#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 0.89 0.30 0.03 2.56 -1.26 -5.13 118.70 116.09 1tm9 s GLU 2 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.97 54.19 1tm9 s GLU 2 Cb 0.00 -0.19 0.00 0.00 2.00 0.00 0.00 34.13 35.94 1tm9 s GLU 2 CO 0.00 -1.26 0.00 1.04 -0.56 0.00 0.00 175.26 174.48 1tm9 n GLN 3 N 3.74 -2.05 -3.65 4.30 3.00 -1.26 -4.93 117.38 116.53 1tm9 n GLN 3 Ca 0.15 1.49 -0.02 0.00 -0.01 0.00 0.00 57.00 58.62 1tm9 n GLN 3 Cb 0.54 -2.59 -0.07 0.00 0.00 0.00 0.00 30.24 28.12 1tm9 n GLN 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1tm9 s ASN 4 N -5.62 -0.07 0.00 1.08 4.22 -1.26 -4.84 114.94 108.44 1tm9 s ASN 4 Ca 0.00 0.13 0.00 0.00 -2.14 0.00 0.00 52.86 50.85 1tm9 s ASN 4 Cb 0.00 0.40 0.00 0.00 1.28 0.00 0.00 41.25 42.93 1tm9 s ASN 4 CO 0.00 -0.02 0.00 -3.20 -2.04 0.00 0.00 177.10 171.84 1tm9 n ASN 5 N 2.06 0.00 -0.12 3.54 2.85 -1.26 -4.03 115.26 118.30 1tm9 n ASN 5 Ca -0.12 0.00 -0.03 0.00 -0.11 0.00 0.00 54.58 54.31 1tm9 n ASN 5 Cb 0.57 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.56 1tm9 n ASN 5 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1tm9 n ILE 6 N 0.00 -0.19 -0.31 -1.44 2.08 -1.26 0.90 119.36 119.13 1tm9 n ILE 6 Ca 0.00 1.63 0.03 0.00 0.56 0.00 0.00 62.75 64.97 1tm9 n ILE 6 Cb 0.00 -2.11 0.09 0.00 -0.75 0.00 0.00 39.64 36.88 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 -3.60 -0.11 0.10 0.38 0.00 -1.26 0.12 118.16 113.78 1tm9 n LYS 7 Ca 0.01 1.31 -0.13 0.00 0.00 0.00 0.00 58.31 59.50 1tm9 n LYS 7 Cb 0.07 -1.96 -0.08 0.00 0.00 0.00 0.00 35.03 33.07 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 -0.18 -1.01 1.64 4.81 0.33 -2.44 114.58 117.73 1tm9 h GLU 8 Ca 0.37 0.01 0.33 0.00 -0.13 0.00 0.00 59.36 59.94 1tm9 h GLU 8 Cb 0.58 0.04 -0.15 0.00 0.63 0.00 0.00 28.75 29.86 1tm9 h GLU 8 CO -0.86 -0.04 0.58 1.96 -0.73 0.00 0.00 179.01 179.92 1tm9 h GLN 9 N -0.29 0.29 0.53 1.92 4.20 0.76 0.14 115.11 122.67 1tm9 h GLN 9 Ca -0.02 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 1tm9 h GLN 9 Cb 0.23 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 27.95 1tm9 h GLN 9 CO 0.03 0.19 -0.25 -0.07 -0.67 0.00 0.00 178.83 178.06 1tm9 h LEU 10 N 0.30 -0.60 -0.85 1.46 3.38 -0.47 -2.71 115.31 115.82 1tm9 h LEU 10 Ca 0.74 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.81 1tm9 h LEU 10 Cb 1.73 0.16 -0.10 0.00 0.09 0.00 0.00 40.66 42.53 1tm9 h LEU 10 CO -0.61 -0.37 -0.50 -0.38 0.09 0.00 0.00 178.44 176.68 1tm9 n ILE 11 N -4.28 -0.58 0.00 1.22 -0.00 -0.13 -1.12 119.36 114.47 1tm9 n ILE 11 Ca -0.09 2.25 0.00 0.00 -0.00 0.00 0.00 62.75 64.91 1tm9 n ILE 11 Cb 0.28 -2.79 0.00 0.00 -0.00 0.00 0.00 39.64 37.13 1tm9 n ILE 11 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 1tm9 n SER 12 N -4.92 0.00 -0.09 4.38 7.64 -0.21 0.21 113.62 120.63 1tm9 n SER 12 Ca 0.02 0.65 -0.02 0.00 1.01 0.00 0.00 58.87 60.52 1tm9 n SER 12 Cb 0.22 -0.17 -0.02 0.00 -1.01 0.00 0.00 64.21 63.23 1tm9 n SER 12 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1tm9 n PHE 13 N -1.68 -0.09 -0.33 1.43 3.72 -0.78 0.11 117.46 119.84 1tm9 n PHE 13 Ca 0.00 0.26 0.16 0.00 -0.05 0.00 0.00 57.45 57.82 1tm9 n PHE 13 Cb 0.00 -0.46 0.36 0.00 -0.94 0.00 0.00 39.48 38.45 1tm9 n PHE 13 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 1tm9 h PHE 14 N 0.00 0.88 -0.64 1.38 3.57 -0.54 0.45 116.94 122.04 1tm9 h PHE 14 Ca 0.03 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.60 1tm9 h PHE 14 Cb 0.08 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 1tm9 h PHE 14 CO -0.81 0.01 0.40 -0.97 -2.23 0.00 0.00 178.31 174.70 1tm9 h ASN 15 N 0.50 0.65 -0.44 0.41 -0.73 0.98 -1.65 115.58 115.30 1tm9 h ASN 15 Ca 0.62 -0.00 -0.28 0.00 1.87 0.00 0.00 56.30 58.51 1tm9 h ASN 15 Cb 1.20 -0.14 -0.11 0.00 0.27 0.00 0.00 38.32 39.54 1tm9 h ASN 15 CO -0.50 0.45 0.12 0.00 -0.37 0.00 0.00 177.43 177.13 1tm9 n GLN 16 N -4.70 1.89 0.00 6.67 10.64 0.16 -4.22 117.38 127.81 1tm9 n GLN 16 Ca 0.06 -1.37 0.00 0.00 -1.83 0.00 0.00 57.00 53.86 1tm9 n GLN 16 Cb 0.08 -1.77 0.00 0.00 -0.86 0.00 0.00 30.24 27.69 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 1.29 0.72 -2.97 2.61 0.00 -0.75 -4.62 120.51 116.78 1tm9 n ALA 17 Ca 0.34 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.38 1tm9 n ALA 17 Cb 0.65 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.98 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 4.93 1.77 -3.32 0.00 7.64 -1.26 -4.63 113.62 118.75 1tm9 n SER 19 Ca -0.12 0.25 -0.30 0.00 1.01 0.00 0.00 58.87 59.70 1tm9 n SER 19 Cb 0.45 -0.67 0.02 0.00 -1.01 0.00 0.00 64.21 63.00 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 -3.98 0.00 0.00 0.44 -2.24 -1.26 -4.97 114.28 102.28 1tm9 n THR 20 Ca -0.47 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 1tm9 n THR 20 Cb 0.85 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1tm9 n THR 20 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1tm9 n HIS 21 N -1.52 0.00 -0.49 4.78 8.25 -1.26 -4.50 115.22 120.47 1tm9 n HIS 21 Ca 0.03 0.00 0.39 0.00 -0.26 0.00 0.00 57.72 57.88 1tm9 n HIS 21 Cb 0.41 0.00 0.62 0.00 1.12 0.00 0.00 29.99 32.14 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 -0.90 -0.01 -0.36 -0.41 6.02 -1.26 0.58 117.38 121.04 1tm9 n GLN 22 Ca 0.00 0.96 0.05 0.00 -0.01 0.00 0.00 57.00 58.01 1tm9 n GLN 22 Cb 0.00 -2.05 0.13 0.00 1.02 0.00 0.00 30.24 29.34 1tm9 n GLN 22 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1tm9 h GLU 23 N 0.00 -0.00 -0.30 -1.09 3.07 -1.96 0.66 114.58 114.96 1tm9 h GLU 23 Ca 0.75 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.65 1tm9 h GLU 23 Cb 2.75 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 30.60 1tm9 h GLU 23 CO -0.19 -0.00 -0.32 0.00 -1.40 0.00 0.00 179.01 177.09 1tm9 h ARG 24 N -0.00 -0.18 -0.42 2.33 3.08 -0.11 1.48 114.38 120.57 1tm9 h ARG 24 Ca 0.47 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.65 1tm9 h ARG 24 Cb 0.72 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.79 1tm9 h ARG 24 CO -1.02 -0.12 0.67 -0.07 -1.07 0.00 0.00 179.97 178.36 1tm9 h LEU 25 N -0.19 0.00 0.20 3.04 3.38 -1.07 1.53 115.31 122.20 1tm9 h LEU 25 Ca 0.05 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.69 1tm9 h LEU 25 Cb 0.32 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.09 1tm9 h LEU 25 CO -0.38 0.00 -1.53 -0.78 0.09 0.00 0.00 178.44 175.84 1tm9 h ASP 26 N 0.00 0.65 0.79 -0.43 3.58 0.24 -3.35 116.42 117.90 1tm9 h ASP 26 Ca 0.20 -0.79 -0.04 0.00 0.42 0.00 0.00 57.03 56.82 1tm9 h ASP 26 Cb 1.53 -0.21 0.01 0.00 1.72 0.00 0.00 39.33 42.37 1tm9 h ASP 26 CO -0.00 1.64 -0.40 -0.26 -2.88 0.00 0.00 179.24 177.34 1tm9 h PHE 27 N 0.11 -1.04 -1.10 0.28 -1.00 0.82 1.44 116.94 116.46 1tm9 h PHE 27 Ca -0.26 -0.02 0.37 0.00 2.81 0.00 0.00 57.97 60.87 1tm9 h PHE 27 Cb 2.10 0.35 -0.10 0.00 3.61 0.00 0.00 35.95 41.91 1tm9 h PHE 27 CO 0.10 -0.63 0.72 0.44 -1.61 0.00 0.00 178.31 177.33 1tm9 n ILE 28 N -4.97 -0.17 0.00 -0.55 -5.35 -0.65 0.31 119.36 107.97 1tm9 n ILE 28 Ca -0.13 1.35 0.00 0.00 -0.27 0.00 0.00 62.75 63.69 1tm9 n ILE 28 Cb 0.43 -2.21 0.00 0.00 -1.74 0.00 0.00 39.64 36.12 1tm9 n ILE 28 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tm9 n SER 30 N -1.88 0.09 -1.94 0.00 7.64 0.49 -0.03 113.62 117.99 1tm9 n SER 30 Ca 0.00 1.03 -0.08 0.00 1.01 0.00 0.00 58.87 60.83 1tm9 n SER 30 Cb 0.00 -0.51 -0.11 0.00 -1.01 0.00 0.00 64.21 62.58 1tm9 n SER 30 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1tm9 n THR 31 N -4.04 2.45 0.00 0.44 -1.04 0.90 -3.00 114.28 109.98 1tm9 n THR 31 Ca 0.37 -1.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.26 1tm9 n THR 31 Cb 1.55 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 68.24 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 2.31 0.00 -0.53 -2.82 0.63 0.96 -4.92 116.66 112.29 1tm9 n ARG 32 Ca 0.29 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 57.21 1tm9 n ARG 32 Cb 0.73 0.00 0.19 0.00 0.45 0.00 0.00 32.46 33.82 1tm9 n ARG 32 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1tm9 n GLU 33 N -0.27 2.72 0.00 -0.14 0.28 -1.00 -4.62 120.64 117.61 1tm9 n GLU 33 Ca 0.00 -1.67 0.00 0.00 -0.16 0.00 0.00 57.16 55.33 1tm9 n GLU 33 Cb 0.00 -1.84 0.00 0.00 1.43 0.00 0.00 31.44 31.03 1tm9 n GLU 33 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1tm9 n SER 34 N 0.14 0.00 0.02 -1.84 3.41 -1.19 -4.98 113.62 109.18 1tm9 n SER 34 Ca 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 1tm9 n SER 34 Cb 0.86 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 1tm9 n SER 34 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1tm9 n ASP 35 N 0.00 -0.37 0.00 4.04 -0.08 -1.26 -5.15 116.55 113.72 1tm9 n ASP 35 Ca 0.00 0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.41 1tm9 n ASP 35 Cb 0.00 0.58 0.00 0.00 2.34 0.00 0.00 41.12 44.04 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 -2.41 0.00 -0.01 5.18 5.66 -1.26 -5.04 114.28 116.40 1tm9 n THR 36 Ca 0.00 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.99 1tm9 n THR 36 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1tm9 n THR 36 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1tm9 n PHE 37 N 0.00 0.00 0.36 1.09 3.72 -1.26 -4.58 117.46 116.79 1tm9 n PHE 37 Ca 0.00 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.45 1tm9 n PHE 37 Cb 0.00 -0.07 0.22 0.00 -0.94 0.00 0.00 39.48 38.69 1tm9 n PHE 37 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1tm9 n SER 38 N -2.59 0.00 0.06 4.37 3.41 -1.26 -1.05 113.62 116.57 1tm9 n SER 38 Ca -0.03 0.42 0.01 0.00 -0.26 0.00 0.00 58.87 59.02 1tm9 n SER 38 Cb 0.53 -0.45 -0.06 0.00 -0.26 0.00 0.00 64.21 63.97 1tm9 n SER 38 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1tm9 h SER 39 N 0.00 0.00 0.00 4.04 0.02 -1.97 -3.43 113.55 112.20 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 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1tm9 h SER 39 CO 0.00 0.52 0.00 0.52 -1.14 0.00 0.00 176.83 176.73 1tm9 n VAL 40 N -2.94 0.00 -2.41 2.27 0.31 -0.21 -5.07 118.33 110.28 1tm9 n VAL 40 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1tm9 n VAL 40 Cb 0.80 -0.30 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 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 0.00 -1.64 4.52 2.03 -1.26 -5.13 116.55 115.07 1tm9 n ASP 41 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1tm9 n ASP 41 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1tm9 n ASP 41 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1tm9 n VAL 42 N 0.00 -4.64 -2.53 5.18 3.14 -1.26 -4.86 118.33 113.35 1tm9 n VAL 42 Ca 0.00 2.14 -0.36 0.00 -2.96 0.00 0.00 64.34 63.15 1tm9 n VAL 42 Cb 0.00 -2.91 -0.04 0.00 -1.06 0.00 0.00 33.84 29.83 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 -3.20 4.11 0.16 1.45 0.04 -1.26 -4.94 135.00 131.37 1tm9 s PRO 43 Ca 0.00 1.50 0.26 0.00 0.04 0.00 0.00 61.00 62.80 1tm9 s PRO 43 Cb 0.00 -2.49 0.69 0.00 0.04 0.00 0.00 34.50 32.74 1tm9 s PRO 43 CO 0.00 -0.19 1.64 1.28 0.04 0.00 0.00 177.00 179.77 1tm9 n LEU 44 N -0.18 0.72 0.40 -3.56 4.77 -1.26 -2.82 117.00 115.06 1tm9 n LEU 44 Ca 0.06 0.45 -0.19 0.00 -0.03 0.00 0.00 56.01 56.29 1tm9 n LEU 44 Cb 0.50 -0.29 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 1tm9 n LEU 44 CO 0.44 -0.12 0.59 -0.33 -1.33 0.00 0.00 177.39 176.65 1tm9 h GLU 45 N 0.00 -1.03 -0.04 3.23 5.08 -1.97 0.38 114.58 120.24 1tm9 h GLU 45 Ca 0.00 0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.27 1tm9 h GLU 45 Cb 0.72 0.23 0.01 0.00 0.50 0.00 0.00 28.75 30.21 1tm9 h GLU 45 CO 0.00 -0.68 -0.61 -1.00 -1.00 0.00 0.00 179.01 175.71 1tm9 h PRO 46 N -1.07 0.49 -0.61 2.33 0.13 -1.82 -3.27 132.00 128.18 1tm9 h PRO 46 Ca -0.10 -0.47 0.13 0.00 -0.87 0.00 0.00 66.00 64.69 1tm9 h PRO 46 Cb 0.84 0.12 -0.11 0.00 0.13 0.00 0.00 31.00 31.99 1tm9 h PRO 46 CO 0.12 1.11 -0.03 0.82 -0.23 0.00 0.00 178.00 179.80 1tm9 h ILE 47 N 0.04 0.48 -0.07 -3.56 1.08 -1.55 1.52 117.51 115.44 1tm9 h ILE 47 Ca -0.07 -0.03 0.02 0.00 -0.39 0.00 0.00 64.86 64.39 1tm9 h ILE 47 Cb 1.29 0.38 -0.00 0.00 -3.07 0.00 0.00 36.82 35.42 1tm9 h ILE 47 CO 0.12 0.02 0.37 0.11 -0.69 0.00 0.00 178.15 178.08 1tm9 h LYS 48 N 0.09 0.00 0.17 2.37 1.57 -0.96 0.69 116.57 120.50 1tm9 h LYS 48 Ca 0.31 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.82 1tm9 h LYS 48 Cb 0.50 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.84 1tm9 h LYS 48 CO -0.54 0.00 -1.17 -0.97 -0.57 0.00 0.00 179.45 176.20 1tm9 h ASN 49 N 0.00 0.73 -0.02 0.86 -0.73 0.20 -3.02 115.58 113.60 1tm9 h ASN 49 Ca 0.03 -0.89 0.00 0.00 1.87 0.00 0.00 56.30 57.31 1tm9 h ASN 49 Cb 0.77 -0.23 0.00 0.00 0.27 0.00 0.00 38.32 39.13 1tm9 h ASN 49 CO -0.00 1.56 0.00 2.30 -0.37 0.00 0.00 177.43 180.92 1tm9 n ILE 50 N -3.89 0.02 0.01 2.57 -5.35 0.21 -2.80 119.36 110.12 1tm9 n ILE 50 Ca -0.15 -0.08 0.08 0.00 -0.27 0.00 0.00 62.75 62.34 1tm9 n ILE 50 Cb 0.96 -0.19 -0.12 0.00 -1.74 0.00 0.00 39.64 38.55 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 -0.61 0.36 -0.39 7.28 5.41 0.70 -4.22 119.36 127.89 1tm9 n ILE 51 Ca 0.19 -0.56 -0.06 0.00 1.00 0.00 0.00 62.75 63.32 1tm9 n ILE 51 Cb 0.15 -0.17 0.02 0.00 -0.71 0.00 0.00 39.64 38.93 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 -2.45 1.31 -0.02 0.38 1.02 -1.12 -3.34 120.64 116.42 1tm9 n GLU 52 Ca -0.06 -0.63 -0.03 0.00 -0.02 0.00 0.00 57.16 56.42 1tm9 n GLU 52 Cb 0.64 -1.25 -0.03 0.00 -0.02 0.00 0.00 31.44 30.79 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 0.84 0.27 1.15 -3.67 0.13 -1.26 -4.59 119.36 112.23 1tm9 n ILE 53 Ca 0.12 -0.14 0.13 0.00 -1.10 0.00 0.00 62.75 61.76 1tm9 n ILE 53 Cb 0.58 -0.80 0.22 0.00 -0.84 0.00 0.00 39.64 38.79 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 -2.36 0.00 0.01 9.51 -2.24 -1.21 -4.34 114.28 113.65 1tm9 n THR 54 Ca -0.07 -0.39 -0.10 0.00 -2.27 0.00 0.00 64.05 61.22 1tm9 n THR 54 Cb 0.61 1.15 -0.03 0.00 -2.10 0.00 0.00 70.33 69.96 1tm9 n THR 54 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1tm9 h LYS 55 N 3.67 -0.23 -6.96 -0.78 1.57 -1.81 -3.34 116.57 108.68 1tm9 h LYS 55 Ca 0.00 0.02 -0.45 0.00 -1.87 0.00 0.00 60.65 58.34 1tm9 h LYS 55 Cb 0.81 0.05 0.22 0.00 0.08 0.00 0.00 32.23 33.40 1tm9 h LYS 55 CO 0.00 -0.16 -0.41 -0.25 -0.57 0.00 0.00 179.45 178.07 1tm9 n ASP 56 N -5.33 -1.90 -0.08 0.86 8.00 -1.26 -4.91 116.55 111.93 1tm9 n ASP 56 Ca -0.03 -0.11 -0.15 0.00 0.71 0.00 0.00 54.79 55.21 1tm9 n ASP 56 Cb 0.24 -1.16 -0.11 0.00 -0.02 0.00 0.00 41.12 40.07 1tm9 n ASP 56 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1tm9 h GLU 57 N -2.40 0.00 -0.39 -1.24 4.81 -1.95 -3.20 114.58 110.21 1tm9 h GLU 57 Ca -0.57 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 58.75 1tm9 h GLU 57 Cb 1.34 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.70 1tm9 h GLU 57 CO 0.44 0.87 0.27 -0.91 -0.73 0.00 0.00 179.01 178.96 1tm9 h ASN 58 N -1.00 0.10 0.40 1.04 2.35 -1.94 -2.61 115.58 113.92 1tm9 h ASN 58 Ca -0.13 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.60 1tm9 h ASN 58 Cb 1.02 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.37 1tm9 h ASN 58 CO -0.08 0.06 -0.19 1.56 -1.65 0.00 0.00 177.43 177.13 1tm9 h GLN 59 N 0.12 -0.51 -0.98 0.81 1.08 -1.84 0.74 115.11 114.52 1tm9 h GLN 59 Ca 0.18 0.03 0.34 0.00 -1.45 0.00 0.00 58.65 57.75 1tm9 h GLN 59 Cb 0.58 0.12 -0.18 0.00 -0.05 0.00 0.00 27.48 27.94 1tm9 h GLN 59 CO -0.02 -0.34 0.26 1.04 -0.95 0.00 0.00 178.83 178.82 1tm9 n GLN 60 N -3.59 -0.07 0.00 1.46 6.02 -1.01 0.19 117.38 120.39 1tm9 n GLN 60 Ca -0.07 1.41 -0.13 0.00 -0.01 0.00 0.00 57.00 58.20 1tm9 n GLN 60 Cb 0.21 -2.37 -0.10 0.00 1.02 0.00 0.00 30.24 29.00 1tm9 n GLN 60 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1tm9 h ILE 61 N 0.00 1.31 -0.29 5.09 2.04 -1.34 -1.46 117.51 122.86 1tm9 h ILE 61 Ca 0.71 -1.27 0.08 0.00 1.00 0.00 0.00 64.86 65.38 1tm9 h ILE 61 Cb 1.69 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.89 1tm9 h ILE 61 CO -0.84 0.31 0.23 -0.33 0.00 0.00 0.00 178.15 177.52 1tm9 h GLU 62 N -0.64 0.00 -0.04 2.37 5.08 0.69 -0.22 114.58 121.83 1tm9 h GLU 62 Ca -0.01 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 1tm9 h GLU 62 Cb 0.56 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.82 1tm9 h GLU 62 CO 0.01 0.00 -0.61 0.82 -1.00 0.00 0.00 179.01 178.23 1tm9 h ILE 63 N 0.00 1.39 -0.33 3.13 2.04 0.23 -2.16 117.51 121.81 1tm9 h ILE 63 Ca 0.14 -2.00 0.05 0.00 1.00 0.00 0.00 64.86 64.04 1tm9 h ILE 63 Cb 0.59 2.42 -0.08 0.00 -0.74 0.00 0.00 36.82 39.01 1tm9 h ILE 63 CO -0.00 0.59 -0.53 0.74 0.00 0.00 0.00 178.15 178.95 1tm9 h THR 64 N 0.03 0.02 -0.73 -0.27 2.02 0.07 1.40 112.91 115.46 1tm9 h THR 64 Ca -0.06 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1tm9 h THR 64 Cb 1.29 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1tm9 h THR 64 CO 0.12 0.00 0.41 0.11 0.37 0.00 0.00 175.52 176.54 1tm9 h LYS 65 N -0.44 1.00 0.19 6.66 6.56 -1.59 -1.71 116.57 127.24 1tm9 h LYS 65 Ca 0.07 -0.11 0.01 0.00 -1.06 0.00 0.00 60.65 59.57 1tm9 h LYS 65 Cb 0.62 -0.20 -0.03 0.00 -0.57 0.00 0.00 32.23 32.04 1tm9 h LYS 65 CO -0.55 0.73 -0.33 0.82 -2.06 0.00 0.00 179.45 178.06 1tm9 h ILE 66 N 1.00 0.31 -0.87 1.86 2.04 -0.32 0.59 117.51 122.12 1tm9 h ILE 66 Ca 0.26 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.29 1tm9 h ILE 66 Cb 0.01 0.31 -0.11 0.00 -0.74 0.00 0.00 36.82 36.29 1tm9 h ILE 66 CO -0.04 0.00 0.42 0.00 0.00 0.00 0.00 178.15 178.53 1tm9 h ALA 67 N -0.01 1.35 -0.17 1.87 0.00 0.21 0.84 119.26 123.36 1tm9 h ALA 67 Ca 0.01 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1tm9 h ALA 67 Cb 0.60 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1tm9 h ALA 67 CO -0.15 -0.19 -0.25 0.28 0.00 0.00 0.00 179.25 178.94 1tm9 h VAL 68 N 0.53 1.25 -0.18 0.00 2.07 -0.29 0.52 116.25 120.16 1tm9 h VAL 68 Ca 0.50 -1.16 -0.08 0.00 0.82 0.00 0.00 66.70 66.78 1tm9 h VAL 68 Cb 0.82 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1tm9 h VAL 68 CO -0.43 0.36 -0.24 -1.13 0.02 0.00 0.00 177.57 176.15 1tm9 h ASN 69 N 0.27 0.32 0.88 0.57 -0.73 0.61 1.62 115.58 119.13 1tm9 h ASN 69 Ca 0.04 -0.10 0.00 0.00 1.87 0.00 0.00 56.30 58.12 1tm9 h ASN 69 Cb 0.60 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 39.10 1tm9 h ASN 69 CO 0.04 0.57 -0.82 0.78 -0.37 0.00 0.00 177.43 177.63 1tm9 h ASN 70 N 0.29 0.00 0.00 1.15 4.21 -0.09 -3.33 115.58 117.82 1tm9 h ASN 70 Ca 0.05 -0.14 -0.16 0.00 1.21 0.00 0.00 56.30 57.25 1tm9 h ASN 70 Cb 0.59 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.77 1tm9 h ASN 70 CO 0.04 0.07 -0.96 0.40 -1.29 0.00 0.00 177.43 175.69 1tm9 h ILE 71 N 0.00 0.88 -0.93 2.81 1.08 0.79 -3.08 117.51 119.06 1tm9 h ILE 71 Ca 0.00 -2.01 0.27 0.00 -0.39 0.00 0.00 64.86 62.73 1tm9 h ILE 71 Cb 0.85 2.01 -0.04 0.00 -3.07 0.00 0.00 36.82 36.57 1tm9 h ILE 71 CO 0.00 0.30 0.86 0.07 -0.69 0.00 0.00 178.15 178.68 1tm9 h LYS 72 N -1.00 0.00 0.13 2.37 2.10 0.22 1.47 116.57 121.86 1tm9 h LYS 72 Ca -0.25 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.10 1tm9 h LYS 72 Cb 1.12 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1tm9 h LYS 72 CO -0.15 0.00 -1.52 1.15 -2.00 0.00 0.00 179.45 176.93 1tm9 h THR 73 N 0.00 1.18 0.00 0.07 2.02 -1.68 -3.25 112.91 111.25 1tm9 h THR 73 Ca 0.44 -2.80 -0.00 0.00 0.77 0.00 0.00 66.41 64.82 1tm9 h THR 73 Cb 2.15 2.79 -0.00 0.00 -1.74 0.00 0.00 68.15 71.34 1tm9 h THR 73 CO -0.00 0.83 -0.00 -0.07 0.37 0.00 0.00 175.52 176.64 1tm9 h LEU 74 N 0.07 0.00 0.00 2.58 3.38 0.21 0.44 115.31 121.99 1tm9 h LEU 74 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1tm9 h LEU 74 Cb 2.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.77 1tm9 h LEU 74 CO 0.17 0.00 0.00 -0.24 0.09 0.00 0.00 178.44 178.46 1tm9 n SER 75 N -3.40 0.00 -3.09 -0.43 2.88 -0.64 -3.49 113.62 105.45 1tm9 n SER 75 Ca -0.03 -0.63 -0.16 0.00 -1.33 0.00 0.00 58.87 56.72 1tm9 n SER 75 Cb 0.08 -0.06 -0.01 0.00 -0.75 0.00 0.00 64.21 63.47 1tm9 n SER 75 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1tm9 n SER 76 N -1.06 0.14 -4.56 -3.46 3.41 0.15 -5.08 113.62 103.16 1tm9 n SER 76 Ca 0.17 -3.15 -0.41 0.00 -0.26 0.00 0.00 58.87 55.22 1tm9 n SER 76 Cb 0.11 -0.08 -0.08 0.00 -0.26 0.00 0.00 64.21 63.90 1tm9 n SER 76 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1tm9 s VAL 77 N -1.83 5.06 0.00 -3.33 1.01 -1.23 -4.96 120.40 115.13 1tm9 s VAL 77 Ca 0.36 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1tm9 s VAL 77 Cb 0.33 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.80 1tm9 s VAL 77 CO -0.08 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.48 1tm9 n GLY 78 N 4.81 0.95 1.33 4.51 0.00 -1.26 -4.68 105.19 110.84 1tm9 n GLY 78 Ca -0.06 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 3.48 1.08 -3.55 4.61 0.00 -1.26 -5.00 120.51 119.86 1tm9 n ALA 79 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1tm9 n ALA 79 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1tm9 n ALA 79 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1tm9 n THR 80 N -2.16 3.25 -1.31 0.00 -2.24 -1.26 -4.93 114.28 105.63 1tm9 n THR 80 Ca 0.00 -5.21 0.00 0.00 -2.27 0.00 0.00 64.05 56.57 1tm9 n THR 80 Cb 0.00 -2.34 0.00 0.00 -2.10 0.00 0.00 70.33 65.89 1tm9 n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tm9 n GLY 81 N 2.10 -4.45 0.00 3.38 0.00 -1.26 -5.09 105.19 99.87 1tm9 n GLY 81 Ca 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.91 0.00 -0.84 1.61 7.27 -1.26 -4.96 117.38 120.10 1tm9 n GLN 82 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.77 1tm9 n GLN 82 Cb 0.00 0.00 0.17 0.00 2.41 0.00 0.00 30.24 32.82 1tm9 n GLN 82 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 1tm9 s TYR 83 N 0.00 1.83 0.01 3.69 2.02 -1.26 -4.61 117.35 119.02 1tm9 s TYR 83 Ca 0.00 1.51 0.25 0.00 -0.37 0.00 0.00 57.07 58.46 1tm9 s TYR 83 Cb 0.00 -3.21 1.38 0.00 -0.40 0.00 0.00 41.96 39.73 1tm9 s TYR 83 CO 0.00 -2.84 1.76 1.98 -1.57 0.00 0.00 175.55 174.89 1tm9 h MET 84 N -1.88 0.00 0.15 -0.62 1.85 -1.95 -1.67 114.93 110.81 1tm9 h MET 84 Ca -0.49 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.59 1tm9 h MET 84 Cb 1.28 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.31 1tm9 h MET 84 CO 0.48 0.00 -0.07 0.00 -0.40 0.00 0.00 176.91 176.91 1tm9 h ALA 85 N 1.90 -0.21 0.00 0.39 0.00 -1.97 -2.78 119.26 116.59 1tm9 h ALA 85 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1tm9 h ALA 85 Cb 0.08 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1tm9 h ALA 85 CO 0.00 -0.37 0.00 0.43 0.00 0.00 0.00 179.25 179.31 1tm9 n SER 86 N -4.97 0.40 -1.87 0.00 7.64 -0.65 -2.35 113.62 111.83 1tm9 n SER 86 Ca -0.09 0.65 -0.16 0.00 1.01 0.00 0.00 58.87 60.29 1tm9 n SER 86 Cb 0.26 -0.72 0.04 0.00 -1.01 0.00 0.00 64.21 62.78 1tm9 n SER 86 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1tm9 n PHE 87 N -2.00 1.45 0.00 1.43 7.35 -1.05 -3.87 117.46 120.77 1tm9 n PHE 87 Ca 0.00 -1.90 0.00 0.00 -0.76 0.00 0.00 57.45 54.79 1tm9 n PHE 87 Cb 0.09 -0.92 0.00 0.00 0.35 0.00 0.00 39.48 38.99 1tm9 n PHE 87 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1tm9 n PHE 88 N 0.40 0.00 0.25 -5.13 -0.00 -0.99 -4.71 117.46 107.28 1tm9 n PHE 88 Ca 0.28 0.00 0.08 0.00 -0.00 0.00 0.00 57.45 57.81 1tm9 n PHE 88 Cb 0.58 0.31 0.61 0.00 -0.00 0.00 0.00 39.48 40.98 1tm9 n PHE 88 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1tm9 h SER 89 N 0.00 0.00 0.39 -2.13 0.87 -1.73 -3.04 113.55 107.91 1tm9 h SER 89 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1tm9 h SER 89 Cb 0.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1tm9 h SER 89 CO 0.00 0.07 -0.19 0.71 -0.53 0.00 0.00 176.83 176.89 1tm9 h THR 90 N 0.00 0.00 -3.18 2.23 1.35 -1.88 -3.43 112.91 108.00 1tm9 h THR 90 Ca -0.00 -0.10 -0.67 0.00 -0.55 0.00 0.00 66.41 65.09 1tm9 h THR 90 Cb 0.12 0.00 -0.34 0.00 -1.73 0.00 0.00 68.15 66.20 1tm9 h THR 90 CO 0.01 0.00 -0.86 0.20 -0.25 0.00 0.00 175.52 174.62 1tm9 s ASN 91 N -3.21 3.19 -0.08 5.36 -0.87 -1.15 -5.00 114.94 113.18 1tm9 s ASN 91 Ca -0.08 -0.60 -0.18 0.00 -1.57 0.00 0.00 52.86 50.44 1tm9 s ASN 91 Cb 0.01 -1.47 -0.29 0.00 -0.02 0.00 0.00 41.25 39.48 1tm9 s ASN 91 CO 0.23 0.06 0.67 0.28 -2.57 0.00 0.00 177.10 175.77 1tm9 h SER 92 N 7.47 0.42 -0.86 -1.22 0.02 -1.84 -2.90 113.55 114.64 1tm9 h SER 92 Ca -0.36 -0.88 0.14 0.00 -0.84 0.00 0.00 61.79 59.86 1tm9 h SER 92 Cb 1.18 -0.14 -0.14 0.00 0.14 0.00 0.00 62.40 63.44 1tm9 h SER 92 CO 0.58 1.56 -0.31 -0.62 -1.14 0.00 0.00 176.83 176.89 1tm9 n GLU 93 N -3.98 -0.17 -0.03 3.45 1.02 -1.26 0.12 120.64 119.78 1tm9 n GLU 93 Ca -0.22 1.33 -0.14 0.00 -0.02 0.00 0.00 57.16 58.11 1tm9 n GLU 93 Cb 0.88 -1.97 -0.11 0.00 -0.02 0.00 0.00 31.44 30.22 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 0.13 -0.54 3.49 0.13 -1.96 -2.83 132.00 130.41 1tm9 h PRO 94 Ca 0.33 -0.12 0.16 0.00 -0.87 0.00 0.00 66.00 65.49 1tm9 h PRO 94 Cb 0.54 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.68 1tm9 h PRO 94 CO -0.86 0.84 0.64 0.00 -0.23 0.00 0.00 178.00 178.40 1tm9 h ALA 95 N 0.29 2.29 0.08 -0.56 0.00 -0.60 1.37 119.26 122.11 1tm9 h ALA 95 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1tm9 h ALA 95 Cb 0.89 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1tm9 h ALA 95 CO 0.03 -0.92 -0.04 0.82 0.00 0.00 0.00 179.25 179.14 1tm9 h ILE 96 N 0.00 0.14 -0.03 0.00 5.03 0.96 -1.09 117.51 122.52 1tm9 h ILE 96 Ca 0.26 -1.02 0.01 0.00 -0.12 0.00 0.00 64.86 63.99 1tm9 h ILE 96 Cb 1.54 0.26 -0.00 0.00 -3.03 0.00 0.00 36.82 35.59 1tm9 h ILE 96 CO -0.00 0.04 0.03 0.40 -0.68 0.00 0.00 178.15 177.94 1tm9 h ILE 97 N -1.02 0.61 0.01 -0.67 5.03 -0.72 0.33 117.51 121.08 1tm9 h ILE 97 Ca -0.01 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.73 1tm9 h ILE 97 Cb 0.15 0.98 0.00 0.00 -3.03 0.00 0.00 36.82 34.92 1tm9 h ILE 97 CO 0.02 0.00 -0.00 0.15 -0.68 0.00 0.00 178.15 177.63 1tm9 h PHE 98 N 0.00 -0.01 0.75 1.37 3.04 0.17 -2.57 116.94 119.68 1tm9 h PHE 98 Ca 0.01 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.93 1tm9 h PHE 98 Cb 0.07 0.00 0.01 0.00 2.56 0.00 0.00 35.95 38.60 1tm9 h PHE 98 CO 0.00 0.72 -0.36 0.00 -2.02 0.00 0.00 178.31 176.65 1tm9 h VAL 100 N -1.21 0.01 0.51 0.00 2.07 -0.52 0.34 116.25 117.45 1tm9 h VAL 100 Ca -0.10 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 1tm9 h VAL 100 Cb 0.77 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1tm9 h VAL 100 CO 0.17 0.00 -0.25 0.40 0.02 0.00 0.00 177.57 177.91 1tm9 h ILE 101 N -0.00 0.00 -0.85 4.57 1.08 -1.34 0.25 117.51 121.22 1tm9 h ILE 101 Ca 0.46 -0.05 0.08 0.00 -0.39 0.00 0.00 64.86 64.96 1tm9 h ILE 101 Cb 0.71 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.35 1tm9 h ILE 101 CO -1.01 0.00 -0.50 -1.22 -0.69 0.00 0.00 178.15 174.73 1tm9 n TYR 102 N -3.99 -0.36 0.38 1.37 4.02 0.95 -1.36 117.16 118.16 1tm9 n TYR 102 Ca -0.09 1.06 -0.16 0.00 -0.01 0.00 0.00 57.90 58.71 1tm9 n TYR 102 Cb 0.27 -0.57 -0.08 0.00 -0.02 0.00 0.00 39.34 38.94 1tm9 n TYR 102 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 1tm9 h PHE 103 N 0.00 -1.01 -0.18 -0.72 0.04 -0.43 -2.87 116.94 111.77 1tm9 h PHE 103 Ca 0.14 -0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.93 1tm9 h PHE 103 Cb 0.35 0.35 -0.03 0.00 2.20 0.00 0.00 35.95 38.82 1tm9 h PHE 103 CO -0.87 -0.60 -0.06 1.28 -0.60 0.00 0.00 178.31 177.46 1tm9 n LEU 104 N -4.85 -0.09 0.23 1.54 4.77 0.87 0.28 117.00 119.76 1tm9 n LEU 104 Ca -0.12 0.31 -0.09 0.00 -0.03 0.00 0.00 56.01 56.08 1tm9 n LEU 104 Cb 0.41 -0.08 -0.04 0.00 -2.33 0.00 0.00 43.42 41.37 1tm9 n LEU 104 CO 0.30 -0.29 0.46 1.88 -1.33 0.00 0.00 177.39 178.41 1tm9 h TYR 105 N 0.00 -0.56 -1.89 -1.77 0.05 -1.22 1.49 116.97 113.07 1tm9 h TYR 105 Ca 0.08 -0.01 -0.76 0.00 0.05 0.00 0.00 58.73 58.09 1tm9 h TYR 105 Cb 0.12 0.18 -0.28 0.00 1.01 0.00 0.00 36.73 37.77 1tm9 h TYR 105 CO -0.15 -0.35 0.99 0.72 -1.05 0.00 0.00 178.16 178.32 1tm9 n HIS 106 N -3.77 3.02 0.08 4.88 8.25 0.49 -4.41 115.22 123.75 1tm9 n HIS 106 Ca -0.07 -2.41 0.00 0.00 -0.26 0.00 0.00 57.72 54.98 1tm9 n HIS 106 Cb 0.24 -1.17 0.00 0.00 1.12 0.00 0.00 29.99 30.17 1tm9 n HIS 106 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1tm9 n PHE 107 N -0.57 -2.98 0.00 4.41 7.35 0.79 -4.80 117.46 121.66 1tm9 n PHE 107 Ca 0.54 0.52 0.00 0.00 -0.76 0.00 0.00 57.45 57.76 1tm9 n PHE 107 Cb 0.28 1.59 0.00 0.00 0.35 0.00 0.00 39.48 41.71 1tm9 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1tm9 n GLY 108 N -1.23 1.56 2.72 7.13 0.00 0.48 -4.81 105.19 111.04 1tm9 n GLY 108 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.34 -3.86 1.61 3.72 0.48 -4.86 117.46 112.22 1tm9 n PHE 109 Ca 0.00 -1.48 -0.37 0.00 -0.05 0.00 0.00 57.45 55.55 1tm9 n PHE 109 Cb 0.00 1.43 -0.06 0.00 -0.94 0.00 0.00 39.48 39.91 1tm9 n PHE 109 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1tm9 s LEU 110 N -0.90 4.36 -0.18 4.37 1.43 -0.57 -4.85 118.68 122.33 1tm9 s LEU 110 Ca 0.28 0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 53.80 1tm9 s LEU 110 Cb 0.24 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.40 1tm9 s LEU 110 CO -0.17 0.38 -0.14 -0.54 0.23 0.00 0.00 176.35 176.10 1tm9 s LYS 111 N -0.82 3.16 -0.37 1.70 -0.14 -1.26 -4.61 119.74 117.39 1tm9 s LYS 111 Ca 0.14 -0.75 0.05 0.00 -1.36 0.00 0.00 55.97 54.05 1tm9 s LYS 111 Cb -0.12 -2.71 0.31 0.00 -1.68 0.00 0.00 37.83 33.63 1tm9 s LYS 111 CO 0.03 -0.15 1.28 -3.47 -0.76 0.00 0.00 175.35 172.28 1tm9 n ASP 112 N 4.53 -1.62 -3.42 2.83 -0.08 -1.26 -4.86 116.55 112.68 1tm9 n ASP 112 Ca -0.20 -2.47 -0.20 0.00 -1.51 0.00 0.00 54.79 50.41 1tm9 n ASP 112 Cb 0.51 1.39 -0.10 0.00 2.34 0.00 0.00 41.12 45.25 1tm9 n ASP 112 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1tm9 s ASN 113 N -0.60 1.96 -0.10 1.67 4.22 -1.26 -4.29 114.94 116.53 1tm9 s ASN 113 Ca 0.19 -1.22 0.07 0.00 -2.14 0.00 0.00 52.86 49.77 1tm9 s ASN 113 Cb 0.28 0.30 0.17 0.00 1.28 0.00 0.00 41.25 43.28 1tm9 s ASN 113 CO -0.13 -0.35 1.17 -3.20 -2.04 0.00 0.00 177.10 172.55 1tm9 n ASN 114 N 4.87 -0.82 -3.60 3.54 5.15 -1.26 -5.12 115.26 118.02 1tm9 n ASN 114 Ca 0.02 -2.06 -0.08 0.00 -0.60 0.00 0.00 54.58 51.87 1tm9 n ASN 114 Cb 0.44 0.31 -0.05 0.00 -0.53 0.00 0.00 39.78 39.96 1tm9 n ASN 114 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1tm9 s LYS 115 N -0.13 0.42 0.13 1.20 2.20 -1.26 -5.13 119.74 117.17 1tm9 s LYS 115 Ca 0.07 0.12 -0.34 0.00 -0.36 0.00 0.00 55.97 55.46 1tm9 s LYS 115 Cb 0.17 0.20 -0.14 0.00 -1.51 0.00 0.00 37.83 36.55 1tm9 s LYS 115 CO -0.05 -0.13 1.57 1.63 -0.36 0.00 0.00 175.35 178.01 1tm9 n LYS 116 N 0.75 1.99 -2.73 4.03 5.02 -1.26 -3.88 118.16 122.08 1tm9 n LYS 116 Ca -0.07 0.72 -0.04 0.00 -2.02 0.00 0.00 58.31 56.89 1tm9 n LYS 116 Cb 0.58 -2.47 -0.04 0.00 -0.02 0.00 0.00 35.03 33.08 1tm9 n LYS 116 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1tm9 n GLN 117 N 3.54 -3.71 -2.60 1.97 6.02 -1.26 -5.05 117.38 116.28 1tm9 n GLN 117 Ca 0.18 2.86 -0.07 0.00 -0.01 0.00 0.00 57.00 59.96 1tm9 n GLN 117 Cb 0.27 -3.89 -0.02 0.00 1.02 0.00 0.00 30.24 27.63 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 1.96 0.00 -0.09 5.09 0.13 -1.25 -4.97 119.36 120.24 1tm9 n ILE 118 Ca -0.31 -0.55 -0.07 0.00 -1.10 0.00 0.00 62.75 60.72 1tm9 n ILE 118 Cb 0.48 0.13 -0.05 0.00 -0.84 0.00 0.00 39.64 39.36 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 1.08 0.00 -0.77 9.51 1.08 -1.95 0.50 117.51 126.96 1tm9 h ILE 119 Ca -0.09 0.00 0.31 0.00 -0.39 0.00 0.00 64.86 64.69 1tm9 h ILE 119 Cb 0.29 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 33.90 1tm9 h ILE 119 CO 0.15 0.00 0.38 1.17 -0.69 0.00 0.00 178.15 179.16 1tm9 n LYS 120 N -4.10 -0.05 0.36 2.37 4.81 -1.26 0.19 118.16 120.48 1tm9 n LYS 120 Ca -0.02 1.07 -0.19 0.00 -0.87 0.00 0.00 58.31 58.31 1tm9 n LYS 120 Cb 0.17 -1.91 -0.09 0.00 0.02 0.00 0.00 35.03 33.22 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 -1.02 0.12 1.64 3.11 -0.38 0.30 116.57 120.34 1tm9 h LYS 121 Ca 0.64 0.07 -0.00 0.00 -2.81 0.00 0.00 60.65 58.55 1tm9 h LYS 121 Cb 1.67 0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 33.12 1tm9 h LYS 121 CO -0.61 -0.68 -0.16 0.00 -2.81 0.00 0.00 179.45 175.19 1tm9 h ALA 122 N -0.89 -0.81 -0.75 5.00 0.00 0.25 1.07 119.26 123.13 1tm9 h ALA 122 Ca -0.08 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.00 1tm9 h ALA 122 Cb 0.88 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1tm9 h ALA 122 CO 0.03 -0.83 0.88 1.88 0.00 0.00 0.00 179.25 181.21 1tm9 h TYR 123 N -0.29 0.00 0.11 0.00 0.05 -1.13 1.50 116.97 117.21 1tm9 h TYR 123 Ca -0.01 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.45 1tm9 h TYR 123 Cb 0.27 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.99 1tm9 h TYR 123 CO -0.21 0.00 -1.63 0.93 -1.05 0.00 0.00 178.16 176.20 1tm9 h GLU 124 N 0.00 0.23 0.00 4.88 5.08 0.16 -1.33 114.58 123.60 1tm9 h GLU 124 Ca 0.36 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1tm9 h GLU 124 Cb 2.12 0.14 0.00 0.00 0.50 0.00 0.00 28.75 31.52 1tm9 h GLU 124 CO -0.00 1.06 0.00 0.00 -1.00 0.00 0.00 179.01 179.07 1tm9 h THR 125 N 0.06 0.00 0.00 1.13 1.03 1.04 -1.26 112.91 114.91 1tm9 h THR 125 Ca -0.28 -0.37 -0.23 0.00 -0.01 0.00 0.00 66.41 65.52 1tm9 h THR 125 Cb 2.02 1.34 -0.03 0.00 -1.07 0.00 0.00 68.15 70.41 1tm9 h THR 125 CO 0.14 0.00 -1.62 -0.38 -0.01 0.00 0.00 175.52 173.65 1tm9 n ILE 126 N -3.01 1.51 0.03 0.00 5.41 -0.24 -2.32 119.36 120.73 1tm9 n ILE 126 Ca -0.00 -0.09 0.22 0.00 1.00 0.00 0.00 62.75 63.88 1tm9 n ILE 126 Cb 0.24 -2.11 0.71 0.00 -0.71 0.00 0.00 39.64 37.77 1tm9 n ILE 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1tm9 h ALA 127 N -0.92 2.28 0.00 -1.39 0.00 -1.23 1.56 119.26 119.56 1tm9 h ALA 127 Ca -0.35 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1tm9 h ALA 127 Cb 1.24 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1tm9 h ALA 127 CO -0.21 -0.84 -0.59 -3.47 0.00 0.00 0.00 179.25 174.14 1tm9 n ASP 128 N -3.67 1.82 -0.33 0.00 -0.08 -0.48 -3.44 116.55 110.36 1tm9 n ASP 128 Ca 0.10 0.61 0.17 0.00 -1.51 0.00 0.00 54.79 54.16 1tm9 n ASP 128 Cb 0.77 -0.87 0.41 0.00 2.34 0.00 0.00 41.12 43.76 1tm9 n ASP 128 CO 0.00 0.00 0.00 -1.13 0.12 0.00 0.00 177.20 176.19 1tm9 h ASN 129 N -1.00 0.63 0.37 1.67 -0.73 -0.95 1.53 115.58 117.10 1tm9 h ASN 129 Ca -0.03 0.10 -0.05 0.00 1.87 0.00 0.00 56.30 58.19 1tm9 h ASN 129 Cb 0.59 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.16 1tm9 h ASN 129 CO -0.02 0.17 -0.24 -0.29 -0.37 0.00 0.00 177.43 176.69 1tm9 h ILE 130 N 0.59 0.95 -0.07 2.57 2.10 0.20 0.39 117.51 124.24 1tm9 h ILE 130 Ca 0.59 -0.88 0.00 0.00 1.08 0.00 0.00 64.86 65.65 1tm9 h ILE 130 Cb 1.16 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 38.40 1tm9 h ILE 130 CO -0.36 0.23 0.00 0.00 -1.08 0.00 0.00 178.15 176.94 1tm9 n ALA 131 N -2.40 2.56 0.04 0.18 0.00 0.52 -2.98 120.51 118.43 1tm9 n ALA 131 Ca -0.02 -0.24 0.01 0.00 0.00 0.00 0.00 53.44 53.19 1tm9 n ALA 131 Cb 0.32 -1.17 -0.07 0.00 0.00 0.00 0.00 19.45 18.53 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 0.74 0.00 0.00 0.00 3.58 -0.30 -3.34 116.42 117.10 1tm9 h ASP 132 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1tm9 h ASP 132 Cb 0.16 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.21 1tm9 h ASP 132 CO 0.00 0.51 -1.11 0.00 -2.88 0.00 0.00 179.24 175.76 1tm9 n TYR 133 N -2.88 0.00 0.00 0.28 0.18 -1.16 -4.67 117.16 108.92 1tm9 n TYR 133 Ca -0.08 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.70 1tm9 n TYR 133 Cb 0.80 -0.08 0.00 0.00 -0.38 0.00 0.00 39.34 39.68 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 -1.60 0.00 -2.36 -3.48 4.77 -1.18 -4.99 117.00 108.17 1tm9 n LEU 134 Ca 0.02 0.38 -0.02 0.00 -0.03 0.00 0.00 56.01 56.36 1tm9 n LEU 134 Cb 0.35 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1tm9 n LEU 134 CO 0.41 0.00 -0.17 0.59 -1.33 0.00 0.00 177.39 176.89 1tm9 n ASN 135 N -0.43 -6.05 0.00 -1.43 3.02 -1.26 -5.04 115.26 104.06 1tm9 n ASN 135 Ca 0.00 0.69 0.00 0.00 -0.03 0.00 0.00 54.58 55.24 1tm9 n ASN 135 Cb 0.00 -3.95 0.00 0.00 -0.61 0.00 0.00 39.78 35.22 1tm9 n ASN 135 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1tm9 n GLU 136 N 0.09 0.00 -0.39 3.52 0.00 -1.26 -5.21 120.64 117.39 1tm9 n GLU 136 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.20 1tm9 n GLU 136 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.58 1tm9 n GLU 136 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42