca -0.00 -0.01 -0.02 0.00 -0.12 0.00 0.00 64.86 64.71 1tm9 h ILE 97 Cb 0.01 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.81 1tm9 h ILE 97 CO 0.00 0.00 -0.19 -0.26 -0.68 0.00 0.00 178.15 177.03 1tm9 h PHE 98 N 0.03 -0.48 -0.94 1.37 0.04 -1.08 -2.56 116.94 113.32 1tm9 h PHE 98 Ca 0.73 -0.01 0.28 0.00 2.80 0.00 0.00 57.97 61.77 1tm9 h PHE 98 Cb 1.76 0.16 -0.15 0.00 2.20 0.00 0.00 35.95 39.92 1tm9 h PHE 98 CO -0.22 -0.20 0.35 0.00 -0.60 0.00 0.00 178.31 177.64 1tm9 h VAL 100 N 0.21 0.93 0.37 0.00 2.07 -0.83 -1.35 116.25 117.65 1tm9 h VAL 100 Ca 0.64 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 68.04 1tm9 h VAL 100 Cb 1.41 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1tm9 h VAL 100 CO -0.68 0.06 -0.43 0.40 0.02 0.00 0.00 177.57 176.95 1tm9 h ILE 101 N 0.33 0.00 0.00 4.57 1.08 0.19 -1.77 117.51 121.91 1tm9 h ILE 101 Ca 0.17 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.64 1tm9 h ILE 101 Cb 0.12 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.87 1tm9 h ILE 101 CO -0.15 0.00 0.00 -1.22 -0.69 0.00 0.00 178.15 176.09 1tm9 n TYR 102 N -4.99 0.00 -0.32 1.37 4.01 -0.40 -1.57 117.16 115.26 1tm9 n TYR 102 Ca -0.10 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.56 1tm9 n TYR 102 Cb 0.38 -0.49 -0.08 0.00 -0.31 0.00 0.00 39.34 38.84 1tm9 n TYR 102 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1tm9 n PHE 103 N -2.80 -0.33 -0.25 -0.72 7.35 -0.53 0.33 117.46 120.52 1tm9 n PHE 103 Ca 0.00 0.95 -0.10 0.00 -0.76 0.00 0.00 57.45 57.54 1tm9 n PHE 103 Cb 0.00 -0.56 -0.08 0.00 0.35 0.00 0.00 39.48 39.19 1tm9 n PHE 103 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1tm9 h LEU 104 N 0.00 -1.68 -1.01 -2.13 3.38 -0.57 0.58 115.31 113.88 1tm9 h LEU 104 Ca 0.12 0.24 0.14 0.00 0.09 0.00 0.00 57.88 58.47 1tm9 h LEU 104 Cb 0.31 0.72 -0.09 0.00 0.09 0.00 0.00 40.66 41.69 1tm9 h LEU 104 CO -0.71 -0.25 0.63 1.88 0.09 0.00 0.00 178.44 180.08 1tm9 h TYR 105 N -0.14 1.13 0.00 1.13 0.05 0.66 0.53 116.97 120.33 1tm9 h TYR 105 Ca 0.10 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.91 1tm9 h TYR 105 Cb 0.40 -0.36 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 1tm9 h TYR 105 CO -0.88 0.41 -0.01 0.45 -1.05 0.00 0.00 178.16 177.07 1tm9 h HIS 106 N 0.95 0.00 -0.44 4.88 3.86 0.47 0.10 115.15 124.97 1tm9 h HIS 106 Ca 0.52 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.73 1tm9 h HIS 106 Cb 0.58 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.05 1tm9 h HIS 106 CO -0.00 0.01 0.00 1.19 0.86 0.00 0.00 177.93 179.99 1tm9 n PHE 107 N -3.98 0.76 -3.45 2.45 3.72 0.16 -4.96 117.46 112.16 1tm9 n PHE 107 Ca -0.03 -0.57 -0.18 0.00 -0.05 0.00 0.00 57.45 56.62 1tm9 n PHE 107 Cb 0.09 -0.10 0.03 0.00 -0.94 0.00 0.00 39.48 38.56 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 0.64 -1.16 0.88 1.37 0.00 0.43 -4.95 105.19 102.39 1tm9 n GLY 108 Ca 0.17 0.51 -0.03 0.00 0.00 0.00 0.00 46.02 46.67 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 -3.02 0.00 -1.28 1.61 3.72 -0.63 -4.98 117.46 112.89 1tm9 n PHE 109 Ca -0.10 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 56.95 1tm9 n PHE 109 Cb 0.59 -0.12 0.11 0.00 -0.94 0.00 0.00 39.48 39.11 1tm9 n PHE 109 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1tm9 n LEU 110 N -3.41 4.39 -4.35 4.37 4.77 -1.26 -5.00 117.00 116.51 1tm9 n LEU 110 Ca -0.06 0.65 -0.27 0.00 -0.03 0.00 0.00 56.01 56.30 1tm9 n LEU 110 Cb 0.34 -1.49 -0.13 0.00 -2.33 0.00 0.00 43.42 39.82 1tm9 n LEU 110 CO 0.02 -1.70 -0.54 -0.54 -1.33 0.00 0.00 177.39 173.30 1tm9 s LYS 111 N -3.76 1.30 -0.30 3.23 -0.14 -1.26 -4.91 119.74 113.90 1tm9 s LYS 111 Ca 0.75 -1.30 -0.06 0.00 -1.36 0.00 0.00 55.97 54.00 1tm9 s LYS 111 Cb -0.32 -1.68 0.19 0.00 -1.68 0.00 0.00 37.83 34.34 1tm9 s LYS 111 CO 0.49 0.39 0.87 0.34 -0.76 0.00 0.00 175.35 176.68 1tm9 s ASP 112 N -2.08 -0.87 -0.33 2.83 -1.08 -1.26 -4.74 116.67 109.15 1tm9 s ASP 112 Ca 0.12 0.27 -0.29 0.00 -0.52 0.00 0.00 52.55 52.14 1tm9 s ASP 112 Cb -0.10 1.62 -0.01 0.00 -1.46 0.00 0.00 42.92 42.97 1tm9 s ASP 112 CO 0.06 -0.16 1.70 0.20 0.52 0.00 0.00 175.17 177.49 1tm9 s ASN 113 N 2.91 6.03 0.00 -0.34 -0.87 -1.26 -4.81 114.94 116.61 1tm9 s ASN 113 Ca 0.15 1.25 0.00 0.00 -1.57 0.00 0.00 52.86 52.68 1tm9 s ASN 113 Cb -0.08 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 38.62 1tm9 s ASN 113 CO -0.20 -1.60 0.00 0.59 -2.57 0.00 0.00 177.10 173.32 1tm9 n ASN 114 N 9.78 0.00 -3.81 -1.22 5.03 -1.26 -5.17 115.26 118.62 1tm9 n ASN 114 Ca 0.21 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.36 1tm9 n ASN 114 Cb 0.47 0.00 0.23 0.00 -1.02 0.00 0.00 39.78 39.46 1tm9 n ASN 114 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1tm9 s LYS 115 N 0.00 -0.53 0.27 3.52 2.47 -1.26 -4.86 119.74 119.35 1tm9 s LYS 115 Ca 0.00 -0.37 0.00 0.00 -1.56 0.00 0.00 55.97 54.04 1tm9 s LYS 115 Cb 0.00 -1.71 0.00 0.00 -1.46 0.00 0.00 37.83 34.66 1tm9 s LYS 115 CO 0.00 -3.20 0.00 1.17 0.16 0.00 0.00 175.35 173.48 1tm9 n LYS 116 N -4.33 -0.65 -1.63 4.03 4.81 -1.26 -4.79 118.16 114.33 1tm9 n LYS 116 Ca 0.16 0.43 -0.49 0.00 -0.87 0.00 0.00 58.31 57.54 1tm9 n LYS 116 Cb 0.59 -0.80 -0.05 0.00 0.02 0.00 0.00 35.03 34.80 1tm9 n LYS 116 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1tm9 n GLN 117 N -1.65 1.70 0.00 1.64 10.64 -1.26 -4.95 117.38 123.50 1tm9 n GLN 117 Ca 0.00 0.61 0.00 0.00 -1.83 0.00 0.00 57.00 55.79 1tm9 n GLN 117 Cb 0.15 -2.33 0.00 0.00 -0.86 0.00 0.00 30.24 27.20 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 3.05 0.00 0.11 -0.39 0.13 -1.26 -4.99 119.36 116.01 1tm9 n ILE 118 Ca 0.18 0.00 -0.04 0.00 -1.10 0.00 0.00 62.75 61.78 1tm9 n ILE 118 Cb 0.24 0.00 -0.02 0.00 -0.84 0.00 0.00 39.64 39.02 1tm9 n ILE 118 CO 0.00 0.00 0.00 0.40 2.80 0.00 0.00 176.55 179.75 1tm9 h ILE 119 N 0.00 0.00 -1.85 9.51 1.08 -1.97 0.26 117.51 124.54 1tm9 h ILE 119 Ca 0.00 -0.03 0.54 0.00 -0.39 0.00 0.00 64.86 64.98 1tm9 h ILE 119 Cb 0.00 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 33.68 1tm9 h ILE 119 CO 0.00 0.00 1.35 0.07 -0.69 0.00 0.00 178.15 178.88 1tm9 h LYS 120 N -0.31 0.00 0.32 2.37 2.10 -1.97 1.07 116.57 120.15 1tm9 h LYS 120 Ca -0.03 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.61 1tm9 h LYS 120 Cb 0.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 1tm9 h LYS 120 CO 0.05 0.00 -0.15 -0.22 -2.00 0.00 0.00 179.45 177.13 1tm9 h LYS 121 N 0.00 -0.41 0.61 0.07 1.63 -1.83 -2.21 116.57 114.43 1tm9 h LYS 121 Ca 0.88 0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 60.68 1tm9 h LYS 121 Cb 3.56 0.09 0.01 0.00 -0.60 0.00 0.00 32.23 35.29 1tm9 h LYS 121 CO -0.01 -0.12 -0.29 0.00 -3.45 0.00 0.00 179.45 175.58 1tm9 h ALA 122 N -0.73 -1.10 -1.00 5.00 0.00 0.29 0.10 119.26 121.82 1tm9 h ALA 122 Ca -0.04 -0.18 0.40 0.00 0.00 0.00 0.00 54.91 55.09 1tm9 h ALA 122 Cb 0.48 0.32 -0.18 0.00 0.00 0.00 0.00 17.79 18.41 1tm9 h ALA 122 CO 0.07 -1.04 0.54 1.88 0.00 0.00 0.00 179.25 180.70 1tm9 h TYR 123 N -0.90 0.84 -0.19 0.00 -1.99 0.11 1.70 116.97 116.54 1tm9 h TYR 123 Ca -0.08 0.04 -0.20 0.00 2.00 0.00 0.00 58.73 60.48 1tm9 h TYR 123 Cb 0.63 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 39.16 1tm9 h TYR 123 CO 0.07 -0.44 -0.68 1.49 -0.00 0.00 0.00 178.16 178.60 1tm9 h GLU 124 N 0.05 0.77 -0.21 4.88 4.22 -1.16 0.29 114.58 123.43 1tm9 h GLU 124 Ca 0.83 -0.57 0.06 0.00 0.08 0.00 0.00 59.36 59.76 1tm9 h GLU 124 Cb 2.16 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 31.50 1tm9 h GLU 124 CO -0.75 1.19 0.19 0.00 -2.18 0.00 0.00 179.01 177.46 1tm9 h THR 125 N 0.56 0.62 0.00 0.32 1.03 0.51 0.10 112.91 116.05 1tm9 h THR 125 Ca -0.02 0.00 -0.07 0.00 -0.01 0.00 0.00 66.41 66.31 1tm9 h THR 125 Cb 1.30 0.86 -0.01 0.00 -1.07 0.00 0.00 68.15 69.22 1tm9 h THR 125 CO 0.14 0.00 -0.95 -0.38 -0.01 0.00 0.00 175.52 174.32 1tm9 n ILE 126 N -4.05 1.47 -0.28 0.00 5.41 -0.48 -2.25 119.36 119.18 1tm9 n ILE 126 Ca 0.02 0.11 0.33 0.00 1.00 0.00 0.00 62.75 64.22 1tm9 n ILE 126 Cb 0.32 -2.30 0.64 0.00 -0.71 0.00 0.00 39.64 37.59 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 -0.95 3.03 0.00 -1.39 0.00 -0.28 1.77 119.26 121.44 1tm9 h ALA 127 Ca -0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1tm9 h ALA 127 Cb 0.87 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1tm9 h ALA 127 CO -0.06 -1.64 -0.39 -3.47 0.00 0.00 0.00 179.25 173.69 1tm9 n ASP 128 N -3.65 1.39 -0.30 0.00 2.03 0.34 -3.47 116.55 112.91 1tm9 n ASP 128 Ca 0.25 0.55 0.13 0.00 0.52 0.00 0.00 54.79 56.24 1tm9 n ASP 128 Cb 1.41 -0.79 0.29 0.00 -0.72 0.00 0.00 41.12 41.32 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 -0.77 0.21 -0.32 1.67 2.35 -0.64 1.59 115.58 119.68 1tm9 h ASN 129 Ca 0.00 0.17 0.01 0.00 -0.55 0.00 0.00 56.30 55.92 1tm9 h ASN 129 Cb 0.39 0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 1tm9 h ASN 129 CO 0.00 -0.05 0.21 -0.29 -1.65 0.00 0.00 177.43 175.65 1tm9 h ILE 130 N 0.33 1.06 0.00 2.81 2.10 0.24 0.56 117.51 124.62 1tm9 h ILE 130 Ca 0.55 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 66.35 1tm9 h ILE 130 Cb 1.05 0.63 0.00 0.00 -1.09 0.00 0.00 36.82 37.41 1tm9 h ILE 130 CO -0.56 0.07 0.00 0.00 -1.08 0.00 0.00 178.15 176.58 1tm9 n ALA 131 N -2.50 2.52 0.13 0.18 0.00 0.54 -2.32 120.51 119.06 1tm9 n ALA 131 Ca 0.02 -0.17 0.09 0.00 0.00 0.00 0.00 53.44 53.38 1tm9 n ALA 131 Cb 0.09 -1.45 0.04 0.00 0.00 0.00 0.00 19.45 18.13 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 0.00 0.00 0.00 3.58 0.89 -3.22 116.42 117.67 1tm9 h ASP 132 Ca 0.00 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.33 1tm9 h ASP 132 Cb 0.01 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 1tm9 h ASP 132 CO 0.00 0.13 -2.01 0.00 -2.88 0.00 0.00 179.24 174.48 1tm9 n TYR 133 N -2.87 0.00 0.00 0.28 0.18 -0.98 -4.72 117.16 109.05 1tm9 n TYR 133 Ca -0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1tm9 n TYR 133 Cb 0.60 -0.60 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 1tm9 n TYR 133 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1tm9 n LEU 134 N -2.35 0.00 0.00 -3.48 4.77 -1.05 -4.91 117.00 109.98 1tm9 n LEU 134 Ca -0.13 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1tm9 n LEU 134 Cb 0.71 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 1tm9 n LEU 134 CO 0.40 0.00 0.00 -3.20 -1.33 0.00 0.00 177.39 173.26 1tm9 n ASN 135 N -0.30 0.00 -4.08 -1.43 2.85 -1.26 -4.96 115.26 106.08 1tm9 n ASN 135 Ca 0.00 0.00 -0.31 0.00 -0.11 0.00 0.00 54.58 54.16 1tm9 n ASN 135 Cb 0.00 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.00 1tm9 n ASN 135 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1tm9 n GLU 136 N 0.00 -3.44 0.00 1.20 2.13 -1.22 -5.13 120.64 114.19 1tm9 n GLU 136 Ca 0.00 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.22 1tm9 n GLU 136 Cb 0.00 -4.89 0.00 0.00 0.27 0.00 0.00 31.44 26.82 1tm9 n GLU 136 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81