#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mm4 s ASN 2 N 0.00 -0.14 0.55 6.12 3.84 -1.26 -5.01 114.94 119.04 1mm4 s ASN 2 Ca 0.00 0.14 0.37 0.00 0.21 0.00 0.00 52.86 53.58 1mm4 s ASN 2 Cb 0.00 0.12 1.95 0.00 -0.55 0.00 0.00 41.25 42.77 1mm4 s ASN 2 CO 0.00 -0.14 2.13 0.00 -2.79 0.00 0.00 177.10 176.29 1mm4 h ALA 3 N 2.19 1.00 0.10 1.71 0.00 -2.04 0.06 119.26 122.28 1mm4 h ALA 3 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1mm4 h ALA 3 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1mm4 h ALA 3 CO 0.25 0.00 -0.05 -0.44 0.00 0.00 0.00 179.25 179.01 1mm4 h ASP 4 N 0.00 -0.12 0.48 0.00 3.32 -1.98 -2.11 116.42 116.01 1mm4 h ASP 4 Ca 0.00 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 56.76 1mm4 h ASP 4 Cb 0.06 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1mm4 h ASP 4 CO 0.00 0.47 -0.20 -0.33 -1.72 0.00 0.00 179.24 177.45 1mm4 h GLU 5 N -1.00 0.00 -0.06 3.56 5.08 -1.90 -0.51 114.58 119.75 1mm4 h GLU 5 Ca -0.01 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.11 1mm4 h GLU 5 Cb 0.36 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.62 1mm4 h GLU 5 CO 0.02 0.20 -0.89 2.35 -1.00 0.00 0.00 179.01 179.70 1mm4 h TRP 6 N 0.00 1.02 0.00 4.33 2.91 -1.08 -3.25 115.95 119.89 1mm4 h TRP 6 Ca -0.00 -0.51 -0.18 0.00 1.13 0.00 0.00 58.89 59.33 1mm4 h TRP 6 Cb 0.50 -0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 29.00 1mm4 h TRP 6 CO 0.00 1.34 -0.84 0.52 -1.03 0.00 0.00 178.44 178.43 1mm4 h MET 7 N 0.41 0.05 -0.07 2.65 2.86 -1.10 -3.16 114.93 116.56 1mm4 h MET 7 Ca -0.09 -0.06 0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1mm4 h MET 7 Cb 1.54 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 33.21 1mm4 h MET 7 CO 0.18 0.86 0.06 1.79 1.06 0.00 0.00 176.91 180.85 1mm4 h THR 8 N 0.03 0.86 -0.59 2.22 1.35 -1.14 -1.43 112.91 114.21 1mm4 h THR 8 Ca -0.02 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.90 1mm4 h THR 8 Cb 1.47 0.96 -0.03 0.00 -1.73 0.00 0.00 68.15 68.81 1mm4 h THR 8 CO 0.11 0.00 0.39 0.71 -0.25 0.00 0.00 175.52 176.49 1mm4 h THR 9 N 0.00 1.01 -0.03 6.82 1.35 -1.58 0.52 112.91 121.01 1mm4 h THR 9 Ca 0.04 -0.20 -0.12 0.00 -0.55 0.00 0.00 66.41 65.58 1mm4 h THR 9 Cb 0.15 0.37 0.01 0.00 -1.73 0.00 0.00 68.15 66.95 1mm4 h THR 9 CO -0.00 0.11 -0.44 -0.26 -0.25 0.00 0.00 175.52 174.68 1mm4 h PHE 10 N 0.59 0.49 -0.45 4.73 -1.00 -1.45 -2.86 116.94 116.99 1mm4 h PHE 10 Ca 0.25 -0.25 -0.03 0.00 2.81 0.00 0.00 57.97 60.76 1mm4 h PHE 10 Cb 0.25 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.73 1mm4 h PHE 10 CO -0.00 1.04 0.16 -0.09 -1.61 0.00 0.00 178.31 177.81 1mm4 h ARG 11 N -0.20 0.64 -0.48 1.51 2.43 -1.36 -2.32 114.38 114.61 1mm4 h ARG 11 Ca -0.05 -0.09 -0.12 0.00 -0.81 0.00 0.00 59.98 58.91 1mm4 h ARG 11 Cb 1.14 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 1mm4 h ARG 11 CO 0.09 0.54 -0.18 0.93 -1.51 0.00 0.00 179.97 179.84 1mm4 h GLU 12 N 0.64 0.94 -0.22 0.20 3.07 -0.95 0.50 114.58 118.77 1mm4 h GLU 12 Ca 0.15 -0.38 -0.01 0.00 -0.50 0.00 0.00 59.36 58.62 1mm4 h GLU 12 Cb 0.15 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 1mm4 h GLU 12 CO -0.01 1.04 0.09 -0.91 -1.40 0.00 0.00 179.01 177.81 1mm4 h ASN 13 N 0.82 0.31 0.49 1.42 4.21 -1.20 0.13 115.58 121.76 1mm4 h ASN 13 Ca 0.12 -0.17 -0.13 0.00 1.21 0.00 0.00 56.30 57.32 1mm4 h ASN 13 Cb 0.74 -0.08 -0.02 0.00 -1.12 0.00 0.00 38.32 37.84 1mm4 h ASN 13 CO 0.06 0.40 -0.58 0.40 -1.29 0.00 0.00 177.43 176.41 1mm4 h ILE 14 N 0.20 1.40 -0.14 2.81 1.08 -1.39 -2.37 117.51 119.10 1mm4 h ILE 14 Ca 0.07 -1.97 -0.20 0.00 -0.39 0.00 0.00 64.86 62.37 1mm4 h ILE 14 Cb 0.19 2.03 0.00 0.00 -3.07 0.00 0.00 36.82 35.97 1mm4 h ILE 14 CO -0.01 0.57 -0.72 0.00 -0.69 0.00 0.00 178.15 177.30 1mm4 h ALA 15 N 1.34 0.47 -0.22 1.87 0.00 -0.67 -2.66 119.26 119.38 1mm4 h ALA 15 Ca -0.00 -0.59 -0.16 0.00 0.00 0.00 0.00 54.91 54.16 1mm4 h ALA 15 Cb 1.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1mm4 h ALA 15 CO 0.08 0.71 -0.52 1.96 0.00 0.00 0.00 179.25 181.48 1mm4 h GLN 16 N 0.44 0.61 -0.09 0.00 4.20 -0.69 -0.42 115.11 119.16 1mm4 h GLN 16 Ca -0.03 -0.37 -0.09 0.00 0.06 0.00 0.00 58.65 58.21 1mm4 h GLN 16 Cb 1.32 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.12 1mm4 h GLN 16 CO 0.14 0.98 -0.36 1.79 -0.67 0.00 0.00 178.83 180.71 1mm4 h THR 17 N 0.48 1.28 0.22 -0.54 1.35 -1.43 0.12 112.91 114.40 1mm4 h THR 17 Ca 0.02 -1.37 -0.34 0.00 -0.55 0.00 0.00 66.41 64.17 1mm4 h THR 17 Cb 1.07 1.62 0.03 0.00 -1.73 0.00 0.00 68.15 69.13 1mm4 h THR 17 CO 0.10 0.41 -1.56 -0.50 -0.25 0.00 0.00 175.52 173.72 1mm4 h TRP 18 N 0.16 0.86 0.16 4.73 4.06 -1.35 -3.37 115.95 121.20 1mm4 h TRP 18 Ca 0.02 -0.63 -0.01 0.00 2.06 0.00 0.00 58.89 60.34 1mm4 h TRP 18 Cb 0.72 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.85 1mm4 h TRP 18 CO 0.01 1.58 -0.07 1.96 -3.56 0.00 0.00 178.44 178.35 1mm4 h GLN 19 N 0.13 -0.20 -5.50 0.49 7.50 -0.99 -3.48 115.11 113.05 1mm4 h GLN 19 Ca -0.28 0.01 -0.29 0.00 0.50 0.00 0.00 58.65 58.60 1mm4 h GLN 19 Cb 2.14 0.05 0.18 0.00 0.05 0.00 0.00 27.48 29.89 1mm4 h GLN 19 CO 0.24 0.23 -0.79 1.04 -1.50 0.00 0.00 178.83 178.05 1mm4 n GLN 20 N -4.95 -4.59 -2.11 1.46 1.13 0.43 -4.90 117.38 103.84 1mm4 n GLN 20 Ca -0.08 0.84 -0.43 0.00 -1.94 0.00 0.00 57.00 55.39 1mm4 n GLN 20 Cb 0.27 -5.78 -0.03 0.00 0.11 0.00 0.00 30.24 24.81 1mm4 n GLN 20 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1mm4 s PRO 21 N -4.90 3.69 -0.07 -1.09 0.04 -1.26 -4.73 135.00 126.67 1mm4 s PRO 21 Ca 0.20 1.56 0.03 0.00 0.04 0.00 0.00 61.00 62.82 1mm4 s PRO 21 Cb -0.03 -4.06 0.09 0.00 0.04 0.00 0.00 34.50 30.54 1mm4 s PRO 21 CO 0.72 -1.42 0.81 -1.91 0.04 0.00 0.00 177.00 175.24 1mm4 n GLU 22 N 7.84 0.29 -3.49 4.56 4.07 -1.26 -5.10 120.64 127.54 1mm4 n GLU 22 Ca 0.19 -0.68 -0.38 0.00 -0.06 0.00 0.00 57.16 56.24 1mm4 n GLU 22 Cb 0.46 0.42 -0.06 0.00 -0.06 0.00 0.00 31.44 32.20 1mm4 n GLU 22 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 1mm4 s HIS 23 N 0.03 3.61 -0.29 4.31 3.76 -1.26 -4.63 115.29 120.82 1mm4 s HIS 23 Ca 0.02 0.85 -0.05 0.00 -0.15 0.00 0.00 55.06 55.73 1mm4 s HIS 23 Cb 0.10 -2.34 0.02 0.00 1.11 0.00 0.00 32.58 31.47 1mm4 s HIS 23 CO -0.03 0.45 0.03 0.71 -0.85 0.00 0.00 174.74 175.05 1mm4 s TYR 24 N -0.33 3.15 -0.14 1.40 2.02 -1.01 -4.13 117.35 118.30 1mm4 s TYR 24 Ca 0.22 -1.29 -0.05 0.00 -0.37 0.00 0.00 57.07 55.58 1mm4 s TYR 24 Cb -0.15 -2.18 -0.04 0.00 -0.40 0.00 0.00 41.96 39.19 1mm4 s TYR 24 CO 0.10 -0.66 0.03 0.34 -1.57 0.00 0.00 175.55 173.79 1mm4 s ASP 25 N 1.41 5.45 -0.12 2.29 3.68 -0.20 -0.89 116.67 128.29 1mm4 s ASP 25 Ca 0.01 0.12 -0.04 0.00 2.13 0.00 0.00 52.55 54.76 1mm4 s ASP 25 Cb -0.17 -1.77 -0.04 0.00 -1.45 0.00 0.00 42.92 39.49 1mm4 s ASP 25 CO 0.00 0.27 0.05 -0.76 0.13 0.00 0.00 175.17 174.87 1mm4 s LEU 26 N -0.24 3.85 -0.17 -1.34 1.02 -1.07 -0.58 118.68 120.14 1mm4 s LEU 26 Ca 0.07 0.22 0.01 0.00 0.02 0.00 0.00 54.13 54.45 1mm4 s LEU 26 Cb -0.12 -1.92 0.02 0.00 0.02 0.00 0.00 46.19 44.19 1mm4 s LEU 26 CO 0.02 0.34 -0.20 -0.31 0.02 0.00 0.00 176.35 176.22 1mm4 s TYR 27 N -0.64 2.77 -0.04 0.29 1.51 0.35 -2.57 117.35 119.03 1mm4 s TYR 27 Ca 0.11 -1.54 -0.01 0.00 -1.01 0.00 0.00 57.07 54.62 1mm4 s TYR 27 Cb -0.12 -1.91 0.03 0.00 -0.11 0.00 0.00 41.96 39.86 1mm4 s TYR 27 CO 0.02 -0.75 0.06 -1.50 -1.11 0.00 0.00 175.55 172.27 1mm4 s ILE 28 N 1.20 -0.09 -0.07 2.71 2.07 -0.50 -1.90 121.20 124.61 1mm4 s ILE 28 Ca 0.03 0.28 -0.30 0.00 -1.41 0.00 0.00 60.65 59.25 1mm4 s ILE 28 Cb -0.14 -0.13 -0.04 0.00 0.13 0.00 0.00 42.46 42.28 1mm4 s ILE 28 CO -0.10 0.12 1.45 -2.16 -1.91 0.00 0.00 174.94 172.33 1mm4 s PRO 29 N 1.47 4.23 0.29 3.50 0.04 -1.26 -2.58 135.00 140.69 1mm4 s PRO 29 Ca -0.04 1.95 -0.24 0.00 0.04 0.00 0.00 61.00 62.70 1mm4 s PRO 29 Cb -0.12 -3.78 -0.09 0.00 0.04 0.00 0.00 34.50 30.54 1mm4 s PRO 29 CO -0.04 -0.71 0.88 0.00 0.04 0.00 0.00 177.00 177.17 1mm4 s ALA 30 N 3.33 3.28 -0.07 8.56 0.00 -1.26 -4.96 121.76 130.65 1mm4 s ALA 30 Ca 0.64 0.42 -0.05 0.00 0.00 0.00 0.00 51.96 52.97 1mm4 s ALA 30 Cb -0.29 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1mm4 s ALA 30 CO 0.24 0.22 0.17 0.96 0.00 0.00 0.00 175.76 177.35 1mm4 s ILE 31 N -1.57 5.47 -0.10 0.00 -4.36 -1.26 -4.99 121.20 114.38 1mm4 s ILE 31 Ca 0.48 0.05 -0.01 0.00 -0.26 0.00 0.00 60.65 60.90 1mm4 s ILE 31 Cb -0.18 -3.47 0.03 0.00 1.25 0.00 0.00 42.46 40.09 1mm4 s ILE 31 CO 0.23 0.48 -0.02 0.42 0.24 0.00 0.00 174.94 176.29 1mm4 s THR 32 N -1.17 0.61 0.06 8.37 -4.23 -1.26 -5.01 115.64 113.00 1mm4 s THR 32 Ca 0.21 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.62 1mm4 s THR 32 Cb -0.12 -0.77 0.00 0.00 1.34 0.00 0.00 72.50 72.95 1mm4 s THR 32 CO 0.11 0.24 0.00 1.87 -0.54 0.00 0.00 174.62 176.30 1mm4 n TRP 33 N 5.07 -4.73 -4.65 3.99 -0.00 -1.26 -5.04 117.44 110.81 1mm4 n TRP 33 Ca -0.09 2.82 -0.26 0.00 -0.00 0.00 0.00 57.50 59.97 1mm4 n TRP 33 Cb 0.50 -3.77 -0.14 0.00 -0.00 0.00 0.00 31.31 27.89 1mm4 n TRP 33 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 1mm4 s HIS 34 N -0.57 1.94 0.38 5.87 -3.43 -1.26 -5.07 115.29 113.15 1mm4 s HIS 34 Ca 0.00 -0.39 0.00 0.00 -0.80 0.00 0.00 55.06 53.87 1mm4 s HIS 34 Cb 0.00 -1.14 0.00 0.00 -1.43 0.00 0.00 32.58 30.01 1mm4 s HIS 34 CO 0.00 0.12 0.00 0.00 -2.00 0.00 0.00 174.74 172.86 1mm4 n ALA 35 N 1.72 -3.63 -0.18 -1.38 0.00 -1.26 -4.81 120.51 110.97 1mm4 n ALA 35 Ca -0.17 0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1mm4 n ALA 35 Cb 0.53 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1mm4 n ALA 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mm4 n ARG 36 N -4.19 0.00 0.00 0.00 1.74 -1.26 -5.05 116.66 107.90 1mm4 n ARG 36 Ca -0.01 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 1mm4 n ARG 36 Cb 0.65 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 31.34 1mm4 n ARG 36 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1mm4 n PHE 37 N -1.93 -0.91 -3.77 -1.55 -1.74 -1.26 -5.14 117.46 101.16 1mm4 n PHE 37 Ca 0.00 0.00 -0.35 0.00 -0.56 0.00 0.00 57.45 56.54 1mm4 n PHE 37 Cb 0.00 0.18 -0.05 0.00 1.52 0.00 0.00 39.48 41.13 1mm4 n PHE 37 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1mm4 s ALA 38 N -1.85 3.85 -0.23 1.98 0.00 -1.26 -5.09 121.76 119.16 1mm4 s ALA 38 Ca 0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 51.96 51.35 1mm4 s ALA 38 Cb 0.00 -2.06 0.01 0.00 0.00 0.00 0.00 23.12 21.07 1mm4 s ALA 38 CO 0.00 0.64 -0.05 0.71 0.00 0.00 0.00 175.76 177.06 1mm4 s TYR 39 N -1.24 3.00 1.06 0.00 2.02 -1.26 -5.11 117.35 115.82 1mm4 s TYR 39 Ca 0.25 -1.21 -0.12 0.00 -0.37 0.00 0.00 57.07 55.63 1mm4 s TYR 39 Cb -0.13 -2.09 0.23 0.00 -0.40 0.00 0.00 41.96 39.56 1mm4 s TYR 39 CO 0.14 -0.63 1.07 0.34 -1.57 0.00 0.00 175.55 174.90 1mm4 s ASP 40 N 1.41 1.79 0.36 2.29 3.68 -1.26 -4.91 116.67 120.04 1mm4 s ASP 40 Ca 0.04 1.78 0.09 0.00 2.13 0.00 0.00 52.55 56.59 1mm4 s ASP 40 Cb -0.15 -2.41 0.69 0.00 -1.45 0.00 0.00 42.92 39.60 1mm4 s ASP 40 CO -0.04 -3.74 1.85 0.11 0.13 0.00 0.00 175.17 173.48 1mm4 h LYS 41 N -2.30 0.20 0.00 4.34 1.57 -2.05 -3.45 116.57 114.88 1mm4 h LYS 41 Ca -0.54 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.18 1mm4 h LYS 41 Cb 1.31 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1mm4 h LYS 41 CO 0.47 0.44 0.00 0.39 -0.57 0.00 0.00 179.45 180.18 1mm4 n GLU 42 N -4.19 0.00 -1.70 3.15 1.02 -1.26 -5.10 120.64 112.56 1mm4 n GLU 42 Ca -0.01 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1mm4 n GLU 42 Cb 0.34 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.73 1mm4 n GLU 42 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1mm4 s LYS 43 N -1.65 4.14 0.37 3.49 2.47 -1.26 -4.97 119.74 122.33 1mm4 s LYS 43 Ca 0.00 2.58 0.01 0.00 -1.56 0.00 0.00 55.97 57.00 1mm4 s LYS 43 Cb 0.00 -4.04 -0.00 0.00 -1.46 0.00 0.00 37.83 32.32 1mm4 s LYS 43 CO 0.00 -0.93 0.04 0.25 0.16 0.00 0.00 175.35 174.87 1mm4 n THR 44 N 5.39 0.00 -2.53 3.43 -2.24 -1.26 -4.55 114.28 112.52 1mm4 n THR 44 Ca 0.19 -1.85 0.01 0.00 -2.27 0.00 0.00 64.05 60.13 1mm4 n THR 44 Cb 0.41 0.47 0.05 0.00 -2.10 0.00 0.00 70.33 69.15 1mm4 n THR 44 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1mm4 n ASP 45 N -1.37 1.55 -3.93 3.42 8.00 -1.26 -5.08 116.55 117.87 1mm4 n ASP 45 Ca -0.12 -2.28 -0.09 0.00 0.71 0.00 0.00 54.79 53.01 1mm4 n ASP 45 Cb 0.49 -0.39 -0.09 0.00 -0.02 0.00 0.00 41.12 41.11 1mm4 n ASP 45 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1mm4 s ARG 46 N -2.01 0.66 0.08 -1.24 6.06 -1.26 -5.15 118.95 116.08 1mm4 s ARG 46 Ca 0.33 -0.86 0.06 0.00 -2.50 0.00 0.00 55.73 52.75 1mm4 s ARG 46 Cb 0.36 0.26 -0.04 0.00 0.06 0.00 0.00 34.95 35.59 1mm4 s ARG 46 CO -0.10 -0.17 -0.07 0.71 -2.50 0.00 0.00 175.30 173.18 1mm4 s TYR 47 N -3.09 2.84 0.69 5.12 1.51 -1.26 -5.13 117.35 118.04 1mm4 s TYR 47 Ca -0.01 -0.09 -0.10 0.00 -1.01 0.00 0.00 57.07 55.86 1mm4 s TYR 47 Cb 0.02 -1.50 0.03 0.00 -0.11 0.00 0.00 41.96 40.39 1mm4 s TYR 47 CO -0.07 0.43 1.06 -0.80 -1.11 0.00 0.00 175.55 175.05 1mm4 s ASN 48 N -2.04 5.27 -0.53 2.29 -0.87 -1.26 -5.02 114.94 112.79 1mm4 s ASN 48 Ca 0.21 0.91 -0.22 0.00 -1.57 0.00 0.00 52.86 52.19 1mm4 s ASN 48 Cb -0.11 -1.69 0.05 0.00 -0.02 0.00 0.00 41.25 39.48 1mm4 s ASN 48 CO 0.13 -1.39 0.81 -0.70 -2.57 0.00 0.00 177.10 173.38 1mm4 s GLU 49 N -5.30 3.26 0.80 -0.60 2.12 -1.26 -5.04 118.70 112.68 1mm4 s GLU 49 Ca 0.58 -0.49 -0.11 0.00 0.36 0.00 0.00 54.97 55.32 1mm4 s GLU 49 Cb -0.11 -4.06 0.07 0.00 0.26 0.00 0.00 34.13 30.30 1mm4 s GLU 49 CO 0.49 -1.35 1.09 1.03 -0.54 0.00 0.00 175.26 175.98 1mm4 s ARG 50 N 3.40 2.01 0.06 4.30 1.81 -1.26 -4.92 118.95 124.35 1mm4 s ARG 50 Ca 0.25 1.08 -0.36 0.00 -1.72 0.00 0.00 55.73 54.98 1mm4 s ARG 50 Cb -0.15 -1.88 -0.15 0.00 -0.45 0.00 0.00 34.95 32.33 1mm4 s ARG 50 CO 0.17 -1.79 1.54 -2.30 -0.68 0.00 0.00 175.30 172.24 1mm4 n PRO 51 N -3.61 1.70 -0.78 3.54 -0.02 -1.26 -4.89 135.00 129.68 1mm4 n PRO 51 Ca 0.09 0.62 -0.03 0.00 -2.02 0.00 0.00 63.50 62.15 1mm4 n PRO 51 Cb 0.54 -2.34 0.20 0.00 -0.02 0.00 0.00 33.50 31.88 1mm4 n PRO 51 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1mm4 n TRP 52 N 3.66 1.01 0.00 6.00 -0.00 -1.26 -4.60 117.44 122.25 1mm4 n TRP 52 Ca 0.19 -1.57 0.00 0.00 -0.00 0.00 0.00 57.50 56.12 1mm4 n TRP 52 Cb 0.24 -0.47 0.00 0.00 -0.00 0.00 0.00 31.31 31.08 1mm4 n TRP 52 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1mm4 n GLY 53 N -1.10 2.12 0.00 5.87 0.00 -1.25 -4.67 105.19 106.17 1mm4 n GLY 53 Ca 0.32 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.70 1mm4 n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm4 n GLY 54 N 0.00 0.95 3.71 -0.02 0.00 -1.07 -5.02 105.19 103.75 1mm4 n GLY 54 Ca 0.00 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 1mm4 n GLY 54 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mm4 s GLY 55 N 0.00 1.95 0.27 -0.02 0.00 -0.80 -2.28 107.32 106.44 1mm4 s GLY 55 Ca 0.00 -1.08 0.02 0.00 0.00 0.00 0.00 44.72 43.66 1mm4 s GLY 55 CO 0.00 -1.06 0.09 -1.36 0.00 0.00 0.00 173.10 170.77 1mm4 s PHE 56 N -1.33 1.60 -0.18 1.90 0.08 0.40 -0.50 117.98 119.96 1mm4 s PHE 56 Ca 0.27 -1.13 -0.28 0.00 0.12 0.00 0.00 56.93 55.91 1mm4 s PHE 56 Cb -0.12 -0.96 0.07 0.00 -0.57 0.00 0.00 43.02 41.44 1mm4 s PHE 56 CO 0.19 -0.27 0.72 0.20 -0.10 0.00 0.00 175.22 175.96 1mm4 s GLY 57 N -3.34 -0.54 0.19 4.36 0.00 0.25 -2.56 107.32 105.68 1mm4 s GLY 57 Ca 0.37 1.75 0.08 0.00 0.00 0.00 0.00 44.72 46.93 1mm4 s GLY 57 CO 0.14 1.41 -0.02 -2.27 0.00 0.00 0.00 173.10 172.36 1mm4 s LEU 58 N -0.30 3.23 -0.05 0.66 2.96 -1.03 -1.04 118.68 123.12 1mm4 s LEU 58 Ca -0.04 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.39 1mm4 s LEU 58 Cb -0.03 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 1mm4 s LEU 58 CO 0.05 0.07 -0.03 -0.55 -1.32 0.00 0.00 176.35 174.57 1mm4 s SER 59 N -3.07 4.92 -0.15 3.68 0.15 -1.26 -2.59 113.70 115.38 1mm4 s SER 59 Ca 0.28 0.02 -0.05 0.00 0.70 0.00 0.00 55.95 56.90 1mm4 s SER 59 Cb -0.09 -1.28 0.07 0.00 -1.71 0.00 0.00 66.02 63.01 1mm4 s SER 59 CO 0.18 0.34 0.27 -0.13 1.20 0.00 0.00 173.24 175.11 1mm4 s ARG 60 N -1.06 0.17 -0.03 5.44 0.52 0.42 -4.77 118.95 119.64 1mm4 s ARG 60 Ca 0.15 0.69 -0.17 0.00 -0.52 0.00 0.00 55.73 55.87 1mm4 s ARG 60 Cb -0.11 -0.18 -0.05 0.00 0.52 0.00 0.00 34.95 35.13 1mm4 s ARG 60 CO 0.04 -0.35 0.47 -1.58 0.02 0.00 0.00 175.30 173.90 1mm4 s TRP 61 N 2.43 3.66 -0.22 -0.53 0.52 -1.26 -0.89 118.94 122.64 1mm4 s TRP 61 Ca 0.02 1.01 -0.06 0.00 0.02 0.00 0.00 56.10 57.09 1mm4 s TRP 61 Cb -0.13 -2.44 -0.02 0.00 -1.15 0.00 0.00 33.47 29.73 1mm4 s TRP 61 CO -0.10 0.44 0.03 0.34 0.02 0.00 0.00 176.95 177.68 1mm4 s ASP 62 N -0.39 4.93 0.64 2.95 2.15 0.02 -4.96 116.67 122.02 1mm4 s ASP 62 Ca 0.26 -0.21 0.33 0.00 0.43 0.00 0.00 52.55 53.35 1mm4 s ASP 62 Cb -0.17 -1.86 1.81 0.00 -0.30 0.00 0.00 42.92 42.40 1mm4 s ASP 62 CO 0.13 0.02 2.06 -0.33 -0.17 0.00 0.00 175.17 176.88 1mm4 h GLU 63 N 7.85 0.00 -0.90 4.34 5.08 -1.98 0.10 114.58 129.07 1mm4 h GLU 63 Ca -0.38 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.79 1mm4 h GLU 63 Cb 1.17 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.31 1mm4 h GLU 63 CO 0.60 0.00 0.25 1.17 -1.00 0.00 0.00 179.01 180.03 1mm4 n LYS 64 N -3.22 2.42 -2.93 2.33 4.81 -1.26 -4.87 118.16 115.44 1mm4 n LYS 64 Ca -0.00 -1.90 -0.11 0.00 -0.87 0.00 0.00 58.31 55.42 1mm4 n LYS 64 Cb 0.32 -1.83 0.06 0.00 0.02 0.00 0.00 35.03 33.60 1mm4 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mm4 n GLY 65 N -0.17 -0.20 3.19 3.14 0.00 0.33 -5.05 105.19 106.43 1mm4 n GLY 65 Ca 0.29 0.01 -0.15 0.00 0.00 0.00 0.00 46.02 46.17 1mm4 n GLY 65 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1mm4 s ASN 66 N -3.80 1.59 -0.21 1.61 3.84 -1.08 -4.85 114.94 112.05 1mm4 s ASN 66 Ca 0.07 -0.79 0.02 0.00 0.21 0.00 0.00 52.86 52.36 1mm4 s ASN 66 Cb -0.01 -0.01 0.04 0.00 -0.55 0.00 0.00 41.25 40.72 1mm4 s ASN 66 CO 0.51 -0.22 -0.14 0.26 -2.79 0.00 0.00 177.10 174.72 1mm4 s TRP 67 N -2.26 2.79 -0.13 0.43 0.52 -1.00 -0.80 118.94 118.49 1mm4 s TRP 67 Ca 0.05 -1.81 -0.02 0.00 0.02 0.00 0.00 56.10 54.34 1mm4 s TRP 67 Cb -0.04 -1.82 -0.03 0.00 -1.15 0.00 0.00 33.47 30.43 1mm4 s TRP 67 CO 0.01 -0.80 -0.06 -1.01 0.02 0.00 0.00 176.95 175.11 1mm4 s HIS 68 N 1.27 2.97 -0.03 -1.98 3.76 -0.07 -0.66 115.29 120.56 1mm4 s HIS 68 Ca -0.01 -0.26 -0.00 0.00 -0.15 0.00 0.00 55.06 54.64 1mm4 s HIS 68 Cb -0.16 -1.88 0.03 0.00 1.11 0.00 0.00 32.58 31.68 1mm4 s HIS 68 CO -0.09 0.04 0.01 0.20 -0.85 0.00 0.00 174.74 174.05 1mm4 s GLY 69 N 0.04 0.24 0.38 -2.22 0.00 -0.67 -0.44 107.32 104.66 1mm4 s GLY 69 Ca -0.01 0.15 -0.11 0.00 0.00 0.00 0.00 44.72 44.75 1mm4 s GLY 69 CO 0.03 0.78 0.76 1.08 0.00 0.00 0.00 173.10 175.75 1mm4 s LEU 70 N 1.30 3.88 -0.15 0.66 1.43 -1.07 -1.87 118.68 122.86 1mm4 s LEU 70 Ca -0.06 1.16 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 1mm4 s LEU 70 Cb -0.13 -4.02 0.03 0.00 0.03 0.00 0.00 46.19 42.10 1mm4 s LEU 70 CO -0.02 -0.35 -0.10 -0.31 0.23 0.00 0.00 176.35 175.80 1mm4 s TYR 71 N -2.28 1.91 -0.21 0.29 1.51 0.44 -2.46 117.35 116.55 1mm4 s TYR 71 Ca 0.52 -1.11 -0.01 0.00 -1.01 0.00 0.00 57.07 55.45 1mm4 s TYR 71 Cb -0.10 -1.44 0.06 0.00 -0.11 0.00 0.00 41.96 40.37 1mm4 s TYR 71 CO 0.28 -0.63 0.00 0.00 -1.11 0.00 0.00 175.55 174.10 1mm4 s ALA 72 N 1.57 1.38 0.32 3.71 0.00 -1.06 -0.82 121.76 126.86 1mm4 s ALA 72 Ca 0.03 -0.96 0.09 0.00 0.00 0.00 0.00 51.96 51.12 1mm4 s ALA 72 Cb -0.14 -1.28 -0.05 0.00 0.00 0.00 0.00 23.12 21.66 1mm4 s ALA 72 CO -0.09 -1.18 0.04 1.41 0.00 0.00 0.00 175.76 175.95 1mm4 s MET 73 N 1.68 2.21 -0.09 0.00 1.75 -0.34 -0.46 119.30 124.06 1mm4 s MET 73 Ca -0.03 -1.61 -0.07 0.00 -1.25 0.00 0.00 55.69 52.73 1mm4 s MET 73 Cb -0.18 -2.06 0.03 0.00 2.84 0.00 0.00 34.83 35.46 1mm4 s MET 73 CO -0.07 0.19 0.22 0.00 -0.65 0.00 0.00 175.02 174.71 1mm4 s ALA 74 N -2.44 -0.54 0.10 4.11 0.00 -0.97 -1.64 121.76 120.39 1mm4 s ALA 74 Ca 0.35 0.68 0.05 0.00 0.00 0.00 0.00 51.96 53.04 1mm4 s ALA 74 Cb -0.02 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1mm4 s ALA 74 CO 0.20 -0.12 -0.14 0.12 0.00 0.00 0.00 175.76 175.83 1mm4 s PHE 75 N 0.32 1.31 -0.52 0.00 5.36 -1.07 -2.59 117.98 120.79 1mm4 s PHE 75 Ca -0.02 -0.53 -0.17 0.00 -0.96 0.00 0.00 56.93 55.26 1mm4 s PHE 75 Cb -0.03 -0.70 0.09 0.00 -0.34 0.00 0.00 43.02 42.04 1mm4 s PHE 75 CO -0.01 0.10 0.50 0.21 -1.46 0.00 0.00 175.22 174.56 1mm4 s LYS 76 N -2.35 3.01 0.81 10.12 2.20 -1.26 -1.02 119.74 131.24 1mm4 s LYS 76 Ca 0.05 -1.40 -0.13 0.00 -0.36 0.00 0.00 55.97 54.13 1mm4 s LYS 76 Cb -0.06 -4.20 0.08 0.00 -1.51 0.00 0.00 37.83 32.14 1mm4 s LYS 76 CO 0.02 -1.22 1.18 -0.51 -0.36 0.00 0.00 175.35 174.46 1mm4 s ASP 77 N 3.07 3.71 0.31 1.43 -0.00 -1.07 -4.92 116.67 119.20 1mm4 s ASP 77 Ca 0.06 2.26 0.11 0.00 -0.00 0.00 0.00 52.55 54.98 1mm4 s ASP 77 Cb -0.25 -2.58 0.50 0.00 -0.00 0.00 0.00 42.92 40.59 1mm4 s ASP 77 CO 0.06 -2.58 1.70 -1.28 -0.00 0.00 0.00 175.17 173.07 1mm4 h SER 78 N -0.98 0.01 0.27 0.27 0.87 -1.97 -3.31 113.55 108.71 1mm4 h SER 78 Ca -0.46 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.09 1mm4 h SER 78 Cb 1.28 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 1mm4 h SER 78 CO 0.47 0.53 -0.14 -0.25 -0.53 0.00 0.00 176.83 176.90 1mm4 h TRP 79 N 0.00 -0.37 0.00 2.24 7.01 -2.04 -3.48 115.95 119.31 1mm4 h TRP 79 Ca -0.00 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.99 1mm4 h TRP 79 Cb 0.92 0.13 0.00 0.00 -2.10 0.00 0.00 29.16 28.11 1mm4 h TRP 79 CO 0.00 -0.22 0.00 -1.71 -2.79 0.00 0.00 178.44 173.72 1mm4 n ASN 80 N -3.08 -0.22 -3.59 2.65 5.15 -1.25 -5.15 115.26 109.77 1mm4 n ASN 80 Ca -0.05 0.18 -0.30 0.00 -0.60 0.00 0.00 54.58 53.81 1mm4 n ASN 80 Cb 0.15 0.39 0.29 0.00 -0.53 0.00 0.00 39.78 40.08 1mm4 n ASN 80 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1mm4 s LYS 81 N -1.31 -2.80 0.07 1.20 1.02 -1.26 -4.62 119.74 112.03 1mm4 s LYS 81 Ca 0.00 0.28 0.06 0.00 0.02 0.00 0.00 55.97 56.33 1mm4 s LYS 81 Cb 0.00 -1.38 -0.04 0.00 -0.52 0.00 0.00 37.83 35.89 1mm4 s LYS 81 CO 0.00 -4.83 -0.10 -1.58 -0.92 0.00 0.00 175.35 167.92 1mm4 s TRP 82 N -2.23 2.75 -0.17 3.18 0.52 -1.26 -2.61 118.94 119.11 1mm4 s TRP 82 Ca 0.68 -0.14 -0.21 0.00 0.02 0.00 0.00 56.10 56.45 1mm4 s TRP 82 Cb -0.16 -1.49 -0.03 0.00 -1.15 0.00 0.00 33.47 30.65 1mm4 s TRP 82 CO 0.59 0.38 0.65 -1.21 0.02 0.00 0.00 176.95 177.39 1mm4 s GLU 83 N -1.87 4.26 0.43 4.98 2.02 -0.19 -4.91 118.70 123.43 1mm4 s GLU 83 Ca 0.19 0.68 -0.21 0.00 0.02 0.00 0.00 54.97 55.65 1mm4 s GLU 83 Cb -0.11 -3.55 -0.11 0.00 0.10 0.00 0.00 34.13 30.46 1mm4 s GLU 83 CO 0.11 -0.18 0.95 -1.25 0.02 0.00 0.00 175.26 174.91 1mm4 s PRO 84 N 1.69 4.21 -0.10 0.39 0.04 -1.26 -2.59 135.00 137.37 1mm4 s PRO 84 Ca 0.31 1.12 -0.03 0.00 0.04 0.00 0.00 61.00 62.43 1mm4 s PRO 84 Cb -0.16 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.25 1mm4 s PRO 84 CO 0.12 -0.05 0.12 0.42 0.04 0.00 0.00 177.00 177.65 1mm4 s ILE 85 N -2.19 -0.19 0.20 0.56 1.01 -0.65 -4.58 121.20 115.35 1mm4 s ILE 85 Ca 0.62 0.23 0.09 0.00 0.00 0.00 0.00 60.65 61.58 1mm4 s ILE 85 Cb -0.09 -0.35 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 1mm4 s ILE 85 CO 0.14 0.04 -0.17 0.00 0.00 0.00 0.00 174.94 174.95 1mm4 s ALA 86 N 2.23 2.11 0.00 9.38 0.00 -1.07 -1.19 121.76 133.21 1mm4 s ALA 86 Ca 0.04 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.38 1mm4 s ALA 86 Cb -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1mm4 s ALA 86 CO -0.06 0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.28 1mm4 n GLY 87 N -0.12 0.79 2.94 0.00 0.00 -0.00 -0.42 105.19 108.38 1mm4 n GLY 87 Ca -0.10 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 1mm4 n GLY 87 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mm4 s TYR 88 N -2.00 -0.14 0.22 1.61 -0.85 0.43 -0.42 117.35 116.20 1mm4 s TYR 88 Ca 0.00 0.39 0.00 0.00 -0.52 0.00 0.00 57.07 56.94 1mm4 s TYR 88 Cb 0.00 -0.05 -0.05 0.00 0.38 0.00 0.00 41.96 42.25 1mm4 s TYR 88 CO 0.00 -0.12 0.10 0.20 -1.52 0.00 0.00 175.55 174.21 1mm4 s GLY 89 N 0.74 1.53 0.06 5.49 0.00 -0.78 -0.43 107.32 113.93 1mm4 s GLY 89 Ca -0.06 -1.75 0.04 0.00 0.00 0.00 0.00 44.72 42.95 1mm4 s GLY 89 CO -0.03 -1.49 -0.13 0.66 0.00 0.00 0.00 173.10 172.11 1mm4 s TRP 90 N -3.95 1.08 0.03 1.90 -2.14 0.36 -1.67 118.94 114.54 1mm4 s TRP 90 Ca 0.37 -0.44 -0.06 0.00 2.66 0.00 0.00 56.10 58.62 1mm4 s TRP 90 Cb 0.07 -0.62 -0.01 0.00 -3.10 0.00 0.00 33.47 29.82 1mm4 s TRP 90 CO 0.12 0.02 0.12 -1.21 -2.66 0.00 0.00 176.95 173.34 1mm4 s GLU 91 N -1.57 0.56 -0.16 3.25 2.02 0.16 -1.85 118.70 121.11 1mm4 s GLU 91 Ca -0.03 -0.62 -0.07 0.00 0.02 0.00 0.00 54.97 54.27 1mm4 s GLU 91 Cb -0.09 0.22 -0.04 0.00 0.10 0.00 0.00 34.13 34.32 1mm4 s GLU 91 CO 0.02 -0.14 0.06 -1.12 0.02 0.00 0.00 175.26 174.10 1mm4 s SER 92 N -1.86 5.66 0.12 -0.19 0.01 0.43 -2.38 113.70 115.50 1mm4 s SER 92 Ca -0.09 0.13 -0.30 0.00 1.31 0.00 0.00 55.95 57.00 1mm4 s SER 92 Cb -0.04 -1.92 -0.06 0.00 0.21 0.00 0.00 66.02 64.22 1mm4 s SER 92 CO -0.02 0.23 1.01 0.42 0.41 0.00 0.00 173.24 175.28 1mm4 s THR 93 N 0.06 4.31 -0.16 1.44 -4.23 -1.26 -2.60 115.64 113.20 1mm4 s THR 93 Ca 0.05 1.92 -0.14 0.00 -1.18 0.00 0.00 61.69 62.34 1mm4 s THR 93 Cb -0.12 -4.22 0.04 0.00 1.34 0.00 0.00 72.50 69.54 1mm4 s THR 93 CO 0.01 0.29 0.43 0.86 -0.54 0.00 0.00 174.62 175.67 1mm4 s TRP 94 N 0.01 -0.49 -0.32 3.99 -0.11 -0.01 -5.01 118.94 117.01 1mm4 s TRP 94 Ca 0.48 1.17 0.04 0.00 1.22 0.00 0.00 56.10 59.01 1mm4 s TRP 94 Cb -0.25 0.17 0.09 0.00 -1.50 0.00 0.00 33.47 31.98 1mm4 s TRP 94 CO 0.31 -0.24 0.02 1.03 -4.62 0.00 0.00 176.95 173.46 1mm4 s ARG 95 N 0.34 1.59 0.19 5.86 0.52 -1.26 -0.44 118.95 125.75 1mm4 s ARG 95 Ca -0.01 -1.75 -0.11 0.00 -0.52 0.00 0.00 55.73 53.34 1mm4 s ARG 95 Cb -0.03 -3.10 0.20 0.00 0.52 0.00 0.00 34.95 32.53 1mm4 s ARG 95 CO -0.01 -0.87 1.78 -1.35 0.02 0.00 0.00 175.30 174.87 1mm4 h PRO 96 N 7.66 0.52 0.00 3.54 0.11 -1.93 -3.45 132.00 138.45 1mm4 h PRO 96 Ca -0.07 -0.03 -0.49 0.00 0.11 0.00 0.00 66.00 65.52 1mm4 h PRO 96 Cb 1.02 -0.12 -0.12 0.00 0.11 0.00 0.00 31.00 31.90 1mm4 h PRO 96 CO 0.51 0.34 -0.45 1.28 -0.21 0.00 0.00 178.00 179.47 1mm4 n LEU 97 N -4.88 0.00 -2.77 2.35 4.77 -1.26 -5.09 117.00 110.12 1mm4 n LEU 97 Ca 0.06 -3.01 -0.03 0.00 -0.03 0.00 0.00 56.01 53.01 1mm4 n LEU 97 Cb 0.17 1.34 0.05 0.00 -2.33 0.00 0.00 43.42 42.65 1mm4 n LEU 97 CO 0.28 -0.49 -0.02 0.00 -1.33 0.00 0.00 177.39 175.83 1mm4 n ALA 98 N -0.96 2.83 -0.08 -1.18 0.00 -1.26 -4.41 120.51 115.45 1mm4 n ALA 98 Ca -0.13 -2.86 -0.17 0.00 0.00 0.00 0.00 53.44 50.28 1mm4 n ALA 98 Cb 0.58 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 19.11 1mm4 n ALA 98 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mm4 n ASP 99 N -0.53 1.25 -1.17 0.00 -0.08 -1.26 -4.70 116.55 110.07 1mm4 n ASP 99 Ca 0.09 0.21 -0.03 0.00 -1.51 0.00 0.00 54.79 53.56 1mm4 n ASP 99 Cb 0.81 -0.51 0.21 0.00 2.34 0.00 0.00 41.12 43.97 1mm4 n ASP 99 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1mm4 n GLU 100 N -3.80 2.06 -2.58 -0.67 2.13 -1.26 -4.93 120.64 111.59 1mm4 n GLU 100 Ca -0.31 -3.11 -0.19 0.00 0.66 0.00 0.00 57.16 54.21 1mm4 n GLU 100 Cb 0.70 -1.84 -0.00 0.00 0.27 0.00 0.00 31.44 30.56 1mm4 n GLU 100 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1mm4 n ASN 101 N -1.01 -5.16 -4.69 4.31 3.02 -1.26 -4.78 115.26 105.69 1mm4 n ASN 101 Ca 0.32 -0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.43 1mm4 n ASN 101 Cb 1.05 -4.29 -0.03 0.00 -0.61 0.00 0.00 39.78 35.89 1mm4 n ASN 101 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1mm4 n PHE 102 N -3.89 2.60 -4.31 3.10 3.72 -1.26 -4.79 117.46 112.63 1mm4 n PHE 102 Ca -0.18 -0.09 -0.28 0.00 -0.05 0.00 0.00 57.45 56.86 1mm4 n PHE 102 Cb 0.64 -2.71 -0.10 0.00 -0.94 0.00 0.00 39.48 36.37 1mm4 n PHE 102 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1mm4 s HIS 103 N 2.50 2.57 -0.07 1.38 3.76 -0.88 -4.26 115.29 120.29 1mm4 s HIS 103 Ca 0.82 -0.25 -0.10 0.00 -0.15 0.00 0.00 55.06 55.37 1mm4 s HIS 103 Cb -0.51 -1.29 0.02 0.00 1.11 0.00 0.00 32.58 31.92 1mm4 s HIS 103 CO 0.38 0.48 0.27 -1.17 -0.85 0.00 0.00 174.74 173.84 1mm4 s LEU 104 N -2.62 0.99 -0.02 0.89 0.20 0.42 -2.59 118.68 115.95 1mm4 s LEU 104 Ca 0.23 0.38 -0.01 0.00 0.69 0.00 0.00 54.13 55.41 1mm4 s LEU 104 Cb -0.09 0.99 0.01 0.00 -0.43 0.00 0.00 46.19 46.67 1mm4 s LEU 104 CO 0.13 -0.20 0.06 -0.83 -0.29 0.00 0.00 176.35 175.22 1mm4 s GLY 105 N -0.33 -0.01 -0.02 7.98 0.00 -0.69 -0.83 107.32 113.43 1mm4 s GLY 105 Ca -0.04 0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.93 1mm4 s GLY 105 CO 0.01 0.32 -0.07 -2.27 0.00 0.00 0.00 173.10 171.10 1mm4 s LEU 106 N 0.35 1.79 0.00 0.66 1.98 -1.07 -2.03 118.68 120.36 1mm4 s LEU 106 Ca -0.03 -0.15 0.00 0.00 -2.89 0.00 0.00 54.13 51.07 1mm4 s LEU 106 Cb -0.04 -0.44 0.00 0.00 0.66 0.00 0.00 46.19 46.37 1mm4 s LEU 106 CO -0.01 0.05 0.00 0.61 -1.89 0.00 0.00 176.35 175.11 1mm4 n GLY 107 N 3.28 -1.03 3.35 7.98 0.00 -1.05 -0.43 105.19 117.29 1mm4 n GLY 107 Ca -0.18 -0.87 -0.19 0.00 0.00 0.00 0.00 46.02 44.79 1mm4 n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mm4 s PHE 108 N -3.00 1.75 0.04 1.61 0.40 -0.77 -0.99 117.98 117.02 1mm4 s PHE 108 Ca 0.00 -0.55 0.04 0.00 -0.60 0.00 0.00 56.93 55.82 1mm4 s PHE 108 Cb 0.00 -0.81 -0.02 0.00 0.51 0.00 0.00 43.02 42.69 1mm4 s PHE 108 CO 0.00 0.38 -0.11 0.95 0.70 0.00 0.00 175.22 177.14 1mm4 s THR 109 N -2.86 0.83 -0.29 0.64 -4.23 -0.86 -0.49 115.64 108.39 1mm4 s THR 109 Ca 0.22 -0.97 -0.05 0.00 -1.18 0.00 0.00 61.69 59.72 1mm4 s THR 109 Cb -0.01 -0.80 0.02 0.00 1.34 0.00 0.00 72.50 73.05 1mm4 s THR 109 CO 0.07 -0.14 0.03 0.00 -0.54 0.00 0.00 174.62 174.05 1mm4 s ALA 110 N -0.98 2.93 -0.23 3.99 0.00 0.43 -2.60 121.76 125.29 1mm4 s ALA 110 Ca -0.03 -1.52 -0.09 0.00 0.00 0.00 0.00 51.96 50.33 1mm4 s ALA 110 Cb -0.08 -2.01 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1mm4 s ALA 110 CO 0.01 -0.97 0.11 0.20 0.00 0.00 0.00 175.76 175.11 1mm4 s GLY 111 N 1.41 1.90 -0.11 0.00 0.00 -0.44 -0.43 107.32 109.65 1mm4 s GLY 111 Ca 0.01 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.80 1mm4 s GLY 111 CO 0.00 0.38 -0.17 -1.34 0.00 0.00 0.00 173.10 171.97 1mm4 s VAL 112 N 1.13 2.74 0.07 1.40 -7.23 0.44 -0.40 120.40 118.55 1mm4 s VAL 112 Ca 0.06 -0.79 0.02 0.00 -1.81 0.00 0.00 61.98 59.46 1mm4 s VAL 112 Cb -0.14 -2.11 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 1mm4 s VAL 112 CO 0.04 0.54 -0.08 0.42 -0.31 0.00 0.00 175.10 175.72 1mm4 s THR 113 N 0.20 0.65 0.24 5.32 -4.23 -1.07 -2.60 115.64 114.14 1mm4 s THR 113 Ca -0.10 -1.44 0.08 0.00 -1.18 0.00 0.00 61.69 59.05 1mm4 s THR 113 Cb -0.16 -1.07 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 1mm4 s THR 113 CO 0.06 -0.57 0.10 0.00 -0.54 0.00 0.00 174.62 173.67 1mm4 s ALA 114 N -2.26 3.40 1.04 3.99 0.00 -1.26 -0.44 121.76 126.22 1mm4 s ALA 114 Ca -0.01 -1.48 -0.05 0.00 0.00 0.00 0.00 51.96 50.43 1mm4 s ALA 114 Cb -0.04 -1.09 0.07 0.00 0.00 0.00 0.00 23.12 22.05 1mm4 s ALA 114 CO -0.01 0.30 0.30 -2.13 0.00 0.00 0.00 175.76 174.22 1mm4 n ARG 115 N -0.90 -1.07 -1.33 0.00 0.63 -1.26 -4.97 116.66 107.75 1mm4 n ARG 115 Ca -0.08 -0.47 -0.24 0.00 -0.92 0.00 0.00 57.85 56.14 1mm4 n ARG 115 Cb 0.58 -0.38 0.11 0.00 0.45 0.00 0.00 32.46 33.22 1mm4 n ARG 115 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1mm4 n ASP 116 N -3.37 5.23 -3.07 6.15 2.03 -1.26 -4.70 116.55 117.56 1mm4 n ASP 116 Ca 0.04 -3.75 -0.18 0.00 0.52 0.00 0.00 54.79 51.42 1mm4 n ASP 116 Cb 0.15 -0.75 -0.04 0.00 -0.72 0.00 0.00 41.12 39.76 1mm4 n ASP 116 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1mm4 n ASN 117 N -0.97 -1.15 0.00 1.67 2.85 -1.26 -5.03 115.26 111.37 1mm4 n ASN 117 Ca 0.52 -2.80 0.00 0.00 -0.11 0.00 0.00 54.58 52.19 1mm4 n ASN 117 Cb 1.01 0.26 0.00 0.00 1.24 0.00 0.00 39.78 42.29 1mm4 n ASN 117 CO 0.00 0.00 0.00 1.87 -2.11 0.00 0.00 177.26 177.02 1mm4 n TRP 118 N 1.95 0.00 -2.95 1.20 -0.00 -1.26 -4.92 117.44 111.46 1mm4 n TRP 118 Ca 0.20 0.00 0.07 0.00 -0.00 0.00 0.00 57.50 57.77 1mm4 n TRP 118 Cb 0.55 0.00 -0.02 0.00 -0.00 0.00 0.00 31.31 31.84 1mm4 n TRP 118 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1mm4 n ASN 119 N 1.77 -6.08 0.00 5.87 5.03 -1.26 -4.90 115.26 115.70 1mm4 n ASN 119 Ca 0.00 0.58 0.00 0.00 0.87 0.00 0.00 54.58 56.03 1mm4 n ASN 119 Cb 0.00 -1.65 0.00 0.00 -1.02 0.00 0.00 39.78 37.11 1mm4 n ASN 119 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1mm4 n TYR 120 N -2.57 -1.11 -3.80 3.10 9.36 -1.26 -5.08 117.16 115.80 1mm4 n TYR 120 Ca 0.00 0.00 -0.36 0.00 3.32 0.00 0.00 57.90 60.86 1mm4 n TYR 120 Cb 0.24 0.22 -0.12 0.00 -0.63 0.00 0.00 39.34 39.05 1mm4 n TYR 120 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1mm4 s ILE 121 N -1.53 3.33 0.48 2.97 1.09 -1.26 -5.10 121.20 121.18 1mm4 s ILE 121 Ca 0.00 -1.67 -0.23 0.00 -1.10 0.00 0.00 60.65 57.65 1mm4 s ILE 121 Cb 0.00 -3.10 -0.07 0.00 -1.06 0.00 0.00 42.46 38.24 1mm4 s ILE 121 CO 0.00 -0.43 1.23 -2.16 -0.10 0.00 0.00 174.94 173.48 1mm4 s PRO 122 N 1.23 3.60 -0.21 2.79 0.04 -1.26 -4.93 135.00 136.27 1mm4 s PRO 122 Ca 0.02 1.92 -0.29 0.00 0.04 0.00 0.00 61.00 62.70 1mm4 s PRO 122 Cb -0.21 -2.39 0.01 0.00 0.04 0.00 0.00 34.50 31.94 1mm4 s PRO 122 CO -0.02 -0.72 1.05 -0.51 0.04 0.00 0.00 177.00 176.84 1mm4 s LEU 123 N -3.12 4.12 0.77 -3.56 1.02 0.41 -4.58 118.68 113.74 1mm4 s LEU 123 Ca 0.65 1.42 -0.12 0.00 0.02 0.00 0.00 54.13 56.11 1mm4 s LEU 123 Cb -0.32 -3.54 0.05 0.00 0.02 0.00 0.00 46.19 42.40 1mm4 s LEU 123 CO 0.39 -0.65 1.11 -2.16 0.02 0.00 0.00 176.35 175.06 1mm4 s PRO 124 N 3.09 2.32 -0.20 1.29 0.04 -1.26 -2.61 135.00 137.68 1mm4 s PRO 124 Ca 0.45 0.44 -0.07 0.00 0.04 0.00 0.00 61.00 61.86 1mm4 s PRO 124 Cb -0.16 -1.96 0.09 0.00 0.04 0.00 0.00 34.50 32.51 1mm4 s PRO 124 CO 0.08 -1.41 0.42 0.08 0.04 0.00 0.00 177.00 176.20 1mm4 s VAL 125 N -3.33 -0.59 -0.22 -0.36 1.01 0.46 -4.89 120.40 112.48 1mm4 s VAL 125 Ca 0.60 0.16 -0.14 0.00 0.00 0.00 0.00 61.98 62.60 1mm4 s VAL 125 Cb -0.12 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 1mm4 s VAL 125 CO 0.52 0.07 0.32 -0.22 0.00 0.00 0.00 175.10 175.79 1mm4 s LEU 126 N 2.51 4.13 -0.05 3.92 2.96 -1.26 -1.33 118.68 129.55 1mm4 s LEU 126 Ca -0.02 0.36 -0.11 0.00 -0.22 0.00 0.00 54.13 54.13 1mm4 s LEU 126 Cb -0.12 -2.38 0.02 0.00 0.50 0.00 0.00 46.19 44.21 1mm4 s LEU 126 CO -0.13 -0.05 0.27 -1.48 -1.32 0.00 0.00 176.35 173.64 1mm4 s LEU 127 N 1.34 1.01 0.37 -0.68 2.34 -1.07 -5.01 118.68 116.98 1mm4 s LEU 127 Ca 0.15 0.22 -0.26 0.00 0.06 0.00 0.00 54.13 54.30 1mm4 s LEU 127 Cb -0.15 1.04 -0.09 0.00 -0.56 0.00 0.00 46.19 46.44 1mm4 s LEU 127 CO 0.07 -0.30 1.14 -2.16 -1.06 0.00 0.00 176.35 174.04 1mm4 s PRO 128 N -0.76 4.21 0.10 1.48 0.04 -1.26 -2.03 135.00 136.79 1mm4 s PRO 128 Ca -0.08 1.78 -0.09 0.00 0.04 0.00 0.00 61.00 62.64 1mm4 s PRO 128 Cb -0.04 -2.77 0.00 0.00 0.04 0.00 0.00 34.50 31.73 1mm4 s PRO 128 CO 0.02 -0.17 0.22 -0.51 0.04 0.00 0.00 177.00 176.61 1mm4 s LEU 129 N -2.29 1.26 0.00 -3.56 1.02 -0.16 -2.38 118.68 112.58 1mm4 s LEU 129 Ca 0.54 -0.66 0.04 0.00 0.02 0.00 0.00 54.13 54.07 1mm4 s LEU 129 Cb -0.29 1.13 -0.01 0.00 0.02 0.00 0.00 46.19 47.03 1mm4 s LEU 129 CO 0.37 -0.77 0.13 0.00 0.02 0.00 0.00 176.35 176.11 1mm4 n ALA 130 N -0.10 0.43 -3.55 4.21 0.00 -0.55 -2.53 120.51 118.42 1mm4 n ALA 130 Ca -0.14 -1.39 -0.07 0.00 0.00 0.00 0.00 53.44 51.84 1mm4 n ALA 130 Cb 0.63 1.00 -0.03 0.00 0.00 0.00 0.00 19.45 21.05 1mm4 n ALA 130 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1mm4 s SER 131 N -2.67 -0.29 -0.08 0.00 1.04 -0.86 -2.14 113.70 108.69 1mm4 s SER 131 Ca 0.19 0.09 -0.03 0.00 0.48 0.00 0.00 55.95 56.67 1mm4 s SER 131 Cb 0.01 0.28 0.05 0.00 0.10 0.00 0.00 66.02 66.46 1mm4 s SER 131 CO 0.13 -0.43 0.17 0.68 0.98 0.00 0.00 173.24 174.78 1mm4 s VAL 132 N -2.42 -0.21 -0.38 5.02 -7.23 0.45 -1.70 120.40 113.93 1mm4 s VAL 132 Ca 0.05 0.29 -0.18 0.00 -1.81 0.00 0.00 61.98 60.33 1mm4 s VAL 132 Cb -0.01 -0.30 0.01 0.00 0.56 0.00 0.00 36.38 36.64 1mm4 s VAL 132 CO -0.05 0.12 0.52 -0.83 -0.31 0.00 0.00 175.10 174.54 1mm4 s GLY 133 N 1.93 1.82 -0.17 2.32 0.00 -1.07 -2.02 107.32 110.13 1mm4 s GLY 133 Ca -0.01 -1.15 -0.01 0.00 0.00 0.00 0.00 44.72 43.55 1mm4 s GLY 133 CO -0.06 1.29 -0.04 -0.47 0.00 0.00 0.00 173.10 173.81 1mm4 s TYR 134 N 2.41 1.63 0.00 1.90 5.04 -1.01 -2.07 117.35 125.26 1mm4 s TYR 134 Ca 0.18 -1.05 0.00 0.00 -2.44 0.00 0.00 57.07 53.76 1mm4 s TYR 134 Cb -0.16 -1.28 0.00 0.00 0.35 0.00 0.00 41.96 40.87 1mm4 s TYR 134 CO 0.14 -0.61 0.00 0.41 -1.34 0.00 0.00 175.55 174.16 1mm4 n GLY 135 N 4.89 1.10 0.02 8.97 0.00 -1.26 -2.35 105.19 116.57 1mm4 n GLY 135 Ca -0.11 -0.59 0.09 0.00 0.00 0.00 0.00 46.02 45.41 1mm4 n GLY 135 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mm4 n PRO 136 N 0.72 0.04 -4.06 1.61 -0.04 -1.26 -4.76 135.00 127.25 1mm4 n PRO 136 Ca 0.00 0.24 -0.26 0.00 -0.04 0.00 0.00 63.50 63.44 1mm4 n PRO 136 Cb 0.00 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 31.85 1mm4 n PRO 136 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1mm4 s VAL 137 N -3.05 4.64 -0.05 0.52 -7.23 -0.99 -4.65 120.40 109.59 1mm4 s VAL 137 Ca 0.08 -1.02 -0.00 0.00 -1.81 0.00 0.00 61.98 59.23 1mm4 s VAL 137 Cb 0.11 -3.38 0.03 0.00 0.56 0.00 0.00 36.38 33.70 1mm4 s VAL 137 CO 0.33 -0.11 -0.01 0.42 -0.31 0.00 0.00 175.10 175.42 1mm4 s THR 138 N -1.76 0.34 -0.10 5.32 -4.23 -1.03 -2.41 115.64 111.78 1mm4 s THR 138 Ca 0.32 0.06 -0.03 0.00 -1.18 0.00 0.00 61.69 60.86 1mm4 s THR 138 Cb -0.10 -0.44 -0.03 0.00 1.34 0.00 0.00 72.50 73.26 1mm4 s THR 138 CO 0.24 0.21 0.01 0.12 -0.54 0.00 0.00 174.62 174.66 1mm4 s PHE 139 N 1.39 3.18 -0.08 3.99 2.19 -0.86 -1.45 117.98 126.34 1mm4 s PHE 139 Ca -0.04 0.17 0.03 0.00 0.33 0.00 0.00 56.93 57.42 1mm4 s PHE 139 Cb -0.13 -1.83 0.01 0.00 -1.31 0.00 0.00 43.02 39.76 1mm4 s PHE 139 CO -0.02 0.43 -0.18 -1.14 1.83 0.00 0.00 175.22 176.13 1mm4 s GLN 140 N -0.72 2.27 0.19 10.12 -0.44 0.18 -0.41 119.66 130.83 1mm4 s GLN 140 Ca 0.11 -0.64 0.06 0.00 -2.50 0.00 0.00 55.36 52.40 1mm4 s GLN 140 Cb -0.12 -1.80 -0.04 0.00 -1.64 0.00 0.00 33.01 29.42 1mm4 s GLN 140 CO 0.02 0.12 0.11 -1.64 0.50 0.00 0.00 175.29 174.41 1mm4 s MET 141 N 0.43 2.78 -0.03 1.67 -1.94 -0.91 -1.56 119.30 119.75 1mm4 s MET 141 Ca -0.15 -0.97 0.03 0.00 -1.71 0.00 0.00 55.69 52.89 1mm4 s MET 141 Cb -0.16 -2.55 -0.00 0.00 2.01 0.00 0.00 34.83 34.13 1mm4 s MET 141 CO 0.06 0.46 -0.12 0.99 -0.01 0.00 0.00 175.02 176.39 1mm4 s THR 142 N -1.84 1.03 -0.20 2.05 2.01 -1.06 -1.48 115.64 116.15 1mm4 s THR 142 Ca 0.31 -0.51 -0.03 0.00 0.31 0.00 0.00 61.69 61.77 1mm4 s THR 142 Cb -0.09 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 1mm4 s THR 142 CO 0.23 0.31 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.92 1mm4 s TYR 143 N 0.03 2.93 -0.53 4.92 6.14 -1.00 -2.51 117.35 127.33 1mm4 s TYR 143 Ca -0.01 -0.89 -0.15 0.00 0.64 0.00 0.00 57.07 56.66 1mm4 s TYR 143 Cb -0.09 -2.04 0.13 0.00 0.42 0.00 0.00 41.96 40.38 1mm4 s TYR 143 CO 0.01 -0.47 0.47 0.42 0.64 0.00 0.00 175.55 176.62 1mm4 s ILE 144 N 1.20 5.01 -0.02 3.14 1.09 -1.26 -4.17 121.20 126.19 1mm4 s ILE 144 Ca 0.02 -1.57 -0.30 0.00 -1.10 0.00 0.00 60.65 57.70 1mm4 s ILE 144 Cb -0.14 -4.23 -0.04 0.00 -1.06 0.00 0.00 42.46 36.99 1mm4 s ILE 144 CO -0.02 -0.85 1.26 -2.16 -0.10 0.00 0.00 174.94 173.07 1mm4 s PRO 145 N 1.53 4.34 0.18 2.79 0.04 -1.26 -4.93 135.00 137.69 1mm4 s PRO 145 Ca 0.04 1.78 -0.24 0.00 0.04 0.00 0.00 61.00 62.62 1mm4 s PRO 145 Cb -0.29 -3.53 0.06 0.00 0.04 0.00 0.00 34.50 30.78 1mm4 s PRO 145 CO 0.02 -0.46 0.95 0.20 0.04 0.00 0.00 177.00 177.75 1mm4 s GLY 146 N 1.54 -0.12 -1.00 0.56 0.00 -1.26 -5.09 107.32 101.95 1mm4 s GLY 146 Ca 0.59 -0.04 -0.04 0.00 0.00 0.00 0.00 44.72 45.22 1mm4 s GLY 146 CO 0.24 0.41 1.02 -0.37 0.00 0.00 0.00 173.10 174.40 1mm4 n THR 147 N -0.52 3.95 -3.22 0.90 5.66 -1.26 -4.90 114.28 114.89 1mm4 n THR 147 Ca -0.05 -5.36 -0.20 0.00 -3.05 0.00 0.00 64.05 55.40 1mm4 n THR 147 Cb 0.60 -2.40 0.05 0.00 -1.55 0.00 0.00 70.33 67.03 1mm4 n THR 147 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1mm4 n TYR 148 N 2.21 -1.97 0.05 1.09 4.02 -1.26 -5.03 117.16 116.27 1mm4 n TYR 148 Ca 0.24 -2.03 -0.09 0.00 -0.01 0.00 0.00 57.90 56.01 1mm4 n TYR 148 Cb 0.37 -0.50 0.06 0.00 -0.02 0.00 0.00 39.34 39.26 1mm4 n TYR 148 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1mm4 h ASN 149 N 0.20 0.47 0.00 7.72 2.35 -2.05 -3.37 115.58 120.91 1mm4 h ASN 149 Ca -0.27 -0.28 -0.31 0.00 -0.55 0.00 0.00 56.30 54.89 1mm4 h ASN 149 Cb 1.17 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 39.36 1mm4 h ASN 149 CO 0.39 0.99 -2.03 -3.20 -1.65 0.00 0.00 177.43 171.93 1mm4 n ASN 150 N -3.88 1.52 -1.72 5.81 2.85 -1.26 -5.03 115.26 113.54 1mm4 n ASN 150 Ca -0.04 0.18 -0.13 0.00 -0.11 0.00 0.00 54.58 54.48 1mm4 n ASN 150 Cb 0.65 -0.50 0.01 0.00 1.24 0.00 0.00 39.78 41.18 1mm4 n ASN 150 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1mm4 n GLY 151 N 1.96 -0.06 2.74 8.20 0.00 -1.26 -5.00 105.19 111.78 1mm4 n GLY 151 Ca -0.36 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 1mm4 n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mm4 s ASN 152 N -2.71 3.80 -0.02 1.61 0.02 -1.26 -5.04 114.94 111.34 1mm4 s ASN 152 Ca 0.12 -2.48 0.00 0.00 -1.02 0.00 0.00 52.86 49.49 1mm4 s ASN 152 Cb -0.05 -1.07 0.02 0.00 0.02 0.00 0.00 41.25 40.16 1mm4 s ASN 152 CO 0.15 -0.29 0.00 0.68 0.02 0.00 0.00 177.10 177.66 1mm4 s VAL 153 N 0.53 0.12 -0.06 1.60 -7.23 -1.26 -5.15 120.40 108.96 1mm4 s VAL 153 Ca 0.16 0.07 0.04 0.00 -1.81 0.00 0.00 61.98 60.44 1mm4 s VAL 153 Cb -0.23 -0.20 -0.00 0.00 0.56 0.00 0.00 36.38 36.51 1mm4 s VAL 153 CO -0.04 0.11 -0.19 -0.31 -0.31 0.00 0.00 175.10 174.36 1mm4 s TYR 154 N 0.76 1.93 -0.10 2.82 1.51 -1.26 -4.54 117.35 118.48 1mm4 s TYR 154 Ca -0.07 -0.64 -0.03 0.00 -1.01 0.00 0.00 57.07 55.32 1mm4 s TYR 154 Cb -0.10 -1.31 -0.04 0.00 -0.11 0.00 0.00 41.96 40.40 1mm4 s TYR 154 CO -0.02 -0.24 0.04 0.12 -1.11 0.00 0.00 175.55 174.35 1mm4 s PHE 155 N 0.17 3.29 -0.05 2.71 5.36 -1.04 -4.98 117.98 123.44 1mm4 s PHE 155 Ca -0.08 0.29 0.06 0.00 -0.96 0.00 0.00 56.93 56.24 1mm4 s PHE 155 Cb -0.14 -1.83 -0.02 0.00 -0.34 0.00 0.00 43.02 40.69 1mm4 s PHE 155 CO 0.04 0.55 -0.23 0.00 -1.46 0.00 0.00 175.22 174.12 1mm4 s ALA 156 N -0.93 2.26 -0.18 11.12 0.00 -1.26 -2.58 121.76 130.19 1mm4 s ALA 156 Ca 0.14 -1.05 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 1mm4 s ALA 156 Cb -0.12 -0.71 0.08 0.00 0.00 0.00 0.00 23.12 22.38 1mm4 s ALA 156 CO 0.03 0.46 0.36 -1.58 0.00 0.00 0.00 175.76 175.02 1mm4 s TRP 157 N -0.33 -0.65 0.02 0.00 0.51 -0.60 -4.55 118.94 113.33 1mm4 s TRP 157 Ca 0.02 1.25 -0.13 0.00 -2.12 0.00 0.00 56.10 55.12 1mm4 s TRP 157 Cb -0.12 0.15 -0.06 0.00 -0.81 0.00 0.00 33.47 32.63 1mm4 s TRP 157 CO 0.02 -0.45 0.39 1.41 -0.51 0.00 0.00 176.95 177.80 1mm4 s MET 158 N 2.53 3.84 0.03 4.98 1.75 -1.07 -0.65 119.30 130.72 1mm4 s MET 158 Ca 0.01 0.31 -0.06 0.00 -1.25 0.00 0.00 55.69 54.70 1mm4 s MET 158 Cb -0.12 -3.15 -0.01 0.00 2.84 0.00 0.00 34.83 34.39 1mm4 s MET 158 CO -0.11 0.66 0.10 -0.98 -0.65 0.00 0.00 175.02 174.03 1mm4 s ARG 159 N -1.32 0.57 -0.03 4.11 3.03 -0.53 -1.42 118.95 123.35 1mm4 s ARG 159 Ca 0.26 -0.70 0.00 0.00 2.03 0.00 0.00 55.73 57.33 1mm4 s ARG 159 Cb -0.16 0.22 0.03 0.00 -1.03 0.00 0.00 34.95 34.01 1mm4 s ARG 159 CO 0.14 -0.14 -0.01 0.12 -1.13 0.00 0.00 175.30 174.28 1mm4 s PHE 160 N -2.39 0.42 0.00 5.89 2.19 -1.06 -2.46 117.98 120.57 1mm4 s PHE 160 Ca -0.07 -0.05 -0.30 0.00 0.33 0.00 0.00 56.93 56.84 1mm4 s PHE 160 Cb -0.02 -0.48 -0.04 0.00 -1.31 0.00 0.00 43.02 41.16 1mm4 s PHE 160 CO -0.04 -0.15 1.15 1.14 1.83 0.00 0.00 175.22 179.16 1mm4 s GLN 161 N 1.04 4.43 0.06 10.12 -2.07 -1.26 -2.59 119.66 129.38 1mm4 s GLN 161 Ca -0.10 1.66 0.08 0.00 -1.82 0.00 0.00 55.36 55.18 1mm4 s GLN 161 Cb -0.14 -3.45 -0.03 0.00 -1.09 0.00 0.00 33.01 28.31 1mm4 s GLN 161 CO -0.01 -0.29 -0.21 0.12 -1.32 0.00 0.00 175.29 173.58 1mm4 s PHE 162 N 1.49 1.84 0.22 9.60 5.36 -0.07 -5.02 117.98 131.39 1mm4 s PHE 162 Ca 0.56 -0.39 0.07 0.00 -0.96 0.00 0.00 56.93 56.22 1mm4 s PHE 162 Cb -0.26 -1.07 -0.04 0.00 -0.34 0.00 0.00 43.02 41.31 1mm4 s PHE 162 CO 0.26 0.12 0.08 -1.17 -1.46 0.00 0.00 175.22 173.05 1mm4 s LEU 163 N -1.36 3.51 -0.05 6.12 2.96 -1.26 -2.41 118.68 126.19 1mm4 s LEU 163 Ca 0.07 -0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 1mm4 s LEU 163 Cb -0.09 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 1mm4 s LEU 163 CO 0.02 0.03 0.03 -0.70 -1.32 0.00 0.00 176.35 174.42 1mm4 s GLU 164 N -3.39 3.00 0.17 1.98 2.56 -1.26 -5.00 118.70 116.75 1mm4 s GLU 164 Ca 0.30 -0.45 0.10 0.00 0.00 0.00 0.00 54.97 54.93 1mm4 s GLU 164 Cb -0.08 -2.82 -0.04 0.00 2.00 0.00 0.00 34.13 33.19 1mm4 s GLU 164 CO 0.21 0.68 -0.23 -1.01 -0.56 0.00 0.00 175.26 174.36 1mm4 s HIS 165 N -1.01 2.16 0.23 5.30 3.76 -1.26 -5.14 115.29 119.33 1mm4 s HIS 165 Ca 0.17 -0.39 -0.09 0.00 -0.15 0.00 0.00 55.06 54.60 1mm4 s HIS 165 Cb -0.12 -1.09 -0.07 0.00 1.11 0.00 0.00 32.58 32.41 1mm4 s HIS 165 CO 0.07 0.42 0.55 -1.01 -0.85 0.00 0.00 174.74 173.91 1mm4 s HIS 166 N -1.62 3.43 -0.19 1.40 0.09 -1.26 -5.08 115.29 112.06 1mm4 s HIS 166 Ca 0.17 0.86 -0.06 0.00 -0.00 0.00 0.00 55.06 56.03 1mm4 s HIS 166 Cb -0.08 -2.25 -0.03 0.00 -0.00 0.00 0.00 32.58 30.22 1mm4 s HIS 166 CO 0.08 0.27 0.03 -1.01 -0.00 0.00 0.00 174.74 174.11 1mm4 s HIS 167 N -1.83 3.14 -0.01 1.40 3.76 -1.26 -4.99 115.29 115.50 1mm4 s HIS 167 Ca 0.47 -0.17 -0.07 0.00 -0.15 0.00 0.00 55.06 55.14 1mm4 s HIS 167 Cb -0.11 -2.08 -0.02 0.00 1.11 0.00 0.00 32.58 31.48 1mm4 s HIS 167 CO 0.22 -0.04 -0.13 0.72 -0.85 0.00 0.00 174.74 174.66 1mm4 n HIS 168 N 3.88 0.00 -3.77 1.40 8.25 -1.26 -4.92 115.22 118.80 1mm4 n HIS 168 Ca -0.17 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.02 1mm4 n HIS 168 Cb 0.52 -0.19 -0.11 0.00 1.12 0.00 0.00 29.99 31.33 1mm4 n HIS 168 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1mm4 n HIS 169 N -3.77 2.28 -0.12 4.41 8.25 -1.26 -5.39 115.22 119.63 1mm4 n HIS 169 Ca -0.05 -4.08 0.00 0.00 -0.26 0.00 0.00 57.72 53.33 1mm4 n HIS 169 Cb 0.20 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.89 1mm4 n HIS 169 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56