#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jm5 s MET 2 N 0.00 0.40 -0.07 1.43 1.75 -1.26 -5.12 119.30 116.43 2jm5 s MET 2 Ca 0.00 -0.69 0.03 0.00 -1.25 0.00 0.00 55.69 53.78 2jm5 s MET 2 Cb 0.00 -0.97 0.01 0.00 2.84 0.00 0.00 34.83 36.70 2jm5 s MET 2 CO 0.00 -1.10 -0.15 0.54 -0.65 0.00 0.00 175.02 173.65 2jm5 s VAL 3 N 1.79 1.36 0.29 10.11 0.11 -1.26 -5.00 120.40 127.80 2jm5 s VAL 3 Ca 0.13 -0.62 -0.29 0.00 -2.93 0.00 0.00 61.98 58.27 2jm5 s VAL 3 Cb -0.17 -1.21 -0.10 0.00 -1.53 0.00 0.00 36.38 33.37 2jm5 s VAL 3 CO -0.20 0.40 1.16 -0.94 -3.33 0.00 0.00 175.10 172.19 2jm5 s SER 4 N 0.54 7.12 0.52 3.54 1.04 -1.26 -4.84 113.70 120.36 2jm5 s SER 4 Ca -0.15 2.39 0.37 0.00 0.48 0.00 0.00 55.95 59.04 2jm5 s SER 4 Cb -0.16 -2.63 1.52 0.00 0.10 0.00 0.00 66.02 64.85 2jm5 s SER 4 CO 0.05 -0.26 1.73 -0.65 0.98 0.00 0.00 173.24 175.09 2jm5 h PRO 5 N 3.72 0.06 0.56 4.02 0.11 -1.93 0.88 132.00 139.41 2jm5 h PRO 5 Ca -0.47 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 2jm5 h PRO 5 Cb 1.22 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.32 2jm5 h PRO 5 CO 0.67 0.04 -0.27 1.49 -0.21 0.00 0.00 178.00 179.72 2jm5 h GLU 6 N 0.06 -0.72 -0.45 1.05 4.81 -1.91 0.11 114.58 117.54 2jm5 h GLU 6 Ca 0.68 0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.95 2jm5 h GLU 6 Cb 2.52 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 32.04 2jm5 h GLU 6 CO -0.09 -0.42 0.27 1.49 -0.73 0.00 0.00 179.01 179.53 2jm5 h GLU 7 N -0.95 0.60 -0.07 1.92 4.57 -1.47 -1.40 114.58 117.78 2jm5 h GLU 7 Ca -0.08 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2jm5 h GLU 7 Cb 0.64 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2jm5 h GLU 7 CO 0.13 0.42 -0.02 0.00 -1.18 0.00 0.00 179.01 178.35 2jm5 h ALA 8 N 1.69 0.10 0.00 2.92 0.00 -0.77 -2.71 119.26 120.48 2jm5 h ALA 8 Ca 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2jm5 h ALA 8 Cb -0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2jm5 h ALA 8 CO -0.03 -0.18 -0.04 -0.39 0.00 0.00 0.00 179.25 178.61 2jm5 h VAL 9 N -0.21 0.76 0.00 0.00 -1.51 -0.20 0.05 116.25 115.14 2jm5 h VAL 9 Ca 0.02 -0.15 -0.02 0.00 -1.23 0.00 0.00 66.70 65.31 2jm5 h VAL 9 Cb 0.43 1.09 -0.00 0.00 -2.13 0.00 0.00 31.29 30.67 2jm5 h VAL 9 CO 0.01 0.04 -0.12 0.11 -1.23 0.00 0.00 177.57 176.38 2jm5 h LYS 10 N 0.00 0.00 0.00 5.19 1.79 -1.02 -1.27 116.57 121.26 2jm5 h LYS 10 Ca -0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 2jm5 h LYS 10 Cb 0.08 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 2jm5 h LYS 10 CO 0.01 0.12 -0.18 -1.49 -1.08 0.00 0.00 179.45 176.82 2jm5 h TRP 11 N 0.00 0.00 -0.14 -1.35 6.55 -0.67 -3.12 115.95 117.22 2jm5 h TRP 11 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 2jm5 h TRP 11 Cb 0.47 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.77 2jm5 h TRP 11 CO 0.00 0.18 0.00 0.41 -1.05 0.00 0.00 178.44 177.98 2jm5 n GLY 12 N 0.43 -0.26 0.00 1.49 0.00 -0.48 -2.78 105.19 103.59 2jm5 n GLY 12 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2jm5 n GLY 12 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2jm5 n GLU 13 N -0.08 2.72 -3.19 1.61 0.28 -1.18 -4.99 120.64 115.80 2jm5 n GLU 13 Ca 0.08 -0.18 0.01 0.00 -0.16 0.00 0.00 57.16 56.92 2jm5 n GLU 13 Cb 0.16 -0.62 -0.02 0.00 1.43 0.00 0.00 31.44 32.39 2jm5 n GLU 13 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2jm5 s SER 14 N -0.44 -1.08 0.40 -1.84 0.01 -1.12 -5.02 113.70 104.62 2jm5 s SER 14 Ca 0.00 0.44 0.07 0.00 1.31 0.00 0.00 55.95 57.76 2jm5 s SER 14 Cb 0.00 1.88 0.83 0.00 0.21 0.00 0.00 66.02 68.94 2jm5 s SER 14 CO 0.00 -0.29 2.04 0.15 0.41 0.00 0.00 173.24 175.56 2jm5 h PHE 15 N 8.04 0.57 -0.56 2.43 3.57 -1.92 -1.61 116.94 127.46 2jm5 h PHE 15 Ca -0.14 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.33 2jm5 h PHE 15 Cb 1.16 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.69 2jm5 h PHE 15 CO 0.17 0.35 0.16 0.22 -2.23 0.00 0.00 178.31 176.99 2jm5 h ASP 16 N 0.61 0.79 -0.22 0.41 3.58 -1.95 0.51 116.42 120.15 2jm5 h ASP 16 Ca 0.18 -0.13 -0.04 0.00 0.42 0.00 0.00 57.03 57.46 2jm5 h ASP 16 Cb -0.03 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 40.81 2jm5 h ASP 16 CO -0.04 0.75 -0.02 0.50 -2.88 0.00 0.00 179.24 177.55 2jm5 h LYS 17 N 0.83 0.40 0.07 0.28 3.64 -1.67 0.44 116.57 120.57 2jm5 h LYS 17 Ca 0.19 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2jm5 h LYS 17 Cb 0.26 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2jm5 h LYS 17 CO -0.01 0.61 -0.23 1.25 -2.27 0.00 0.00 179.45 178.81 2jm5 h LEU 18 N 0.16 -0.65 -0.86 5.20 5.85 -1.06 -0.05 115.31 123.90 2jm5 h LEU 18 Ca 0.06 0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.75 2jm5 h LEU 18 Cb 0.44 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 2jm5 h LEU 18 CO 0.02 -0.31 -0.38 0.25 -0.34 0.00 0.00 178.44 177.68 2jm5 h LEU 19 N -0.40 0.40 0.00 2.25 5.85 -0.80 -1.33 115.31 121.27 2jm5 h LEU 19 Ca 0.04 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.55 2jm5 h LEU 19 Cb 0.44 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2jm5 h LEU 19 CO -0.16 0.75 -0.31 0.28 -0.34 0.00 0.00 178.44 178.66 2jm5 h SER 20 N 0.32 0.00 -3.31 1.25 0.02 -0.70 -3.38 113.55 107.75 2jm5 h SER 20 Ca 0.03 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.43 2jm5 h SER 20 Cb 0.82 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.33 2jm5 h SER 20 CO 0.07 0.20 0.48 -2.28 -1.14 0.00 0.00 176.83 174.16 2jm5 s HIS 21 N -3.12 3.56 0.25 3.45 5.65 -0.05 -4.92 115.29 120.10 2jm5 s HIS 21 Ca 0.05 1.60 -0.05 0.00 0.25 0.00 0.00 55.06 56.92 2jm5 s HIS 21 Cb 0.06 -3.18 0.35 0.00 -1.18 0.00 0.00 32.58 28.63 2jm5 s HIS 21 CO 0.71 -0.25 1.85 0.00 -0.65 0.00 0.00 174.74 176.41 2jm5 h ARG 22 N 6.97 0.97 0.00 2.88 -0.00 -1.85 0.33 114.38 123.68 2jm5 h ARG 22 Ca -0.36 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.98 59.01 2jm5 h ARG 22 Cb 1.19 -0.22 -0.01 0.00 0.00 0.00 0.00 29.97 30.93 2jm5 h ARG 22 CO 0.81 0.64 -0.25 -0.44 0.00 0.00 0.00 179.97 180.73 2jm5 h ASP 23 N 1.00 0.00 0.10 7.04 3.32 -1.91 -2.25 116.42 123.72 2jm5 h ASP 23 Ca 0.39 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.19 2jm5 h ASP 23 Cb 0.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 2jm5 h ASP 23 CO -0.18 0.25 -1.27 1.23 -1.72 0.00 0.00 179.24 177.55 2jm5 h GLY 24 N 1.77 0.24 0.98 2.75 0.00 -0.96 -1.23 103.07 106.63 2jm5 h GLY 24 Ca -0.00 -0.63 0.11 0.00 0.00 0.00 0.00 47.33 46.81 2jm5 h GLY 24 CO 0.03 0.55 0.42 -2.00 0.00 0.00 0.00 176.54 175.54 2jm5 h LEU 25 N -0.41 0.34 -0.21 3.11 6.46 0.65 0.19 115.31 125.44 2jm5 h LEU 25 Ca -0.28 0.01 -0.17 0.00 -0.12 0.00 0.00 57.88 57.33 2jm5 h LEU 25 Cb 1.67 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.54 2jm5 h LEU 25 CO 0.04 0.20 -0.52 -0.08 -0.62 0.00 0.00 178.44 177.46 2jm5 h GLU 26 N 0.37 0.73 -0.52 1.25 4.57 -1.39 0.23 114.58 119.83 2jm5 h GLU 26 Ca 0.29 -0.50 -0.10 0.00 -1.18 0.00 0.00 59.36 57.87 2jm5 h GLU 26 Cb 0.63 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 2jm5 h GLU 26 CO -0.08 1.12 -0.07 0.00 -1.18 0.00 0.00 179.01 178.81 2jm5 h ALA 27 N 0.61 0.70 -0.26 2.92 0.00 0.18 -2.07 119.26 121.34 2jm5 h ALA 27 Ca -0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.40 2jm5 h ALA 27 Cb 1.14 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2jm5 h ALA 27 CO 0.11 0.58 -0.56 0.35 0.00 0.00 0.00 179.25 179.74 2jm5 h PHE 28 N 0.82 1.06 0.00 0.00 3.57 -0.68 -2.76 116.94 118.95 2jm5 h PHE 28 Ca 0.14 -0.39 -0.06 0.00 3.53 0.00 0.00 57.97 61.19 2jm5 h PHE 28 Cb 0.62 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 2jm5 h PHE 28 CO 0.04 1.21 -0.29 0.00 -2.23 0.00 0.00 178.31 177.05 2jm5 h THR 29 N 0.60 1.13 -0.24 4.41 1.03 -0.42 -0.32 112.91 119.09 2jm5 h THR 29 Ca 0.00 -1.02 -0.02 0.00 -0.01 0.00 0.00 66.41 65.36 2jm5 h THR 29 Cb 1.17 1.56 -0.01 0.00 -1.07 0.00 0.00 68.15 69.80 2jm5 h THR 29 CO 0.12 0.28 0.06 0.03 -0.01 0.00 0.00 175.52 176.01 2jm5 h ARG 30 N 0.00 0.39 -0.21 0.00 3.08 -1.15 0.50 114.38 116.99 2jm5 h ARG 30 Ca -0.00 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 2jm5 h ARG 30 Cb 0.54 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2jm5 h ARG 30 CO 0.04 0.49 -0.04 0.35 -1.07 0.00 0.00 179.97 179.74 2jm5 h PHE 31 N 0.22 0.31 0.05 3.04 3.57 -1.15 -0.37 116.94 122.61 2jm5 h PHE 31 Ca 0.08 -0.02 -0.24 0.00 3.53 0.00 0.00 57.97 61.31 2jm5 h PHE 31 Cb 0.27 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2jm5 h PHE 31 CO 0.01 0.35 -1.13 1.25 -2.23 0.00 0.00 178.31 176.56 2jm5 h LEU 32 N 0.30 0.16 -0.15 0.59 5.85 -0.62 -3.32 115.31 118.12 2jm5 h LEU 32 Ca 0.07 -0.17 -0.18 0.00 0.84 0.00 0.00 57.88 58.43 2jm5 h LEU 32 Cb 0.26 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.25 2jm5 h LEU 32 CO 0.01 1.14 -0.62 0.11 -0.34 0.00 0.00 178.44 178.74 2jm5 h LYS 33 N 0.03 0.68 -0.27 1.25 1.57 0.56 0.13 116.57 120.52 2jm5 h LYS 33 Ca -0.07 -0.53 0.05 0.00 -1.87 0.00 0.00 60.65 58.23 2jm5 h LYS 33 Cb 1.86 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 34.26 2jm5 h LYS 33 CO 0.15 1.15 0.19 0.00 -0.57 0.00 0.00 179.45 180.37 2jm5 h THR 34 N 0.36 0.93 -0.42 -0.16 1.03 -1.18 -0.59 112.91 112.88 2jm5 h THR 34 Ca -0.04 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 66.32 2jm5 h THR 34 Cb 1.25 0.80 0.00 0.00 -1.07 0.00 0.00 68.15 69.13 2jm5 h THR 34 CO 0.13 0.02 0.00 -1.84 -0.01 0.00 0.00 175.52 173.82 2jm5 n GLU 35 N -4.48 2.85 -3.07 0.00 0.28 -1.25 -5.01 120.64 109.97 2jm5 n GLU 35 Ca 0.03 -2.18 -0.02 0.00 -0.16 0.00 0.00 57.16 54.82 2jm5 n GLU 35 Cb 0.26 -1.33 0.00 0.00 1.43 0.00 0.00 31.44 31.79 2jm5 n GLU 35 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2jm5 n PHE 36 N 0.73 -3.01 -2.19 -1.84 3.01 -0.23 -4.97 117.46 108.97 2jm5 n PHE 36 Ca 0.14 1.16 -0.00 0.00 1.01 0.00 0.00 57.45 59.76 2jm5 n PHE 36 Cb 0.47 -4.05 -0.01 0.00 -0.01 0.00 0.00 39.48 35.88 2jm5 n PHE 36 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2jm5 n SER 37 N -1.62 0.09 0.12 4.37 7.64 0.01 -4.94 113.62 119.30 2jm5 n SER 37 Ca 0.00 -1.85 0.12 0.00 1.01 0.00 0.00 58.87 58.16 2jm5 n SER 37 Cb 0.50 -0.07 0.46 0.00 -1.01 0.00 0.00 64.21 64.09 2jm5 n SER 37 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2jm5 n GLU 38 N 0.19 0.23 0.00 1.43 0.28 -1.07 -2.83 120.64 118.86 2jm5 n GLU 38 Ca -0.06 0.34 0.12 0.00 -0.16 0.00 0.00 57.16 57.40 2jm5 n GLU 38 Cb 0.84 -1.85 0.74 0.00 1.43 0.00 0.00 31.44 32.60 2jm5 n GLU 38 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2jm5 n GLU 39 N -2.26 0.85 -0.03 3.44 0.00 -1.26 -1.69 120.64 119.69 2jm5 n GLU 39 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 57.16 57.02 2jm5 n GLU 39 Cb 0.32 -1.46 -0.13 0.00 0.00 0.00 0.00 31.44 30.16 2jm5 n GLU 39 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 2jm5 h ASN 40 N 0.00 0.18 -0.39 -1.84 2.35 -1.94 0.19 115.58 114.13 2jm5 h ASN 40 Ca 0.00 -0.89 -0.08 0.00 -0.55 0.00 0.00 56.30 54.77 2jm5 h ASN 40 Cb 0.00 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 2jm5 h ASN 40 CO 0.00 1.27 -0.05 -0.29 -1.65 0.00 0.00 177.43 176.71 2jm5 h ILE 41 N -0.73 1.25 -0.00 2.81 2.10 -1.70 -1.06 117.51 120.18 2jm5 h ILE 41 Ca -0.14 -1.09 0.00 0.00 1.08 0.00 0.00 64.86 64.71 2jm5 h ILE 41 Cb 1.33 0.95 0.00 0.00 -1.09 0.00 0.00 36.82 38.01 2jm5 h ILE 41 CO 0.02 0.38 -0.14 -0.62 -1.08 0.00 0.00 178.15 176.71 2jm5 n GLU 42 N -4.19 0.53 0.40 2.19 1.02 -0.68 -2.25 120.64 117.66 2jm5 n GLU 42 Ca 0.02 -0.18 -0.18 0.00 -0.02 0.00 0.00 57.16 56.80 2jm5 n GLU 42 Cb 0.33 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.17 2jm5 n GLU 42 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2jm5 h PHE 43 N 0.44 -0.95 0.00 -0.32 3.57 0.74 0.25 116.94 120.67 2jm5 h PHE 43 Ca 0.00 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.45 2jm5 h PHE 43 Cb 0.39 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 2jm5 h PHE 43 CO 0.00 -0.57 -0.11 0.11 -2.23 0.00 0.00 178.31 175.51 2jm5 h TRP 44 N -1.12 0.00 -0.58 0.41 5.08 -1.53 -2.16 115.95 116.05 2jm5 h TRP 44 Ca -0.10 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.83 2jm5 h TRP 44 Cb 0.80 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.93 2jm5 h TRP 44 CO -0.01 0.11 0.23 0.82 -1.28 0.00 0.00 178.44 178.31 2jm5 h ILE 45 N 0.00 1.21 -0.46 0.12 2.04 -1.40 0.21 117.51 119.24 2jm5 h ILE 45 Ca -0.00 -0.66 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 2jm5 h ILE 45 Cb 0.95 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2jm5 h ILE 45 CO 0.01 0.26 0.07 0.00 0.00 0.00 0.00 178.15 178.50 2jm5 h ALA 46 N 1.41 0.60 -0.29 1.87 0.00 -0.47 -0.12 119.26 122.27 2jm5 h ALA 46 Ca 0.20 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2jm5 h ALA 46 Cb 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2jm5 h ALA 46 CO -0.02 0.33 0.14 0.00 0.00 0.00 0.00 179.25 179.71 2jm5 h GLU 48 N 0.34 0.00 -0.37 0.00 4.39 -0.56 0.14 114.58 118.53 2jm5 h GLU 48 Ca 0.10 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.68 2jm5 h GLU 48 Cb 0.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2jm5 h GLU 48 CO -0.01 0.28 -0.24 0.22 -1.16 0.00 0.00 179.01 178.09 2jm5 h ASP 49 N 0.00 0.76 -0.07 1.42 3.58 -0.52 -1.97 116.42 119.62 2jm5 h ASP 49 Ca -0.00 -0.28 -0.19 0.00 0.42 0.00 0.00 57.03 56.98 2jm5 h ASP 49 Cb 0.90 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.74 2jm5 h ASP 49 CO 0.04 0.98 -0.64 0.15 -2.88 0.00 0.00 179.24 176.89 2jm5 h PHE 50 N 0.65 0.89 -0.21 0.28 3.57 -0.58 -2.68 116.94 118.86 2jm5 h PHE 50 Ca 0.09 -0.35 0.06 0.00 3.53 0.00 0.00 57.97 61.30 2jm5 h PHE 50 Cb 0.75 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 2jm5 h PHE 50 CO 0.04 1.14 0.17 -0.22 -2.23 0.00 0.00 178.31 177.21 2jm5 h LYS 51 N 0.51 0.00 0.00 1.11 3.64 -0.46 -0.29 116.57 121.08 2jm5 h LYS 51 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2jm5 h LYS 51 Cb 1.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2jm5 h LYS 51 CO 0.13 0.00 0.00 1.63 -2.27 0.00 0.00 179.45 178.94 2jm5 n LYS 52 N -4.17 0.18 -2.67 1.90 5.02 -0.76 -4.79 118.16 112.87 2jm5 n LYS 52 Ca 0.02 0.37 -0.31 0.00 -2.02 0.00 0.00 58.31 56.37 2jm5 n LYS 52 Cb 0.31 -1.82 -0.03 0.00 -0.02 0.00 0.00 35.03 33.46 2jm5 n LYS 52 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2jm5 s SER 53 N -4.15 6.56 0.00 4.39 0.15 -0.12 -4.97 113.70 115.56 2jm5 s SER 53 Ca 0.05 1.31 0.00 0.00 0.70 0.00 0.00 55.95 58.01 2jm5 s SER 53 Cb 0.10 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 2jm5 s SER 53 CO 0.41 -0.47 0.39 2.29 1.20 0.00 0.00 173.24 177.05 2jm5 n LYS 54 N -1.40 -0.28 -3.22 5.44 -0.00 -1.26 -4.99 118.16 112.43 2jm5 n LYS 54 Ca 0.04 -0.39 -0.42 0.00 -0.00 0.00 0.00 58.31 57.54 2jm5 n LYS 54 Cb 0.54 -0.88 -0.08 0.00 -0.00 0.00 0.00 35.03 34.61 2jm5 n LYS 54 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2jm5 s GLY 55 N -0.07 1.81 0.45 2.58 0.00 -1.26 -4.94 107.32 105.88 2jm5 s GLY 55 Ca 0.00 -1.15 0.13 0.00 0.00 0.00 0.00 44.72 43.71 2jm5 s GLY 55 CO 0.00 1.31 2.03 -2.55 0.00 0.00 0.00 173.10 173.89 2jm5 h PRO 56 N 8.61 0.34 -0.46 2.90 0.11 -1.99 0.39 132.00 141.90 2jm5 h PRO 56 Ca -0.27 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.72 2jm5 h PRO 56 Cb 1.12 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 2jm5 h PRO 56 CO 0.81 0.23 -0.10 -0.56 -0.21 0.00 0.00 178.00 178.16 2jm5 h GLN 57 N 0.35 0.83 0.00 1.05 -0.00 -2.00 -2.41 115.11 112.93 2jm5 h GLN 57 Ca 0.20 -0.28 -0.09 0.00 -0.00 0.00 0.00 58.65 58.48 2jm5 h GLN 57 Cb 0.34 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.48 27.74 2jm5 h GLN 57 CO -0.05 0.89 -0.45 0.37 -0.00 0.00 0.00 178.83 179.60 2jm5 h GLN 58 N 0.75 0.00 -0.36 0.06 5.75 -1.39 -2.25 115.11 117.67 2jm5 h GLN 58 Ca 0.13 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.64 2jm5 h GLN 58 Cb 0.60 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.12 2jm5 h GLN 58 CO 0.04 0.45 0.22 0.82 -2.65 0.00 0.00 178.83 177.70 2jm5 h ILE 59 N 0.00 1.05 -0.42 2.39 1.08 -0.71 0.22 117.51 121.11 2jm5 h ILE 59 Ca -0.00 -0.15 0.03 0.00 -0.39 0.00 0.00 64.86 64.35 2jm5 h ILE 59 Cb 0.86 0.57 -0.04 0.00 -3.07 0.00 0.00 36.82 35.15 2jm5 h ILE 59 CO 0.06 0.08 0.21 0.45 -0.69 0.00 0.00 178.15 178.26 2jm5 h HIS 60 N 0.44 0.38 0.55 1.37 3.86 -1.14 0.14 115.15 120.75 2jm5 h HIS 60 Ca 0.14 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.34 2jm5 h HIS 60 Cb -0.01 -0.11 0.01 0.00 1.06 0.00 0.00 27.41 28.36 2jm5 h HIS 60 CO -0.07 0.20 -0.26 -0.07 0.86 0.00 0.00 177.93 178.58 2jm5 h LEU 61 N 0.42 -0.62 -0.98 2.43 3.38 -1.19 -1.34 115.31 117.40 2jm5 h LEU 61 Ca 0.18 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.23 2jm5 h LEU 61 Cb 0.09 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 2jm5 h LEU 61 CO -0.13 -0.37 0.64 0.11 0.09 0.00 0.00 178.44 178.78 2jm5 h LYS 62 N -0.89 1.14 0.25 1.13 1.57 -0.57 0.86 116.57 120.06 2jm5 h LYS 62 Ca -0.08 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 2jm5 h LYS 62 Cb 0.56 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2jm5 h LYS 62 CO 0.12 0.76 -0.12 0.00 -0.57 0.00 0.00 179.45 179.64 2jm5 h ALA 63 N 1.43 -0.33 0.00 3.86 0.00 -0.72 -1.49 119.26 122.01 2jm5 h ALA 63 Ca 0.41 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 2jm5 h ALA 63 Cb 0.12 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2jm5 h ALA 63 CO -0.16 -0.62 -0.21 0.87 0.00 0.00 0.00 179.25 179.14 2jm5 h LYS 64 N -0.47 0.00 0.04 0.00 1.57 -1.01 0.32 116.57 117.01 2jm5 h LYS 64 Ca -0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2jm5 h LYS 64 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2jm5 h LYS 64 CO 0.06 0.21 -0.02 0.00 -0.57 0.00 0.00 179.45 179.13 2jm5 h ALA 65 N 1.79 -0.05 -0.37 3.86 0.00 -0.61 -0.49 119.26 123.39 2jm5 h ALA 65 Ca -0.00 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2jm5 h ALA 65 Cb 0.42 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2jm5 h ALA 65 CO 0.03 -0.41 -0.25 0.82 0.00 0.00 0.00 179.25 179.44 2jm5 h ILE 66 N -0.28 1.27 0.53 0.00 2.04 -0.71 -2.20 117.51 118.16 2jm5 h ILE 66 Ca -0.01 -1.36 -0.02 0.00 1.00 0.00 0.00 64.86 64.47 2jm5 h ILE 66 Cb 0.26 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 2jm5 h ILE 66 CO 0.01 0.45 -0.47 0.22 0.00 0.00 0.00 178.15 178.36 2jm5 h TYR 67 N 0.65 -1.29 0.00 1.37 3.20 -0.33 0.56 116.97 121.13 2jm5 h TYR 67 Ca 0.09 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 2jm5 h TYR 67 Cb 0.76 0.49 -0.00 0.00 1.54 0.00 0.00 36.73 39.52 2jm5 h TYR 67 CO 0.04 -0.64 -0.03 0.93 -1.64 0.00 0.00 178.16 176.83 2jm5 h GLU 68 N -0.98 0.00 0.00 1.82 5.08 -1.04 0.81 114.58 120.27 2jm5 h GLU 68 Ca -0.07 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.10 2jm5 h GLU 68 Cb 0.83 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 2jm5 h GLU 68 CO -0.03 0.03 -1.49 1.17 -1.00 0.00 0.00 179.01 177.69 2jm5 n LYS 69 N -3.14 0.62 0.07 2.33 4.81 -0.83 -4.32 118.16 117.69 2jm5 n LYS 69 Ca -0.00 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 2jm5 n LYS 69 Cb 0.28 -1.80 0.00 0.00 0.02 0.00 0.00 35.03 33.53 2jm5 n LYS 69 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2jm5 n PHE 70 N -2.92 -0.88 0.27 5.64 3.72 0.17 -2.32 117.46 121.15 2jm5 n PHE 70 Ca -0.11 0.16 0.13 0.00 -0.05 0.00 0.00 57.45 57.57 2jm5 n PHE 70 Cb 0.89 0.29 0.78 0.00 -0.94 0.00 0.00 39.48 40.49 2jm5 n PHE 70 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2jm5 h ILE 71 N 0.00 0.63 -4.08 4.37 1.08 -0.84 0.29 117.51 118.97 2jm5 h ILE 71 Ca 0.00 -0.30 -0.48 0.00 -0.39 0.00 0.00 64.86 63.68 2jm5 h ILE 71 Cb 0.17 1.19 0.04 0.00 -3.07 0.00 0.00 36.82 35.16 2jm5 h ILE 71 CO 0.00 0.07 0.40 -1.10 -0.69 0.00 0.00 178.15 176.84 2jm5 s GLN 72 N -4.46 3.62 -0.15 2.37 -1.52 -0.21 -4.83 119.66 114.48 2jm5 s GLN 72 Ca -0.04 1.46 -0.24 0.00 -1.95 0.00 0.00 55.36 54.59 2jm5 s GLN 72 Cb 0.14 -2.06 -0.25 0.00 -0.22 0.00 0.00 33.01 30.63 2jm5 s GLN 72 CO 0.59 -0.60 0.59 1.15 -0.25 0.00 0.00 175.29 176.77 2jm5 h THR 73 N 1.42 1.41 -1.27 -0.19 2.02 -1.91 -3.37 112.91 111.01 2jm5 h THR 73 Ca -0.50 -2.33 -0.70 0.00 0.77 0.00 0.00 66.41 63.66 2jm5 h THR 73 Cb 1.24 2.94 -0.11 0.00 -1.74 0.00 0.00 68.15 70.48 2jm5 h THR 73 CO 0.58 0.55 1.94 -0.62 0.37 0.00 0.00 175.52 178.34 2jm5 s ASP 74 N -6.60 6.91 0.05 4.18 2.15 -1.26 -4.75 116.67 117.36 2jm5 s ASP 74 Ca -0.21 -2.62 -0.01 0.00 0.43 0.00 0.00 52.55 50.14 2jm5 s ASP 74 Cb 0.01 -2.52 -0.04 0.00 -0.30 0.00 0.00 42.92 40.07 2jm5 s ASP 74 CO 0.69 -1.04 -0.02 0.00 -0.17 0.00 0.00 175.17 174.62 2jm5 s ALA 75 N 3.41 0.47 0.20 3.66 0.00 -1.26 -4.94 121.76 123.30 2jm5 s ALA 75 Ca 0.51 -1.17 0.36 0.00 0.00 0.00 0.00 51.96 51.66 2jm5 s ALA 75 Cb 0.02 0.27 1.55 0.00 0.00 0.00 0.00 23.12 24.96 2jm5 s ALA 75 CO 0.06 -0.36 2.05 -1.00 0.00 0.00 0.00 175.76 176.50 2jm5 h PRO 76 N 3.21 0.00 0.00 0.00 0.13 -1.75 -3.36 132.00 130.22 2jm5 h PRO 76 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2jm5 h PRO 76 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2jm5 h PRO 76 CO 0.65 0.00 -0.09 1.63 -0.23 0.00 0.00 178.00 179.96 2jm5 n LYS 77 N -3.10 0.05 -1.14 0.86 4.76 -1.08 -5.11 118.16 113.40 2jm5 n LYS 77 Ca -0.00 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 2jm5 n LYS 77 Cb 0.27 -0.55 0.00 0.00 -1.84 0.00 0.00 35.03 32.90 2jm5 n LYS 77 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2jm5 n GLU 78 N -3.52 -2.88 -3.86 1.97 2.13 -0.98 -5.02 120.64 108.48 2jm5 n GLU 78 Ca -0.01 2.16 -0.28 0.00 0.66 0.00 0.00 57.16 59.68 2jm5 n GLU 78 Cb 0.05 -2.24 -0.03 0.00 0.27 0.00 0.00 31.44 29.48 2jm5 n GLU 78 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2jm5 s VAL 79 N -1.00 5.30 -0.23 6.31 1.01 0.09 -4.97 120.40 126.92 2jm5 s VAL 79 Ca 0.00 -0.47 -0.00 0.00 0.00 0.00 0.00 61.98 61.51 2jm5 s VAL 79 Cb 0.00 -3.70 0.19 0.00 0.00 0.00 0.00 36.38 32.87 2jm5 s VAL 79 CO 0.00 -0.03 1.82 0.59 0.00 0.00 0.00 175.10 177.48 2jm5 n ASN 80 N -0.28 5.38 -4.77 3.32 5.03 -1.26 -4.95 115.26 117.74 2jm5 n ASN 80 Ca -0.05 -2.83 -0.39 0.00 0.87 0.00 0.00 54.58 52.17 2jm5 n ASN 80 Cb 0.53 -0.94 -0.03 0.00 -1.02 0.00 0.00 39.78 38.32 2jm5 n ASN 80 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2jm5 s LEU 81 N -1.38 4.29 -0.08 3.41 2.96 -1.26 -4.94 118.68 121.69 2jm5 s LEU 81 Ca 0.24 2.37 -0.38 0.00 -0.22 0.00 0.00 54.13 56.13 2jm5 s LEU 81 Cb 0.19 -3.90 -0.16 0.00 0.50 0.00 0.00 46.19 42.82 2jm5 s LEU 81 CO 0.01 -0.54 1.53 -0.67 -1.32 0.00 0.00 176.35 175.35 2jm5 n ASP 82 N 0.39 2.00 -0.34 3.68 2.03 -1.26 -4.85 116.55 118.21 2jm5 n ASP 82 Ca 0.03 1.10 0.03 0.00 0.52 0.00 0.00 54.79 56.46 2jm5 n ASP 82 Cb 0.46 -1.17 0.17 0.00 -0.72 0.00 0.00 41.12 39.86 2jm5 n ASP 82 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2jm5 h PHE 83 N 5.80 1.07 -0.45 -0.67 3.57 -1.98 -0.67 116.94 123.60 2jm5 h PHE 83 Ca -0.47 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 60.95 2jm5 h PHE 83 Cb 1.33 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 2jm5 h PHE 83 CO 0.68 0.51 -0.16 1.25 -2.23 0.00 0.00 178.31 178.36 2jm5 h HIS 84 N 1.01 0.97 0.32 0.41 2.76 -1.99 0.62 115.15 119.26 2jm5 h HIS 84 Ca 0.42 -0.20 -0.02 0.00 -2.20 0.00 0.00 60.37 58.37 2jm5 h HIS 84 Cb 0.26 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 28.99 2jm5 h HIS 84 CO -0.02 0.96 -0.15 1.15 -1.30 0.00 0.00 177.93 178.56 2jm5 h THR 85 N 0.77 0.70 -0.21 6.26 2.02 -1.76 -2.35 112.91 118.34 2jm5 h THR 85 Ca 0.12 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 2jm5 h THR 85 Cb 0.68 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 2jm5 h THR 85 CO 0.05 0.05 -0.00 0.07 0.37 0.00 0.00 175.52 176.06 2jm5 h LYS 86 N -0.57 0.30 0.14 6.66 2.10 -1.04 -1.20 116.57 122.96 2jm5 h LYS 86 Ca -0.04 -0.05 0.01 0.00 -2.00 0.00 0.00 60.65 58.57 2jm5 h LYS 86 Cb 0.42 -0.05 -0.02 0.00 -0.90 0.00 0.00 32.23 31.68 2jm5 h LYS 86 CO 0.07 0.33 -0.19 1.49 -2.00 0.00 0.00 179.45 179.16 2jm5 h GLU 87 N 0.30 -0.37 -0.48 0.07 4.81 -0.72 0.32 114.58 118.52 2jm5 h GLU 87 Ca 0.07 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2jm5 h GLU 87 Cb 0.21 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2jm5 h GLU 87 CO 0.00 -0.24 0.11 0.28 -0.73 0.00 0.00 179.01 178.43 2jm5 h VAL 88 N -0.38 1.21 0.04 0.32 2.07 -0.83 -2.02 116.25 116.66 2jm5 h VAL 88 Ca 0.01 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 2jm5 h VAL 88 Cb 0.38 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2jm5 h VAL 88 CO -0.08 0.28 -0.02 0.40 0.02 0.00 0.00 177.57 178.17 2jm5 h ILE 89 N 0.70 1.05 -0.15 4.57 2.04 -0.71 -0.95 117.51 124.05 2jm5 h ILE 89 Ca 0.16 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.77 2jm5 h ILE 89 Cb 0.27 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2jm5 h ILE 89 CO -0.00 0.07 0.11 0.71 0.00 0.00 0.00 178.15 179.04 2jm5 h THR 90 N -0.18 0.93 0.00 -0.27 1.35 0.15 0.28 112.91 115.17 2jm5 h THR 90 Ca -0.01 -0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 65.76 2jm5 h THR 90 Cb 0.16 0.92 -0.02 0.00 -1.73 0.00 0.00 68.15 67.49 2jm5 h THR 90 CO 0.01 0.00 -0.95 0.78 -0.25 0.00 0.00 175.52 175.11 2jm5 h ASN 91 N 0.01 0.00 -0.05 5.36 2.35 -1.10 -3.37 115.58 118.78 2jm5 h ASN 91 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2jm5 h ASN 91 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2jm5 h ASN 91 CO -0.00 0.36 0.00 -0.24 -1.65 0.00 0.00 177.43 175.90 2jm5 n SER 92 N -2.94 2.22 0.22 5.81 2.88 -0.39 -4.52 113.62 116.90 2jm5 n SER 92 Ca -0.03 -2.19 0.11 0.00 -1.33 0.00 0.00 58.87 55.43 2jm5 n SER 92 Cb 0.71 -0.11 0.36 0.00 -0.75 0.00 0.00 64.21 64.42 2jm5 n SER 92 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 2jm5 h ILE 93 N 0.29 0.28 0.00 2.46 6.09 -0.63 -1.37 117.51 124.63 2jm5 h ILE 93 Ca 0.00 -1.10 -0.02 0.00 -1.37 0.00 0.00 64.86 62.37 2jm5 h ILE 93 Cb 0.63 1.88 -0.00 0.00 0.47 0.00 0.00 36.82 39.80 2jm5 h ILE 93 CO 0.01 0.14 -0.08 0.00 -3.07 0.00 0.00 178.15 175.14 2jm5 h THR 94 N 0.00 0.91 -2.23 2.19 1.03 -1.83 -3.27 112.91 109.71 2jm5 h THR 94 Ca -0.00 -0.30 -0.59 0.00 -0.01 0.00 0.00 66.41 65.50 2jm5 h THR 94 Cb 0.87 1.17 -0.41 0.00 -1.07 0.00 0.00 68.15 68.71 2jm5 h THR 94 CO 0.02 0.08 -0.71 0.00 -0.01 0.00 0.00 175.52 174.90 2jm5 n GLN 95 N -4.22 2.04 -2.32 0.00 6.02 -0.52 -5.08 117.38 113.29 2jm5 n GLN 95 Ca -0.03 -4.32 -0.34 0.00 -0.01 0.00 0.00 57.00 52.30 2jm5 n GLN 95 Cb 0.17 -2.03 -0.01 0.00 1.02 0.00 0.00 30.24 29.38 2jm5 n GLN 95 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2jm5 s PRO 96 N -2.07 3.53 0.40 -1.09 0.04 -1.22 -4.95 135.00 129.65 2jm5 s PRO 96 Ca 0.38 1.40 0.06 0.00 0.04 0.00 0.00 61.00 62.88 2jm5 s PRO 96 Cb 0.14 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 2jm5 s PRO 96 CO -0.05 -0.66 0.01 0.95 0.04 0.00 0.00 177.00 177.29 2jm5 s THR 97 N -2.04 1.89 0.42 1.26 -4.23 -1.26 -4.86 115.64 106.82 2jm5 s THR 97 Ca 0.68 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.43 2jm5 s THR 97 Cb -0.18 -2.95 0.44 0.00 1.34 0.00 0.00 72.50 71.14 2jm5 s THR 97 CO 0.26 0.00 1.71 0.25 -0.54 0.00 0.00 174.62 176.30 2jm5 h LEU 98 N 1.79 0.34 -5.71 4.79 5.85 -1.95 -2.76 115.31 117.65 2jm5 h LEU 98 Ca -0.44 0.10 -0.37 0.00 0.84 0.00 0.00 57.88 58.02 2jm5 h LEU 98 Cb 1.24 0.06 -0.27 0.00 0.37 0.00 0.00 40.66 42.06 2jm5 h LEU 98 CO 0.80 -0.03 -0.73 -1.38 -0.34 0.00 0.00 178.44 176.75 2jm5 s HIS 99 N -5.38 -0.29 -0.99 1.25 -3.43 -1.26 -2.91 115.29 102.28 2jm5 s HIS 99 Ca -0.08 -1.41 0.06 0.00 -0.80 0.00 0.00 55.06 52.83 2jm5 s HIS 99 Cb 0.27 -0.29 0.25 0.00 -1.43 0.00 0.00 32.58 31.37 2jm5 s HIS 99 CO 0.81 -1.05 1.18 0.43 -2.00 0.00 0.00 174.74 174.11 2jm5 n SER 100 N 2.97 0.01 -1.34 7.38 7.64 -1.04 -0.47 113.62 128.76 2jm5 n SER 100 Ca 0.23 0.50 0.11 0.00 1.01 0.00 0.00 58.87 60.73 2jm5 n SER 100 Cb 0.52 -0.51 0.32 0.00 -1.01 0.00 0.00 64.21 63.53 2jm5 n SER 100 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2jm5 n PHE 101 N -1.51 1.00 -0.29 1.43 3.72 -1.26 -4.57 117.46 115.98 2jm5 n PHE 101 Ca 0.01 -0.49 0.11 0.00 -0.05 0.00 0.00 57.45 57.04 2jm5 n PHE 101 Cb 0.06 -0.02 0.26 0.00 -0.94 0.00 0.00 39.48 38.84 2jm5 n PHE 101 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 2jm5 h ASP 102 N 4.16 0.02 0.29 4.37 2.03 -1.19 0.42 116.42 126.52 2jm5 h ASP 102 Ca 0.00 0.18 -0.17 0.00 -0.73 0.00 0.00 57.03 56.31 2jm5 h ASP 102 Cb 1.00 0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 39.73 2jm5 h ASP 102 CO 0.02 -0.11 -0.69 0.00 -1.03 0.00 0.00 179.24 177.43 2jm5 h ALA 103 N 1.73 0.67 0.00 4.15 0.00 -1.84 -3.07 119.26 120.90 2jm5 h ALA 103 Ca 0.52 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2jm5 h ALA 103 Cb 0.99 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2jm5 h ALA 103 CO -0.61 0.76 -0.40 0.00 0.00 0.00 0.00 179.25 178.99 2jm5 h ALA 104 N 1.02 0.97 -0.66 0.00 0.00 -1.29 -2.20 119.26 117.10 2jm5 h ALA 104 Ca -0.02 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.54 2jm5 h ALA 104 Cb 1.24 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 2jm5 h ALA 104 CO 0.11 0.50 0.43 0.37 0.00 0.00 0.00 179.25 180.67 2jm5 h GLN 105 N 0.00 0.84 -0.18 0.00 -0.00 -0.18 0.21 115.11 115.80 2jm5 h GLN 105 Ca -0.00 -0.05 -0.16 0.00 -0.00 0.00 0.00 58.65 58.43 2jm5 h GLN 105 Cb 0.94 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 28.23 2jm5 h GLN 105 CO 0.05 0.56 -0.55 0.77 0.00 0.00 0.00 178.83 179.66 2jm5 h SER 106 N 0.87 0.61 -0.15 -0.69 0.02 -1.50 -1.68 113.55 111.03 2jm5 h SER 106 Ca 0.25 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 2jm5 h SER 106 Cb -0.06 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2jm5 h SER 106 CO -0.07 1.04 0.07 0.03 -1.14 0.00 0.00 176.83 176.76 2jm5 h ARG 107 N 0.42 0.22 -0.10 3.45 2.47 -0.76 -0.02 114.38 120.07 2jm5 h ARG 107 Ca 0.01 -0.04 -0.12 0.00 -1.26 0.00 0.00 59.98 58.57 2jm5 h ARG 107 Cb 1.10 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.36 2jm5 h ARG 107 CO 0.10 0.28 -0.49 0.28 0.56 0.00 0.00 179.97 180.71 2jm5 h VAL 108 N 0.11 1.34 0.03 2.04 2.07 -0.99 0.83 116.25 121.68 2jm5 h VAL 108 Ca 0.05 -1.72 0.01 0.00 0.82 0.00 0.00 66.70 65.86 2jm5 h VAL 108 Cb 0.14 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2jm5 h VAL 108 CO -0.01 0.51 -0.07 0.22 0.02 0.00 0.00 177.57 178.25 2jm5 h TYR 109 N 0.20 -0.18 -0.04 1.57 5.03 -0.97 -0.68 116.97 121.90 2jm5 h TYR 109 Ca 0.01 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.21 2jm5 h TYR 109 Cb 0.94 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 39.28 2jm5 h TYR 109 CO 0.02 -0.11 -0.48 -0.56 -1.32 0.00 0.00 178.16 175.71 2jm5 h GLN 110 N -0.13 0.10 0.29 1.82 -0.00 -0.68 -1.24 115.11 115.26 2jm5 h GLN 110 Ca 0.02 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 2jm5 h GLN 110 Cb 0.16 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.61 2jm5 h GLN 110 CO -0.05 0.56 -0.33 -0.07 -0.00 0.00 0.00 178.83 178.94 2jm5 h LEU 111 N 0.08 -0.91 -1.49 0.06 3.38 -0.53 -1.51 115.31 114.39 2jm5 h LEU 111 Ca 0.00 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2jm5 h LEU 111 Cb 0.88 0.31 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2jm5 h LEU 111 CO 0.07 -0.46 -0.25 0.24 0.09 0.00 0.00 178.44 178.12 2jm5 h MET 112 N -0.67 0.00 0.36 1.13 2.86 -0.94 -1.02 114.93 116.65 2jm5 h MET 112 Ca -0.01 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 2jm5 h MET 112 Cb 0.62 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.28 2jm5 h MET 112 CO -0.09 0.25 -0.18 1.49 1.06 0.00 0.00 176.91 179.45 2jm5 h GLU 113 N 0.00 -0.47 0.00 1.72 4.22 -0.91 0.36 114.58 119.50 2jm5 h GLU 113 Ca -0.00 0.03 -0.07 0.00 0.08 0.00 0.00 59.36 59.40 2jm5 h GLU 113 Cb 0.45 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2jm5 h GLU 113 CO 0.03 -0.31 -0.33 -0.56 -2.18 0.00 0.00 179.01 175.66 2jm5 h GLN 114 N -0.55 0.00 0.00 1.92 3.07 -1.23 -1.83 115.11 116.49 2jm5 h GLN 114 Ca -0.05 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.57 2jm5 h GLN 114 Cb 0.38 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.92 2jm5 h GLN 114 CO 0.08 0.33 -0.92 -3.47 0.09 0.00 0.00 178.83 174.94 2jm5 n ASP 115 N -4.02 1.84 -0.10 0.06 -0.08 -0.40 -4.66 116.55 109.18 2jm5 n ASP 115 Ca -0.02 0.53 -0.12 0.00 -1.51 0.00 0.00 54.79 53.67 2jm5 n ASP 115 Cb 0.38 -0.92 -0.14 0.00 2.34 0.00 0.00 41.12 42.79 2jm5 n ASP 115 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2jm5 n SER 116 N -4.52 0.86 -0.17 1.67 7.64 0.26 -4.41 113.62 114.95 2jm5 n SER 116 Ca -0.20 -0.04 -0.04 0.00 1.01 0.00 0.00 58.87 59.60 2jm5 n SER 116 Cb 0.48 0.52 0.16 0.00 -1.01 0.00 0.00 64.21 64.36 2jm5 n SER 116 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2jm5 h TYR 117 N 0.00 0.94 0.57 1.43 3.20 0.47 0.48 116.97 124.07 2jm5 h TYR 117 Ca -0.53 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 61.23 2jm5 h TYR 117 Cb 2.08 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 40.07 2jm5 h TYR 117 CO 0.01 0.77 -0.28 1.79 -1.64 0.00 0.00 178.16 178.80 2jm5 h THR 118 N 0.89 0.42 0.00 1.81 1.35 -1.78 0.10 112.91 115.70 2jm5 h THR 118 Ca 0.20 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 66.01 2jm5 h THR 118 Cb 0.27 0.42 -0.01 0.00 -1.73 0.00 0.00 68.15 67.11 2jm5 h THR 118 CO -0.01 0.00 -0.24 0.08 -0.25 0.00 0.00 175.52 175.10 2jm5 h ARG 119 N -0.78 0.00 -0.73 4.72 0.11 -1.71 -2.02 114.38 113.96 2jm5 h ARG 119 Ca -0.08 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.96 2jm5 h ARG 119 Cb 0.61 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.65 2jm5 h ARG 119 CO 0.12 0.24 0.30 0.35 0.10 0.00 0.00 179.97 181.08 2jm5 h PHE 120 N 0.00 1.11 0.00 4.08 3.57 0.33 0.24 116.94 126.27 2jm5 h PHE 120 Ca -0.00 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 2jm5 h PHE 120 Cb 0.79 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 2jm5 h PHE 120 CO 0.00 0.85 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.74 2jm5 h LEU 121 N 1.05 0.00 -2.47 0.59 3.38 -0.24 -0.66 115.31 116.96 2jm5 h LEU 121 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2jm5 h LEU 121 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2jm5 h LEU 121 CO -0.02 0.12 0.00 1.17 0.09 0.00 0.00 178.44 179.79 2jm5 n LYS 122 N -4.31 2.59 -2.42 1.13 3.00 -0.79 -4.59 118.16 112.78 2jm5 n LYS 122 Ca -0.03 -2.43 -0.33 0.00 -0.00 0.00 0.00 58.31 55.53 2jm5 n LYS 122 Cb 0.19 -1.54 -0.03 0.00 0.00 0.00 0.00 35.03 33.65 2jm5 n LYS 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2jm5 s SER 123 N -1.31 6.51 0.53 3.14 1.04 0.79 -4.88 113.70 119.53 2jm5 s SER 123 Ca 0.43 1.66 0.35 0.00 0.48 0.00 0.00 55.95 58.87 2jm5 s SER 123 Cb 0.24 -2.52 1.56 0.00 0.10 0.00 0.00 66.02 65.39 2jm5 s SER 123 CO 0.33 -0.66 2.03 -2.24 0.98 0.00 0.00 173.24 173.67 2jm5 h ASP 124 N 1.06 0.00 -0.08 7.02 2.03 -1.89 0.24 116.42 124.79 2jm5 h ASP 124 Ca -0.47 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 55.73 2jm5 h ASP 124 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 2jm5 h ASP 124 CO 0.60 0.00 -0.34 -0.29 -1.03 0.00 0.00 179.24 178.19 2jm5 h ILE 125 N 0.00 1.41 -0.03 4.15 -0.00 -1.92 -0.39 117.51 120.74 2jm5 h ILE 125 Ca 0.00 -1.72 -0.20 0.00 -0.00 0.00 0.00 64.86 62.94 2jm5 h ILE 125 Cb 0.36 2.28 -0.00 0.00 -0.00 0.00 0.00 36.82 39.46 2jm5 h ILE 125 CO 0.00 0.50 -0.84 0.22 -0.00 0.00 0.00 178.15 178.02 2jm5 h TYR 126 N -0.10 0.51 0.00 2.19 3.20 -1.62 -2.46 116.97 118.68 2jm5 h TYR 126 Ca -0.02 -0.26 0.00 0.00 3.14 0.00 0.00 58.73 61.59 2jm5 h TYR 126 Cb 0.98 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.19 2jm5 h TYR 126 CO 0.12 1.05 0.00 -0.07 -1.64 0.00 0.00 178.16 177.62 2jm5 h LEU 127 N 0.22 0.00 -0.02 2.82 3.38 -0.56 0.12 115.31 121.26 2jm5 h LEU 127 Ca -0.05 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.67 2jm5 h LEU 127 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 2jm5 h LEU 127 CO 0.14 0.00 -1.10 -0.78 0.09 0.00 0.00 178.44 176.79 2jm5 h ASP 128 N 0.00 0.48 0.29 -0.43 3.58 -0.72 -0.68 116.42 118.95 2jm5 h ASP 128 Ca 0.00 -0.45 -0.08 0.00 0.42 0.00 0.00 57.03 56.92 2jm5 h ASP 128 Cb 0.49 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 2jm5 h ASP 128 CO 0.00 1.30 -0.35 -0.07 -2.88 0.00 0.00 179.24 177.23 2jm5 h LEU 129 N 0.15 0.09 -0.35 2.28 3.38 -0.84 -2.57 115.31 117.46 2jm5 h LEU 129 Ca -0.11 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.66 2jm5 h LEU 129 Cb 1.78 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.50 2jm5 h LEU 129 CO 0.19 0.45 -0.43 0.24 0.09 0.00 0.00 178.44 178.97 2jm5 h MET 130 N 0.08 0.91 -4.86 1.13 2.86 -0.87 -3.39 114.93 110.80 2jm5 h MET 130 Ca 0.01 -0.51 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 2jm5 h MET 130 Cb 0.67 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.36 2jm5 h MET 130 CO 0.05 1.16 -0.75 0.39 1.06 0.00 0.00 176.91 178.82 2jm5 n GLU 131 N -4.06 -2.78 0.00 1.72 1.02 -0.27 -4.96 120.64 111.31 2jm5 n GLU 131 Ca -0.03 2.34 0.00 0.00 -0.02 0.00 0.00 57.16 59.45 2jm5 n GLU 131 Cb 0.57 -4.85 0.00 0.00 -0.02 0.00 0.00 31.44 27.14 2jm5 n GLU 131 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jm5 n GLY 132 N 0.38 -1.91 3.60 0.62 0.00 -1.25 -5.07 105.19 101.56 2jm5 n GLY 132 Ca 0.03 0.54 -0.15 0.00 0.00 0.00 0.00 46.02 46.44 2jm5 n GLY 132 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jm5 s ARG 133 N -0.45 0.87 0.00 1.61 1.70 -1.26 -5.14 118.95 116.28 2jm5 s ARG 133 Ca 0.00 0.80 0.22 0.00 -0.47 0.00 0.00 55.73 56.28 2jm5 s ARG 133 Cb 0.00 0.42 1.31 0.00 -0.57 0.00 0.00 34.95 36.11 2jm5 s ARG 133 CO 0.00 -0.15 1.69 -2.30 -1.08 0.00 0.00 175.30 173.46