#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tm9 n GLU 2 N 0.00 0.00 -0.97 0.03 4.07 -1.26 -4.91 120.64 117.60 1tm9 n GLU 2 Ca 0.00 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.76 1tm9 n GLU 2 Cb 0.00 0.00 0.03 0.00 -0.06 0.00 0.00 31.44 31.41 1tm9 n GLU 2 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1tm9 n GLN 3 N 0.00 0.00 0.00 5.31 -0.06 -1.26 -0.64 117.38 120.73 1tm9 n GLN 3 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1tm9 n GLN 3 Cb 0.00 -0.93 0.00 0.00 -4.06 0.00 0.00 30.24 25.25 1tm9 n GLN 3 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 1tm9 n ASN 4 N 3.06 0.00 -0.65 1.69 2.85 -1.26 -4.31 115.26 116.63 1tm9 n ASN 4 Ca -0.00 0.00 0.50 0.00 -0.11 0.00 0.00 54.58 54.97 1tm9 n ASN 4 Cb 0.50 0.00 0.77 0.00 1.24 0.00 0.00 39.78 42.29 1tm9 n ASN 4 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1tm9 n ASN 5 N -1.10 0.03 0.00 1.20 4.13 -1.26 -1.07 115.26 117.19 1tm9 n ASN 5 Ca 0.00 1.02 0.00 0.00 1.68 0.00 0.00 54.58 57.28 1tm9 n ASN 5 Cb 0.00 -0.51 0.00 0.00 -1.54 0.00 0.00 39.78 37.73 1tm9 n ASN 5 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1tm9 n ILE 6 N -3.98 0.00 -0.04 2.41 -0.00 -1.26 0.11 119.36 116.60 1tm9 n ILE 6 Ca 0.42 1.35 -0.01 0.00 -0.00 0.00 0.00 62.75 64.52 1tm9 n ILE 6 Cb 1.88 -1.87 -0.01 0.00 -0.00 0.00 0.00 39.64 39.64 1tm9 n ILE 6 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1tm9 n LYS 7 N -2.40 -0.04 -0.28 0.38 3.00 0.19 0.22 118.16 119.24 1tm9 n LYS 7 Ca 0.00 0.68 0.08 0.00 -0.00 0.00 0.00 58.31 59.07 1tm9 n LYS 7 Cb 0.00 -1.02 0.21 0.00 0.00 0.00 0.00 35.03 34.22 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 0.14 -0.77 1.64 4.22 -1.44 0.65 114.58 119.01 1tm9 h GLU 8 Ca 0.01 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.44 1tm9 h GLU 8 Cb 0.03 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1tm9 h GLU 8 CO -0.08 0.09 0.45 1.96 -2.18 0.00 0.00 179.01 179.25 1tm9 h GLN 9 N 0.14 1.06 0.22 1.92 4.20 0.99 -2.77 115.11 120.88 1tm9 h GLN 9 Ca 0.47 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 59.06 1tm9 h GLN 9 Cb 0.87 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1tm9 h GLN 9 CO -0.67 0.77 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.08 1tm9 h LEU 10 N 1.06 -0.25 -0.94 1.46 3.38 0.72 -2.66 115.31 118.09 1tm9 h LEU 10 Ca 0.28 -0.09 0.16 0.00 0.09 0.00 0.00 57.88 58.32 1tm9 h LEU 10 Cb -0.01 0.06 -0.16 0.00 0.09 0.00 0.00 40.66 40.64 1tm9 h LEU 10 CO -0.05 -0.06 -0.31 -0.38 0.09 0.00 0.00 178.44 177.73 1tm9 n ILE 11 N -5.16 -0.45 0.20 1.22 -0.00 0.12 -0.25 119.36 115.03 1tm9 n ILE 11 Ca -0.09 2.19 -0.14 0.00 -0.00 0.00 0.00 62.75 64.71 1tm9 n ILE 11 Cb 0.18 -2.95 -0.08 0.00 -0.00 0.00 0.00 39.64 36.80 1tm9 n ILE 11 CO 0.00 0.00 0.00 -1.28 -0.00 0.00 0.00 176.55 175.27 1tm9 h SER 12 N 0.00 -1.11 0.00 4.38 0.87 -1.28 -0.86 113.55 115.55 1tm9 h SER 12 Ca 0.38 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 61.04 1tm9 h SER 12 Cb 0.62 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 1tm9 h SER 12 CO -0.95 -0.50 0.00 0.49 -0.53 0.00 0.00 176.83 175.34 1tm9 n PHE 13 N -4.78 0.00 -0.17 2.24 3.01 0.65 0.13 117.46 118.54 1tm9 n PHE 13 Ca -0.09 0.00 0.29 0.00 1.01 0.00 0.00 57.45 58.66 1tm9 n PHE 13 Cb 0.35 -0.30 0.61 0.00 -0.01 0.00 0.00 39.48 40.13 1tm9 n PHE 13 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 1tm9 h PHE 14 N 0.00 0.00 -0.45 1.38 3.57 -1.24 1.67 116.94 121.87 1tm9 h PHE 14 Ca 0.00 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.36 1tm9 h PHE 14 Cb 0.00 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1tm9 h PHE 14 CO -0.56 0.00 -0.26 -0.97 -2.23 0.00 0.00 178.31 174.29 1tm9 h ASN 15 N 0.00 1.00 0.76 0.41 -1.24 0.26 -2.10 115.58 114.66 1tm9 h ASN 15 Ca 0.44 -0.42 0.00 0.00 0.71 0.00 0.00 56.30 57.04 1tm9 h ASN 15 Cb 2.34 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 41.11 1tm9 h ASN 15 CO -0.00 1.20 0.00 0.00 -1.29 0.00 0.00 177.43 177.34 1tm9 n GLN 16 N -4.11 0.15 0.00 6.67 10.64 0.57 -3.66 117.38 127.64 1tm9 n GLN 16 Ca -0.01 0.35 0.00 0.00 -1.83 0.00 0.00 57.00 55.51 1tm9 n GLN 16 Cb 0.48 -1.77 0.00 0.00 -0.86 0.00 0.00 30.24 28.09 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 -1.71 0.00 -0.61 2.61 0.00 -0.83 -4.91 120.51 115.06 1tm9 n ALA 17 Ca 0.03 -0.01 -0.28 0.00 0.00 0.00 0.00 53.44 53.18 1tm9 n ALA 17 Cb 0.24 0.00 0.17 0.00 0.00 0.00 0.00 19.45 19.86 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 -1.64 0.00 -1.20 0.00 7.64 -1.26 -4.94 113.62 112.23 1tm9 n SER 19 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1tm9 n SER 19 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 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 -0.48 0.00 -0.08 0.44 -2.24 -1.26 -5.05 114.28 105.61 1tm9 n THR 20 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 1tm9 n THR 20 Cb 0.00 -1.30 -0.07 0.00 -2.10 0.00 0.00 70.33 66.86 1tm9 n THR 20 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1tm9 h HIS 21 N -0.08 0.00 -1.31 4.78 -0.00 -2.03 -3.36 115.15 113.15 1tm9 h HIS 21 Ca 0.00 0.00 0.41 0.00 -0.00 0.00 0.00 60.37 60.78 1tm9 h HIS 21 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 27.41 27.30 1tm9 h HIS 21 CO 0.00 0.75 0.86 1.96 -0.00 0.00 0.00 177.93 181.50 1tm9 h GLN 22 N -1.00 0.12 -0.96 2.45 4.20 -2.00 0.43 115.11 118.35 1tm9 h GLN 22 Ca -0.16 -0.01 0.30 0.00 0.06 0.00 0.00 58.65 58.84 1tm9 h GLN 22 Cb 0.87 -0.03 -0.17 0.00 0.30 0.00 0.00 27.48 28.46 1tm9 h GLN 22 CO -0.10 0.08 0.25 0.93 -0.67 0.00 0.00 178.83 179.32 1tm9 h GLU 23 N 0.13 0.09 -0.12 1.46 4.39 -1.98 0.47 114.58 119.02 1tm9 h GLU 23 Ca 0.77 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 60.51 1tm9 h GLU 23 Cb 2.45 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 31.02 1tm9 h GLU 23 CO -0.34 0.06 -0.28 0.00 -1.16 0.00 0.00 179.01 177.29 1tm9 h ARG 24 N 0.09 -0.35 0.00 2.33 3.08 -0.37 0.59 114.38 119.76 1tm9 h ARG 24 Ca 0.65 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.73 1tm9 h ARG 24 Cb 1.46 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.59 1tm9 h ARG 24 CO -0.78 -0.23 0.00 -0.07 -1.07 0.00 0.00 179.97 177.82 1tm9 h LEU 25 N -0.36 0.00 0.00 3.04 3.38 -0.28 0.15 115.31 121.24 1tm9 h LEU 25 Ca 0.10 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 1tm9 h LEU 25 Cb 0.51 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1tm9 h LEU 25 CO -0.33 0.00 -0.89 -0.78 0.09 0.00 0.00 178.44 176.53 1tm9 h ASP 26 N 0.00 0.00 0.21 -0.43 1.82 0.17 -3.31 116.42 114.88 1tm9 h ASP 26 Ca 0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.63 1tm9 h ASP 26 Cb 0.13 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.14 1tm9 h ASP 26 CO 0.00 0.74 -0.10 -0.26 -1.61 0.00 0.00 179.24 178.01 1tm9 h PHE 27 N 0.00 -0.26 -1.75 0.28 -1.00 0.22 1.03 116.94 115.47 1tm9 h PHE 27 Ca -0.05 -0.01 0.52 0.00 2.81 0.00 0.00 57.97 61.25 1tm9 h PHE 27 Cb 1.60 0.09 -0.08 0.00 3.61 0.00 0.00 35.95 41.17 1tm9 h PHE 27 CO 0.00 -0.16 1.24 0.44 -1.61 0.00 0.00 178.31 178.22 1tm9 n ILE 28 N -3.81 -0.04 -0.10 -0.55 -5.35 -0.99 0.23 119.36 108.76 1tm9 n ILE 28 Ca -0.03 1.42 -0.19 0.00 -0.27 0.00 0.00 62.75 63.68 1tm9 n ILE 28 Cb 0.11 -2.36 -0.09 0.00 -1.74 0.00 0.00 39.64 35.56 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 -1.00 -0.96 -0.91 0.00 0.87 0.94 -0.34 113.55 112.15 1tm9 h SER 30 Ca -0.29 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 60.41 1tm9 h SER 30 Cb 1.15 0.28 -0.11 0.00 -0.44 0.00 0.00 62.40 63.29 1tm9 h SER 30 CO -0.18 -0.57 -0.54 0.41 -0.53 0.00 0.00 176.83 175.43 1tm9 n THR 31 N -4.75 -0.62 -0.25 2.23 -1.04 0.64 0.21 114.28 110.70 1tm9 n THR 31 Ca -0.11 2.25 0.15 0.00 -2.04 0.00 0.00 64.05 64.29 1tm9 n THR 31 Cb 0.38 -2.78 0.43 0.00 -1.82 0.00 0.00 70.33 66.54 1tm9 n THR 31 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1tm9 h ARG 32 N 0.00 0.55 -1.04 -2.82 9.65 -1.62 0.34 114.38 119.45 1tm9 h ARG 32 Ca 0.15 -0.03 -0.52 0.00 -1.10 0.00 0.00 59.98 58.48 1tm9 h ARG 32 Cb 0.37 -0.12 -0.27 0.00 -1.39 0.00 0.00 29.97 28.56 1tm9 h ARG 32 CO -0.86 0.37 0.66 0.39 2.80 0.00 0.00 179.97 183.33 1tm9 n GLU 33 N -4.54 2.26 -3.04 0.20 -0.58 0.55 -4.59 120.64 110.89 1tm9 n GLU 33 Ca 0.18 -2.78 -0.09 0.00 -0.42 0.00 0.00 57.16 54.04 1tm9 n GLU 33 Cb 0.55 -2.09 -0.03 0.00 -0.57 0.00 0.00 31.44 29.30 1tm9 n GLU 33 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1tm9 s SER 34 N -1.19 -0.57 0.58 1.62 0.01 0.12 -4.91 113.70 109.36 1tm9 s SER 34 Ca 0.54 -1.81 0.30 0.00 1.31 0.00 0.00 55.95 56.29 1tm9 s SER 34 Cb 0.44 1.29 1.43 0.00 0.21 0.00 0.00 66.02 69.39 1tm9 s SER 34 CO 0.06 -0.12 1.81 0.44 0.41 0.00 0.00 173.24 175.84 1tm9 h ASP 35 N 5.74 0.00 -3.39 2.44 5.19 -1.81 -3.40 116.42 121.19 1tm9 h ASP 35 Ca 0.10 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 1tm9 h ASP 35 Cb 1.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.59 1tm9 h ASP 35 CO 0.12 0.00 0.00 1.07 -3.12 0.00 0.00 179.24 177.31 1tm9 n THR 36 N -3.83 0.00 -0.25 0.35 5.66 -1.26 -4.85 114.28 110.10 1tm9 n THR 36 Ca 0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.15 1tm9 n THR 36 Cb 0.92 -1.25 0.00 0.00 -1.55 0.00 0.00 70.33 68.45 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 -1.17 0.00 1.03 1.09 3.72 -1.26 -4.62 117.46 116.25 1tm9 n PHE 37 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 1tm9 n PHE 37 Cb 0.00 0.00 0.11 0.00 -0.94 0.00 0.00 39.48 38.65 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 -0.08 2.81 0.01 4.37 2.88 -1.26 -3.97 113.62 118.37 1tm9 n SER 38 Ca 0.00 -1.92 0.11 0.00 -1.33 0.00 0.00 58.87 55.73 1tm9 n SER 38 Cb 0.06 0.05 -0.06 0.00 -0.75 0.00 0.00 64.21 63.51 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 1.14 0.62 -4.81 -3.46 7.64 -1.26 -4.94 113.62 108.53 1tm9 n SER 39 Ca 0.14 -0.46 -0.31 0.00 1.01 0.00 0.00 58.87 59.25 1tm9 n SER 39 Cb 0.57 1.11 0.06 0.00 -1.01 0.00 0.00 64.21 64.94 1tm9 n SER 39 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1tm9 s VAL 40 N -3.18 3.86 -0.03 0.44 1.01 -1.25 -4.99 120.40 116.25 1tm9 s VAL 40 Ca 0.03 0.60 -0.23 0.00 0.00 0.00 0.00 61.98 62.38 1tm9 s VAL 40 Cb 0.15 -3.33 -0.17 0.00 0.00 0.00 0.00 36.38 33.03 1tm9 s VAL 40 CO 0.85 -0.79 1.06 -0.78 0.00 0.00 0.00 175.10 175.44 1tm9 h ASP 41 N -0.79 -0.21 -1.21 3.32 1.82 -1.92 -3.45 116.42 113.98 1tm9 h ASP 41 Ca -0.44 -0.32 -0.67 0.00 -0.39 0.00 0.00 57.03 55.21 1tm9 h ASP 41 Cb 1.22 0.05 0.10 0.00 0.68 0.00 0.00 39.33 41.39 1tm9 h ASP 41 CO 0.57 0.27 -0.36 0.55 -1.61 0.00 0.00 179.24 178.66 1tm9 n VAL 42 N -4.98 1.73 -2.54 2.25 3.14 -1.26 -4.88 118.33 111.79 1tm9 n VAL 42 Ca -0.08 -0.43 -0.35 0.00 -2.96 0.00 0.00 64.34 60.51 1tm9 n VAL 42 Cb 0.26 -0.15 -0.04 0.00 -1.06 0.00 0.00 33.84 32.86 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 -0.93 3.93 0.01 1.45 0.04 -1.26 -4.98 135.00 133.27 1tm9 s PRO 43 Ca 0.67 1.42 -0.13 0.00 0.04 0.00 0.00 61.00 62.99 1tm9 s PRO 43 Cb -0.94 -2.26 -0.34 0.00 0.04 0.00 0.00 34.50 31.01 1tm9 s PRO 43 CO 0.56 -0.33 0.90 -0.07 0.04 0.00 0.00 177.00 178.10 1tm9 h LEU 44 N 1.91 0.75 -0.82 -3.56 3.38 -1.90 -2.89 115.31 112.17 1tm9 h LEU 44 Ca -0.49 -0.89 0.10 0.00 0.09 0.00 0.00 57.88 56.69 1tm9 h LEU 44 Cb 1.22 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 41.61 1tm9 h LEU 44 CO 0.60 1.72 -0.40 -0.62 0.09 0.00 0.00 178.44 179.82 1tm9 n GLU 45 N -3.66 -0.28 -0.01 1.13 1.02 -1.26 0.22 120.64 117.80 1tm9 n GLU 45 Ca -0.19 1.25 -0.11 0.00 -0.02 0.00 0.00 57.16 58.08 1tm9 n GLU 45 Cb 1.09 -1.84 -0.09 0.00 -0.02 0.00 0.00 31.44 30.58 1tm9 n GLU 45 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1tm9 h PRO 46 N 0.00 -0.08 -0.65 3.49 0.13 -1.94 -3.31 132.00 129.64 1tm9 h PRO 46 Ca 0.21 0.01 0.11 0.00 -0.87 0.00 0.00 66.00 65.45 1tm9 h PRO 46 Cb 0.41 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 31.44 1tm9 h PRO 46 CO -0.79 0.51 -0.37 0.82 -0.23 0.00 0.00 178.00 177.94 1tm9 h ILE 47 N -0.83 0.12 -1.01 -3.56 1.08 -0.99 1.92 117.51 114.23 1tm9 h ILE 47 Ca -0.01 0.00 0.29 0.00 -0.39 0.00 0.00 64.86 64.76 1tm9 h ILE 47 Cb 0.63 0.12 -0.04 0.00 -3.07 0.00 0.00 36.82 34.46 1tm9 h ILE 47 CO 0.01 0.00 1.00 0.11 -0.69 0.00 0.00 178.15 178.58 1tm9 h LYS 48 N -0.16 0.00 -0.01 2.37 1.57 0.25 1.93 116.57 122.53 1tm9 h LYS 48 Ca 0.23 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.88 1tm9 h LYS 48 Cb 0.56 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.88 1tm9 h LYS 48 CO -0.73 0.00 -0.53 -0.97 -0.57 0.00 0.00 179.45 176.65 1tm9 h ASN 49 N 0.00 0.48 0.00 0.86 -0.73 0.29 -2.96 115.58 113.53 1tm9 h ASN 49 Ca 0.48 -0.76 0.00 0.00 1.87 0.00 0.00 56.30 57.90 1tm9 h ASN 49 Cb 2.47 -0.15 0.00 0.00 0.27 0.00 0.00 38.32 40.92 1tm9 h ASN 49 CO -0.01 1.17 0.00 2.30 -0.37 0.00 0.00 177.43 180.53 1tm9 n ILE 50 N -4.27 0.00 -0.02 2.57 -5.35 0.61 -2.63 119.36 110.28 1tm9 n ILE 50 Ca -0.10 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.28 1tm9 n ILE 50 Cb 0.64 -0.51 -0.14 0.00 -1.74 0.00 0.00 39.64 37.89 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 -0.97 1.63 -0.83 7.28 5.41 0.13 -4.16 119.36 127.86 1tm9 n ILE 51 Ca 0.21 -0.78 -0.08 0.00 1.00 0.00 0.00 62.75 63.09 1tm9 n ILE 51 Cb 0.09 -1.11 -0.11 0.00 -0.71 0.00 0.00 39.64 37.80 1tm9 n ILE 51 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1tm9 n GLU 52 N -3.09 1.65 0.00 0.38 0.28 -1.08 -3.33 120.64 115.45 1tm9 n GLU 52 Ca -0.19 -0.67 0.00 0.00 -0.16 0.00 0.00 57.16 56.15 1tm9 n GLU 52 Cb 1.05 -1.65 0.00 0.00 1.43 0.00 0.00 31.44 32.27 1tm9 n GLU 52 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 1tm9 n ILE 53 N 2.13 0.00 0.97 3.84 0.13 -1.26 -4.76 119.36 120.41 1tm9 n ILE 53 Ca 0.28 0.00 0.03 0.00 -1.10 0.00 0.00 62.75 61.96 1tm9 n ILE 53 Cb 0.77 -0.81 0.11 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 -2.59 0.50 0.25 9.51 -2.24 -1.21 -4.21 114.28 114.30 1tm9 n THR 54 Ca 0.00 -0.36 -0.10 0.00 -2.27 0.00 0.00 64.05 61.32 1tm9 n THR 54 Cb 0.21 -0.02 -0.05 0.00 -2.10 0.00 0.00 70.33 68.37 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 1.37 -0.62 -6.39 -0.78 1.57 -1.86 -3.37 116.57 106.49 1tm9 h LYS 55 Ca 0.00 0.04 -0.63 0.00 -1.87 0.00 0.00 60.65 58.19 1tm9 h LYS 55 Cb 0.53 0.14 0.08 0.00 0.08 0.00 0.00 32.23 33.06 1tm9 h LYS 55 CO 0.05 -0.41 0.33 -3.47 -0.57 0.00 0.00 179.45 175.38 1tm9 n ASP 56 N -3.91 1.63 0.25 0.86 -0.08 -1.26 -4.81 116.55 109.22 1tm9 n ASP 56 Ca -0.08 1.14 0.08 0.00 -1.51 0.00 0.00 54.79 54.43 1tm9 n ASP 56 Cb 0.25 -1.26 0.62 0.00 2.34 0.00 0.00 41.12 43.07 1tm9 n ASP 56 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1tm9 h GLU 57 N 3.45 0.00 0.00 -0.67 4.11 -1.96 0.12 114.58 119.63 1tm9 h GLU 57 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1tm9 h GLU 57 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1tm9 h GLU 57 CO 0.71 0.10 0.00 -0.97 0.07 0.00 0.00 179.01 178.92 1tm9 h ASN 58 N 0.00 0.00 0.13 3.06 -1.24 -1.94 -2.45 115.58 113.14 1tm9 h ASN 58 Ca -0.00 0.00 -0.27 0.00 0.71 0.00 0.00 56.30 56.73 1tm9 h ASN 58 Cb 0.19 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.24 1tm9 h ASN 58 CO 0.01 0.00 -1.37 1.56 -1.29 0.00 0.00 177.43 176.34 1tm9 h GLN 59 N 0.00 0.27 -0.57 6.67 7.50 -1.10 -3.14 115.11 124.74 1tm9 h GLN 59 Ca 0.00 -0.47 0.02 0.00 0.50 0.00 0.00 58.65 58.71 1tm9 h GLN 59 Cb 0.50 0.17 -0.03 0.00 0.05 0.00 0.00 27.48 28.18 1tm9 h GLN 59 CO 0.00 1.22 0.38 1.96 -1.50 0.00 0.00 178.83 180.89 1tm9 h GLN 60 N -0.26 0.68 0.42 1.46 4.20 -1.22 0.45 115.11 120.84 1tm9 h GLN 60 Ca -0.29 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.36 1tm9 h GLN 60 Cb 1.79 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 29.42 1tm9 h GLN 60 CO 0.09 0.45 -0.20 0.82 -0.67 0.00 0.00 178.83 179.32 1tm9 h ILE 61 N 0.70 0.00 -0.72 2.54 2.04 -1.56 -0.77 117.51 119.74 1tm9 h ILE 61 Ca 0.22 -0.17 0.16 0.00 1.00 0.00 0.00 64.86 66.08 1tm9 h ILE 61 Cb 0.03 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.06 1tm9 h ILE 61 CO -0.06 0.00 0.49 1.05 0.00 0.00 0.00 178.15 179.63 1tm9 h GLU 62 N -0.73 0.29 -0.33 2.37 4.11 -1.47 0.74 114.58 119.57 1tm9 h GLU 62 Ca -0.06 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 59.34 1tm9 h GLU 62 Cb 0.43 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1tm9 h GLU 62 CO 0.09 0.19 0.14 0.82 0.07 0.00 0.00 179.01 180.33 1tm9 h ILE 63 N 0.30 1.18 -0.25 -1.06 2.04 0.00 0.12 117.51 119.84 1tm9 h ILE 63 Ca 0.35 -0.54 0.06 0.00 1.00 0.00 0.00 64.86 65.73 1tm9 h ILE 63 Cb 0.95 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 37.87 1tm9 h ILE 63 CO -0.09 0.19 -0.29 0.74 0.00 0.00 0.00 178.15 178.70 1tm9 h THR 64 N 0.39 0.31 -0.40 -0.27 2.02 0.69 0.92 112.91 116.56 1tm9 h THR 64 Ca 0.11 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.24 1tm9 h THR 64 Cb 0.17 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1tm9 h THR 64 CO -0.01 0.00 0.05 0.50 0.37 0.00 0.00 175.52 176.43 1tm9 h LYS 65 N -0.30 0.62 -0.11 6.66 3.11 -1.33 -2.39 116.57 122.82 1tm9 h LYS 65 Ca 0.13 -0.12 -0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1tm9 h LYS 65 Cb 0.51 -0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.65 1tm9 h LYS 65 CO -0.42 0.60 0.05 0.82 -2.81 0.00 0.00 179.45 177.69 1tm9 h ILE 66 N 0.59 1.11 -0.75 2.00 2.04 0.17 -1.15 117.51 121.52 1tm9 h ILE 66 Ca 0.13 -0.32 0.13 0.00 1.00 0.00 0.00 64.86 65.80 1tm9 h ILE 66 Cb 0.30 1.13 -0.09 0.00 -0.74 0.00 0.00 36.82 37.42 1tm9 h ILE 66 CO 0.00 0.10 0.32 0.00 0.00 0.00 0.00 178.15 178.58 1tm9 h ALA 67 N 0.93 1.05 -0.75 1.87 0.00 0.12 0.15 119.26 122.63 1tm9 h ALA 67 Ca 0.04 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1tm9 h ALA 67 Cb 0.11 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1tm9 h ALA 67 CO -0.00 -0.16 0.50 0.28 0.00 0.00 0.00 179.25 179.87 1tm9 h VAL 68 N 0.50 1.19 -0.11 0.00 2.07 -0.98 0.24 116.25 119.15 1tm9 h VAL 68 Ca 0.40 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.58 1tm9 h VAL 68 Cb 0.55 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1tm9 h VAL 68 CO -0.36 0.19 -0.13 -1.13 0.02 0.00 0.00 177.57 176.16 1tm9 h ASN 69 N 1.02 -0.43 0.04 0.57 -0.73 0.55 1.92 115.58 118.51 1tm9 h ASN 69 Ca 0.28 0.06 0.01 0.00 1.87 0.00 0.00 56.30 58.51 1tm9 h ASN 69 Cb -0.12 0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.64 1tm9 h ASN 69 CO -0.06 -0.08 -0.06 -0.55 -0.37 0.00 0.00 177.43 176.31 1tm9 h ASN 70 N -0.07 -0.16 -0.04 1.15 7.08 -1.37 -2.05 115.58 120.11 1tm9 h ASN 70 Ca 0.02 0.02 0.00 0.00 -3.08 0.00 0.00 56.30 53.26 1tm9 h ASN 70 Cb 0.13 0.06 -0.01 0.00 -2.08 0.00 0.00 38.32 36.42 1tm9 h ASN 70 CO -0.15 -0.09 -0.06 0.40 -2.08 0.00 0.00 177.43 175.45 1tm9 h ILE 71 N -0.13 0.00 -1.00 6.14 1.08 0.23 0.97 117.51 124.81 1tm9 h ILE 71 Ca 0.01 0.00 0.41 0.00 -0.39 0.00 0.00 64.86 64.90 1tm9 h ILE 71 Cb 0.13 0.00 -0.18 0.00 -3.07 0.00 0.00 36.82 33.70 1tm9 h ILE 71 CO -0.03 0.00 0.53 0.50 -0.69 0.00 0.00 178.15 178.45 1tm9 h LYS 72 N -0.04 0.00 -0.18 2.37 3.11 0.31 1.54 116.57 123.68 1tm9 h LYS 72 Ca 0.01 -0.00 -0.04 0.00 -2.81 0.00 0.00 60.65 57.81 1tm9 h LYS 72 Cb 0.06 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.29 1tm9 h LYS 72 CO -0.06 0.00 -0.03 1.15 -2.81 0.00 0.00 179.45 177.70 1tm9 h THR 73 N 0.00 1.28 -1.30 1.00 2.02 0.33 -2.60 112.91 113.64 1tm9 h THR 73 Ca 0.84 -0.98 0.38 0.00 0.77 0.00 0.00 66.41 67.42 1tm9 h THR 73 Cb 2.21 1.57 -0.05 0.00 -1.74 0.00 0.00 68.15 70.15 1tm9 h THR 73 CO -0.77 0.29 1.14 -0.07 0.37 0.00 0.00 175.52 176.48 1tm9 h LEU 74 N 0.05 0.00 -6.07 2.58 3.38 0.96 -3.01 115.31 113.20 1tm9 h LEU 74 Ca 0.05 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.56 1tm9 h LEU 74 Cb 0.46 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.25 1tm9 h LEU 74 CO 0.02 0.00 2.15 -0.24 0.09 0.00 0.00 178.44 180.46 1tm9 n SER 75 N -3.69 2.95 0.00 -0.43 2.88 -0.98 -1.99 113.62 112.36 1tm9 n SER 75 Ca 0.29 -2.43 0.00 0.00 -1.33 0.00 0.00 58.87 55.39 1tm9 n SER 75 Cb 1.54 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 1tm9 n SER 75 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1tm9 n SER 76 N 6.06 0.00 -4.36 -3.46 7.64 -1.14 -5.09 113.62 113.27 1tm9 n SER 76 Ca 0.41 0.00 -0.52 0.00 1.01 0.00 0.00 58.87 59.77 1tm9 n SER 76 Cb 0.25 0.02 -0.13 0.00 -1.01 0.00 0.00 64.21 63.34 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 -1.12 0.01 0.00 0.44 0.31 -0.84 -4.02 118.33 113.11 1tm9 n VAL 77 Ca 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1tm9 n VAL 77 Cb 0.00 -0.58 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 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 7.04 0.93 1.17 2.92 0.00 -1.26 -3.99 105.19 112.01 1tm9 n GLY 78 Ca 0.59 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 1.37 3.00 -1.95 4.61 0.00 -1.26 -4.87 120.51 121.41 1tm9 n ALA 79 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1tm9 n ALA 79 Cb 0.00 0.35 0.08 0.00 0.00 0.00 0.00 19.45 19.88 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 -3.12 0.83 -1.41 0.00 5.66 -1.26 -4.97 114.28 110.01 1tm9 n THR 80 Ca 0.00 -1.53 0.00 0.00 -3.05 0.00 0.00 64.05 59.47 1tm9 n THR 80 Cb 0.28 0.39 0.00 0.00 -1.55 0.00 0.00 70.33 69.45 1tm9 n THR 80 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1tm9 n GLY 81 N -0.31 -2.85 1.38 1.09 0.00 -1.26 -5.09 105.19 98.16 1tm9 n GLY 81 Ca 0.09 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 0.03 0.00 -4.19 1.61 7.27 -1.26 -5.10 117.38 115.74 1tm9 n GLN 82 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.88 1tm9 n GLN 82 Cb 0.00 0.00 -0.16 0.00 2.41 0.00 0.00 30.24 32.49 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 -0.97 0.69 -1.43 3.69 2.02 -1.26 -4.41 117.35 115.68 1tm9 s TYR 83 Ca 0.00 -0.17 0.17 0.00 -0.37 0.00 0.00 57.07 56.70 1tm9 s TYR 83 Cb 0.00 -0.57 -0.03 0.00 -0.40 0.00 0.00 41.96 40.96 1tm9 s TYR 83 CO 0.00 -0.13 0.85 -1.33 -1.57 0.00 0.00 175.55 173.37 1tm9 n MET 84 N 3.70 1.65 0.01 -0.62 2.81 -1.26 -4.40 117.12 119.00 1tm9 n MET 84 Ca -0.22 -0.72 -0.18 0.00 -1.81 0.00 0.00 57.70 54.77 1tm9 n MET 84 Cb 0.53 -1.29 -0.10 0.00 -0.71 0.00 0.00 33.22 31.64 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 2.82 0.11 -0.66 3.04 0.00 -1.94 -3.30 119.26 119.32 1tm9 h ALA 85 Ca 0.00 -0.59 0.11 0.00 0.00 0.00 0.00 54.91 54.42 1tm9 h ALA 85 Cb 0.54 0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.25 1tm9 h ALA 85 CO 0.00 0.44 -0.38 0.77 0.00 0.00 0.00 179.25 180.09 1tm9 h SER 86 N 0.05 -1.32 0.00 0.00 0.02 -2.01 -3.31 113.55 106.99 1tm9 h SER 86 Ca -0.08 0.25 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1tm9 h SER 86 Cb 1.39 0.64 0.00 0.00 0.14 0.00 0.00 62.40 64.57 1tm9 h SER 86 CO 0.14 -0.31 0.00 0.49 -1.14 0.00 0.00 176.83 176.01 1tm9 n PHE 87 N -5.43 0.00 0.00 3.45 3.01 -1.24 -4.44 117.46 112.81 1tm9 n PHE 87 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.50 1tm9 n PHE 87 Cb 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 1tm9 n PHE 87 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1tm9 n PHE 88 N 0.00 0.00 -0.36 1.38 7.35 -1.24 -2.40 117.46 122.19 1tm9 n PHE 88 Ca 0.00 0.00 0.05 0.00 -0.76 0.00 0.00 57.45 56.74 1tm9 n PHE 88 Cb 0.00 0.00 0.13 0.00 0.35 0.00 0.00 39.48 39.96 1tm9 n PHE 88 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1tm9 h SER 89 N 0.00 -0.99 -0.94 -2.13 0.87 -1.82 1.70 113.55 110.24 1tm9 h SER 89 Ca 0.00 0.30 0.17 0.00 -1.23 0.00 0.00 61.79 61.03 1tm9 h SER 89 Cb 0.00 0.63 -0.10 0.00 -0.44 0.00 0.00 62.40 62.49 1tm9 h SER 89 CO 0.00 -0.32 0.54 0.71 -0.53 0.00 0.00 176.83 177.22 1tm9 h THR 90 N -0.00 0.73 -2.33 2.23 1.35 -1.76 -3.34 112.91 109.79 1tm9 h THR 90 Ca 0.46 -0.25 -0.45 0.00 -0.55 0.00 0.00 66.41 65.63 1tm9 h THR 90 Cb 0.71 -0.05 -0.35 0.00 -1.73 0.00 0.00 68.15 66.72 1tm9 h THR 90 CO -1.02 0.13 -0.74 0.54 -0.25 0.00 0.00 175.52 174.18 1tm9 s ASN 91 N -5.44 2.24 -0.06 5.36 4.22 0.56 -4.99 114.94 116.83 1tm9 s ASN 91 Ca -0.12 -1.50 -0.20 0.00 -2.14 0.00 0.00 52.86 48.90 1tm9 s ASN 91 Cb 0.23 0.11 -0.31 0.00 1.28 0.00 0.00 41.25 42.57 1tm9 s ASN 91 CO 0.79 -0.34 0.82 -1.28 -2.04 0.00 0.00 177.10 175.05 1tm9 h SER 92 N 7.59 0.46 -0.77 3.54 0.87 -1.20 -2.77 113.55 121.27 1tm9 h SER 92 Ca -0.04 -0.93 0.11 0.00 -1.23 0.00 0.00 61.79 59.71 1tm9 h SER 92 Cb 1.03 -0.15 -0.12 0.00 -0.44 0.00 0.00 62.40 62.72 1tm9 h SER 92 CO 0.29 1.46 -0.33 -0.62 -0.53 0.00 0.00 176.83 177.11 1tm9 n GLU 93 N -4.06 -0.21 -0.04 2.24 -0.58 -1.26 0.22 120.64 116.95 1tm9 n GLU 93 Ca -0.17 1.18 -0.14 0.00 -0.42 0.00 0.00 57.16 57.62 1tm9 n GLU 93 Cb 0.85 -1.75 -0.11 0.00 -0.57 0.00 0.00 31.44 29.85 1tm9 n GLU 93 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1tm9 h PRO 94 N 0.00 0.00 -0.79 3.49 0.13 -1.95 -2.79 132.00 130.09 1tm9 h PRO 94 Ca 0.24 -0.00 0.23 0.00 -0.87 0.00 0.00 66.00 65.60 1tm9 h PRO 94 Cb 0.44 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.54 1tm9 h PRO 94 CO -0.76 0.75 0.68 0.00 -0.23 0.00 0.00 178.00 178.44 1tm9 h ALA 95 N 0.25 2.65 0.14 -0.56 0.00 -0.58 0.13 119.26 121.29 1tm9 h ALA 95 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1tm9 h ALA 95 Cb 0.75 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1tm9 h ALA 95 CO 0.00 -1.09 -0.07 0.82 0.00 0.00 0.00 179.25 178.92 1tm9 h ILE 96 N 0.00 0.00 -1.46 0.00 2.04 0.28 -2.40 117.51 115.97 1tm9 h ILE 96 Ca 0.38 -0.33 0.43 0.00 1.00 0.00 0.00 64.86 66.33 1tm9 h ILE 96 Cb 1.73 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 1tm9 h ILE 96 CO -0.00 0.00 1.04 0.40 0.00 0.00 0.00 178.15 179.59 1tm9 h ILE 97 N -0.52 0.25 -0.32 -0.67 5.03 -0.97 1.49 117.51 121.81 1tm9 h ILE 97 Ca -0.02 -0.01 -0.15 0.00 -0.12 0.00 0.00 64.86 64.56 1tm9 h ILE 97 Cb 0.15 0.23 -0.00 0.00 -3.03 0.00 0.00 36.82 34.16 1tm9 h ILE 97 CO 0.03 0.00 -0.40 0.15 -0.68 0.00 0.00 178.15 177.26 1tm9 h PHE 98 N 0.03 1.01 0.36 1.37 3.57 -0.80 -1.41 116.94 121.07 1tm9 h PHE 98 Ca 0.71 -0.32 -0.02 0.00 3.53 0.00 0.00 57.97 61.87 1tm9 h PHE 98 Cb 2.77 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 41.31 1tm9 h PHE 98 CO -0.00 1.12 -0.17 0.00 -2.23 0.00 0.00 178.31 177.03 1tm9 n VAL 100 N -4.30 0.00 -0.22 0.00 0.31 0.26 0.82 118.33 115.21 1tm9 n VAL 100 Ca -0.06 1.41 -0.06 0.00 -0.01 0.00 0.00 64.34 65.62 1tm9 n VAL 100 Cb 0.19 -2.02 -0.05 0.00 -0.91 0.00 0.00 33.84 31.05 1tm9 n VAL 100 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1tm9 n ILE 101 N -2.45 -0.35 -0.03 2.52 2.08 -0.53 -0.88 119.36 119.72 1tm9 n ILE 101 Ca 0.00 1.79 -0.03 0.00 0.56 0.00 0.00 62.75 65.08 1tm9 n ILE 101 Cb 0.00 -2.27 -0.02 0.00 -0.75 0.00 0.00 39.64 36.60 1tm9 n ILE 101 CO 0.00 0.00 0.00 0.22 0.56 0.00 0.00 176.55 177.33 1tm9 h TYR 102 N 0.00 -0.34 -0.81 1.39 3.20 -0.65 0.12 116.97 119.89 1tm9 h TYR 102 Ca 0.08 0.02 0.28 0.00 3.14 0.00 0.00 58.73 62.25 1tm9 h TYR 102 Cb 0.21 0.16 -0.15 0.00 1.54 0.00 0.00 36.73 38.49 1tm9 h TYR 102 CO -0.87 -0.09 0.21 0.34 -1.64 0.00 0.00 178.16 176.10 1tm9 n PHE 103 N -3.25 0.71 0.00 -3.82 7.35 0.24 0.06 117.46 118.75 1tm9 n PHE 103 Ca -0.01 0.97 0.00 0.00 -0.76 0.00 0.00 57.45 57.65 1tm9 n PHE 103 Cb 0.06 -1.23 0.00 0.00 0.35 0.00 0.00 39.48 38.66 1tm9 n PHE 103 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1tm9 n LEU 104 N -5.01 0.70 -0.26 -2.13 4.77 0.07 -2.55 117.00 112.59 1tm9 n LEU 104 Ca 0.24 0.50 -0.07 0.00 -0.03 0.00 0.00 56.01 56.65 1tm9 n LEU 104 Cb 0.82 -0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.66 1tm9 n LEU 104 CO -0.03 -0.19 0.37 -1.22 -1.33 0.00 0.00 177.39 175.00 1tm9 n TYR 105 N -1.06 -0.28 -0.28 -1.77 4.01 0.21 0.20 117.16 118.19 1tm9 n TYR 105 Ca 0.00 0.79 -0.07 0.00 -0.16 0.00 0.00 57.90 58.45 1tm9 n TYR 105 Cb 0.00 -0.53 -0.07 0.00 -0.31 0.00 0.00 39.34 38.43 1tm9 n TYR 105 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1tm9 n HIS 106 N -4.56 -0.29 -2.75 -0.72 8.25 0.11 -4.25 115.22 111.00 1tm9 n HIS 106 Ca 0.01 0.84 -0.04 0.00 -0.26 0.00 0.00 57.72 58.27 1tm9 n HIS 106 Cb 0.16 -0.54 0.01 0.00 1.12 0.00 0.00 29.99 30.75 1tm9 n HIS 106 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1tm9 n PHE 107 N -4.55 -3.49 0.00 4.41 3.72 0.79 -5.09 117.46 113.25 1tm9 n PHE 107 Ca 0.01 -1.29 0.00 0.00 -0.05 0.00 0.00 57.45 56.13 1tm9 n PHE 107 Cb 0.17 1.45 0.00 0.00 -0.94 0.00 0.00 39.48 40.16 1tm9 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1tm9 n GLY 108 N 2.88 1.46 0.00 1.37 0.00 0.53 -4.50 105.19 106.93 1tm9 n GLY 108 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.59 1.61 3.01 -1.25 -5.00 117.46 114.24 1tm9 n PHE 109 Ca 0.00 0.00 -0.45 0.00 1.01 0.00 0.00 57.45 58.01 1tm9 n PHE 109 Cb 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.45 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 -2.17 1.76 -3.62 4.37 4.77 -1.26 -4.95 117.00 115.89 1tm9 n LEU 110 Ca 0.00 1.17 -0.17 0.00 -0.03 0.00 0.00 56.01 56.98 1tm9 n LEU 110 Cb 0.38 -1.28 -0.15 0.00 -2.33 0.00 0.00 43.42 40.04 1tm9 n LEU 110 CO 0.00 -1.38 -0.22 -1.59 -1.33 0.00 0.00 177.39 172.87 1tm9 s LYS 111 N -1.35 0.09 -0.21 3.23 0.00 -1.26 -4.29 119.74 115.95 1tm9 s LYS 111 Ca 0.61 0.45 -0.05 0.00 0.00 0.00 0.00 55.97 56.98 1tm9 s LYS 111 Cb -0.72 -0.60 -0.02 0.00 0.00 0.00 0.00 37.83 36.49 1tm9 s LYS 111 CO 0.58 -0.42 -0.00 0.16 0.00 0.00 0.00 175.35 175.67 1tm9 s ASP 112 N 2.31 4.76 -0.35 0.03 1.47 -1.26 -4.91 116.67 118.71 1tm9 s ASP 112 Ca 0.04 -0.24 -0.03 0.00 1.18 0.00 0.00 52.55 53.50 1tm9 s ASP 112 Cb -0.13 -1.82 0.19 0.00 -0.34 0.00 0.00 42.92 40.81 1tm9 s ASP 112 CO -0.08 0.04 0.88 0.21 0.68 0.00 0.00 175.17 176.90 1tm9 s ASN 113 N 1.15 -0.83 0.31 2.11 3.84 -1.26 -4.79 114.94 115.46 1tm9 s ASN 113 Ca 0.03 -0.34 0.00 0.00 0.21 0.00 0.00 52.86 52.76 1tm9 s ASN 113 Cb -0.14 1.13 0.00 0.00 -0.55 0.00 0.00 41.25 41.68 1tm9 s ASN 113 CO 0.01 -0.10 0.00 -3.20 -2.79 0.00 0.00 177.10 171.02 1tm9 n ASN 114 N 4.18 -2.77 -0.13 -4.21 5.15 -1.26 -5.00 115.26 111.22 1tm9 n ASN 114 Ca 0.08 0.74 -0.28 0.00 -0.60 0.00 0.00 54.58 54.52 1tm9 n ASN 114 Cb 0.60 2.73 -0.09 0.00 -0.53 0.00 0.00 39.78 42.49 1tm9 n ASN 114 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1tm9 n LYS 115 N -3.23 0.55 -3.71 1.20 4.81 -1.26 -5.10 118.16 111.41 1tm9 n LYS 115 Ca 0.00 0.24 0.03 0.00 -0.87 0.00 0.00 58.31 57.71 1tm9 n LYS 115 Cb 0.00 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 33.63 1tm9 n LYS 115 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1tm9 s LYS 116 N -2.47 0.21 -0.26 1.64 2.47 -1.26 -5.02 119.74 115.05 1tm9 s LYS 116 Ca -0.36 -0.12 0.11 0.00 -1.56 0.00 0.00 55.97 54.04 1tm9 s LYS 116 Cb 0.14 0.07 0.52 0.00 -1.46 0.00 0.00 37.83 37.10 1tm9 s LYS 116 CO 0.46 -0.10 1.47 0.00 0.16 0.00 0.00 175.35 177.34 1tm9 n GLN 117 N -0.63 2.23 -0.29 4.03 10.64 -1.26 -4.62 117.38 127.48 1tm9 n GLN 117 Ca -0.05 -3.05 0.34 0.00 -1.83 0.00 0.00 57.00 52.41 1tm9 n GLN 117 Cb 0.62 -1.84 0.74 0.00 -0.86 0.00 0.00 30.24 28.90 1tm9 n GLN 117 CO 0.00 0.00 0.00 -0.84 -1.83 0.00 0.00 177.06 174.39 1tm9 h ILE 118 N 1.26 0.39 -0.15 -0.39 3.07 -1.97 1.80 117.51 121.52 1tm9 h ILE 118 Ca 0.16 0.00 0.04 0.00 1.55 0.00 0.00 64.86 66.62 1tm9 h ILE 118 Cb 1.64 0.40 -0.01 0.00 -0.27 0.00 0.00 36.82 38.59 1tm9 h ILE 118 CO 0.37 0.00 0.11 0.40 -1.05 0.00 0.00 178.15 177.97 1tm9 h ILE 119 N 0.00 0.92 0.00 0.16 1.08 -1.96 1.66 117.51 119.37 1tm9 h ILE 119 Ca 0.54 0.00 -0.27 0.00 -0.39 0.00 0.00 64.86 64.74 1tm9 h ILE 119 Cb 2.22 0.93 -0.04 0.00 -3.07 0.00 0.00 36.82 36.85 1tm9 h ILE 119 CO -0.01 0.00 -1.52 0.50 -0.69 0.00 0.00 178.15 176.43 1tm9 h LYS 120 N 0.00 0.00 0.01 2.37 3.11 0.24 -2.27 116.57 120.02 1tm9 h LYS 120 Ca 0.07 0.00 -0.19 0.00 -2.81 0.00 0.00 60.65 57.72 1tm9 h LYS 120 Cb 0.28 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.49 1tm9 h LYS 120 CO -0.00 0.61 -0.87 -0.22 -2.81 0.00 0.00 179.45 176.16 1tm9 h LYS 121 N 0.00 0.07 0.01 1.90 3.11 -0.24 -2.63 116.57 118.79 1tm9 h LYS 121 Ca -0.21 -0.09 -0.00 0.00 -2.81 0.00 0.00 60.65 57.54 1tm9 h LYS 121 Cb 1.94 0.03 0.00 0.00 -1.00 0.00 0.00 32.23 33.20 1tm9 h LYS 121 CO 0.09 0.89 -0.00 0.00 -2.81 0.00 0.00 179.45 177.62 1tm9 h ALA 122 N 1.08 -0.02 -1.16 5.00 0.00 0.22 -2.40 119.26 121.98 1tm9 h ALA 122 Ca -0.02 -0.00 0.40 0.00 0.00 0.00 0.00 54.91 55.28 1tm9 h ALA 122 Cb 1.51 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 19.16 1tm9 h ALA 122 CO 0.12 -0.02 0.71 1.88 0.00 0.00 0.00 179.25 181.93 1tm9 h TYR 123 N -0.27 0.70 -0.24 0.00 0.05 -1.56 1.53 116.97 117.18 1tm9 h TYR 123 Ca -0.00 0.03 -0.19 0.00 0.05 0.00 0.00 58.73 58.62 1tm9 h TYR 123 Cb 0.01 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 37.57 1tm9 h TYR 123 CO 0.00 -0.26 -0.59 1.49 -1.05 0.00 0.00 178.16 177.76 1tm9 h GLU 124 N 0.13 0.78 -0.49 4.88 4.22 -1.59 0.25 114.58 122.76 1tm9 h GLU 124 Ca 0.80 -0.52 0.14 0.00 0.08 0.00 0.00 59.36 59.87 1tm9 h GLU 124 Cb 2.25 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 31.56 1tm9 h GLU 124 CO -0.54 1.14 0.39 0.00 -2.18 0.00 0.00 179.01 177.81 1tm9 h THR 125 N 0.58 0.65 0.00 0.32 1.03 0.27 0.56 112.91 116.32 1tm9 h THR 125 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 1tm9 h THR 125 Cb 1.19 0.72 0.00 0.00 -1.07 0.00 0.00 68.15 68.99 1tm9 h THR 125 CO 0.12 0.00 -0.52 -0.38 -0.01 0.00 0.00 175.52 174.73 1tm9 n ILE 126 N -4.22 1.26 -0.09 0.00 5.41 -0.88 -2.45 119.36 118.40 1tm9 n ILE 126 Ca 0.09 0.24 0.25 0.00 1.00 0.00 0.00 62.75 64.33 1tm9 n ILE 126 Cb 0.60 -2.28 0.60 0.00 -0.71 0.00 0.00 39.64 37.85 1tm9 n ILE 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1tm9 h ALA 127 N -1.12 2.60 0.00 -1.39 0.00 -0.76 1.52 119.26 120.11 1tm9 h ALA 127 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1tm9 h ALA 127 Cb 0.52 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1tm9 h ALA 127 CO 0.00 -1.26 -0.10 0.22 0.00 0.00 0.00 179.25 178.11 1tm9 h ASP 128 N 0.00 0.00 -0.69 0.00 1.82 -0.03 -2.96 116.42 114.56 1tm9 h ASP 128 Ca 0.37 0.00 0.14 0.00 -0.39 0.00 0.00 57.03 57.15 1tm9 h ASP 128 Cb 2.08 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 41.99 1tm9 h ASP 128 CO -0.00 0.32 0.16 -1.13 -1.61 0.00 0.00 179.24 176.97 1tm9 h ASN 129 N -0.54 0.00 0.02 2.28 -0.00 -0.79 1.17 115.58 117.73 1tm9 h ASN 129 Ca 0.00 0.13 -0.00 0.00 -0.00 0.00 0.00 56.30 56.43 1tm9 h ASN 129 Cb 0.10 0.18 -0.00 0.00 -0.00 0.00 0.00 38.32 38.61 1tm9 h ASN 129 CO 0.00 -0.02 -0.01 -0.29 -0.00 0.00 0.00 177.43 177.11 1tm9 h ILE 130 N 0.27 0.78 -0.19 2.57 2.10 0.19 0.59 117.51 123.82 1tm9 h ILE 130 Ca 0.38 -0.05 0.00 0.00 1.08 0.00 0.00 64.86 66.27 1tm9 h ILE 130 Cb 0.62 1.03 0.00 0.00 -1.09 0.00 0.00 36.82 37.37 1tm9 h ILE 130 CO -0.47 0.01 0.00 0.00 -1.08 0.00 0.00 178.15 176.61 1tm9 n ALA 131 N -2.43 2.51 0.07 0.18 0.00 0.39 -3.40 120.51 117.83 1tm9 n ALA 131 Ca -0.03 -0.54 -0.23 0.00 0.00 0.00 0.00 53.44 52.64 1tm9 n ALA 131 Cb 0.10 -1.07 -0.15 0.00 0.00 0.00 0.00 19.45 18.33 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 2.24 0.60 0.05 0.00 3.58 0.22 -3.32 116.42 119.79 1tm9 h ASP 132 Ca 0.00 -0.92 0.00 0.00 0.42 0.00 0.00 57.03 56.53 1tm9 h ASP 132 Cb 0.49 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.35 1tm9 h ASP 132 CO 0.00 1.72 -0.10 0.00 -2.88 0.00 0.00 179.24 177.97 1tm9 n TYR 133 N -3.72 0.00 0.00 0.28 0.18 -1.20 -4.50 117.16 108.20 1tm9 n TYR 133 Ca -0.23 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.55 1tm9 n TYR 133 Cb 1.03 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 39.95 1tm9 n TYR 133 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1tm9 n LEU 134 N 0.08 0.63 -2.26 -3.48 4.77 -1.22 -5.02 117.00 110.50 1tm9 n LEU 134 Ca 0.16 0.28 -0.01 0.00 -0.03 0.00 0.00 56.01 56.41 1tm9 n LEU 134 Cb 0.39 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 1tm9 n LEU 134 CO 0.20 0.00 -0.34 -3.20 -1.33 0.00 0.00 177.39 172.72 1tm9 n ASN 135 N -0.38 -4.92 -2.12 -1.43 2.85 -1.26 -5.02 115.26 102.98 1tm9 n ASN 135 Ca 0.00 0.91 -0.02 0.00 -0.11 0.00 0.00 54.58 55.36 1tm9 n ASN 135 Cb 0.00 -3.76 0.05 0.00 1.24 0.00 0.00 39.78 37.31 1tm9 n ASN 135 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1tm9 n GLU 136 N 0.57 0.91 0.00 1.20 0.28 -1.26 -5.20 120.64 117.13 1tm9 n GLU 136 Ca -0.05 -1.74 0.00 0.00 -0.16 0.00 0.00 57.16 55.21 1tm9 n GLU 136 Cb 0.08 -0.03 0.00 0.00 1.43 0.00 0.00 31.44 32.92 1tm9 n GLU 136 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26