#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hx2 n SER 3 N 0.00 -1.07 0.30 4.04 2.88 -1.26 -4.86 113.62 113.65 3hx2 n SER 3 Ca 0.00 0.59 0.20 0.00 -1.33 0.00 0.00 58.87 58.33 3hx2 n SER 3 Cb 0.00 -1.24 0.99 0.00 -0.75 0.00 0.00 64.21 63.22 3hx2 n SER 3 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 3hx2 h GLN 4 N -0.42 0.00 0.00 -1.46 3.07 -1.99 -2.84 115.11 111.47 3hx2 h GLN 4 Ca -0.46 0.00 -0.25 0.00 0.09 0.00 0.00 58.65 58.03 3hx2 h GLN 4 Cb 1.34 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.86 3hx2 h GLN 4 CO 0.43 0.00 -2.05 0.44 0.09 0.00 0.00 178.83 177.73 3hx2 n ILE 5 N -3.00 1.12 -1.56 1.86 -5.35 -1.26 -4.99 119.36 106.18 3hx2 n ILE 5 Ca -0.02 -0.75 -0.52 0.00 -0.27 0.00 0.00 62.75 61.19 3hx2 n ILE 5 Cb 0.15 -0.49 -0.06 0.00 -1.74 0.00 0.00 39.64 37.50 3hx2 n ILE 5 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 3hx2 n ARG 6 N -2.72 0.83 -3.61 6.28 0.63 -1.07 -4.90 116.66 112.10 3hx2 n ARG 6 Ca -0.21 0.30 -0.01 0.00 -0.92 0.00 0.00 57.85 57.00 3hx2 n ARG 6 Cb 0.98 -1.83 -0.04 0.00 0.45 0.00 0.00 32.46 32.01 3hx2 n ARG 6 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 3hx2 s GLN 7 N 0.04 0.54 -1.96 -0.14 0.74 -1.26 -4.93 119.66 112.69 3hx2 s GLN 7 Ca 0.82 1.30 0.00 0.00 0.05 0.00 0.00 55.36 57.53 3hx2 s GLN 7 Cb -1.00 0.73 0.00 0.00 1.10 0.00 0.00 33.01 33.85 3hx2 s GLN 7 CO 0.51 -0.18 0.00 -1.71 -0.55 0.00 0.00 175.29 173.37 3hx2 n ASN 8 N 5.25 -5.23 -4.19 6.67 5.15 -1.26 -4.95 115.26 116.70 3hx2 n ASN 8 Ca -0.12 0.45 -0.40 0.00 -0.60 0.00 0.00 54.58 53.91 3hx2 n ASN 8 Cb 0.51 -4.36 -0.08 0.00 -0.53 0.00 0.00 39.78 35.32 3hx2 n ASN 8 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 3hx2 s TYR 9 N -2.69 3.49 0.41 1.20 5.04 -1.26 -4.82 117.35 118.72 3hx2 s TYR 9 Ca 0.00 -2.20 -0.25 0.00 -2.44 0.00 0.00 57.07 52.18 3hx2 s TYR 9 Cb 0.00 -3.44 -0.08 0.00 0.35 0.00 0.00 41.96 38.78 3hx2 s TYR 9 CO 0.00 -0.95 1.25 -1.54 -1.34 0.00 0.00 175.55 172.98 3hx2 s SER 10 N 1.91 6.32 0.50 4.32 1.04 -1.26 -4.91 113.70 121.62 3hx2 s SER 10 Ca 0.11 2.54 0.34 0.00 0.48 0.00 0.00 55.95 59.42 3hx2 s SER 10 Cb -0.21 -2.63 1.74 0.00 0.10 0.00 0.00 66.02 65.02 3hx2 s SER 10 CO -0.03 -0.83 2.03 0.71 0.98 0.00 0.00 173.24 176.10 3hx2 h THR 11 N 2.34 0.00 -0.06 2.02 1.35 -1.99 -1.56 112.91 115.01 3hx2 h THR 11 Ca -0.49 -0.10 -0.10 0.00 -0.55 0.00 0.00 66.41 65.17 3hx2 h THR 11 Cb 1.24 0.90 0.01 0.00 -1.73 0.00 0.00 68.15 68.57 3hx2 h THR 11 CO 0.62 0.00 -0.37 0.44 -0.25 0.00 0.00 175.52 175.96 3hx2 h ASP 12 N 0.00 0.42 -0.20 5.36 3.45 -2.00 -2.87 116.42 120.58 3hx2 h ASP 12 Ca 0.00 -0.67 -0.01 0.00 0.43 0.00 0.00 57.03 56.78 3hx2 h ASP 12 Cb 0.11 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 3hx2 h ASP 12 CO 0.00 1.03 0.09 0.58 -1.57 0.00 0.00 179.24 179.37 3hx2 h VAL 13 N -0.15 1.14 -0.97 -1.35 2.07 -1.69 -1.91 116.25 113.38 3hx2 h VAL 13 Ca -0.03 -0.41 0.15 0.00 0.82 0.00 0.00 66.70 67.23 3hx2 h VAL 13 Cb 1.04 1.05 -0.09 0.00 -1.52 0.00 0.00 31.29 31.76 3hx2 h VAL 13 CO 0.08 0.14 0.58 -0.08 0.02 0.00 0.00 177.57 178.30 3hx2 h GLU 14 N 0.18 0.81 -0.08 1.57 4.81 -1.45 0.11 114.58 120.54 3hx2 h GLU 14 Ca 0.07 -0.05 -0.24 0.00 -0.13 0.00 0.00 59.36 59.01 3hx2 h GLU 14 Cb 0.13 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.34 3hx2 h GLU 14 CO -0.01 0.53 -0.89 0.00 -0.73 0.00 0.00 179.01 177.92 3hx2 h ALA 15 N 1.58 0.28 -0.30 2.92 0.00 -1.31 -2.67 119.26 119.76 3hx2 h ALA 15 Ca 0.52 -0.65 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 3hx2 h ALA 15 Cb 0.67 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3hx2 h ALA 15 CO -0.33 0.71 -0.10 0.00 0.00 0.00 0.00 179.25 179.53 3hx2 h ALA 16 N 0.57 1.27 0.28 0.00 0.00 -0.52 0.25 119.26 121.11 3hx2 h ALA 16 Ca -0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3hx2 h ALA 16 Cb 1.52 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3hx2 h ALA 16 CO 0.17 0.48 -0.13 0.28 0.00 0.00 0.00 179.25 180.05 3hx2 h VAL 17 N 0.47 0.77 -0.31 0.00 2.07 -0.99 0.29 116.25 118.54 3hx2 h VAL 17 Ca 0.09 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 67.22 3hx2 h VAL 17 Cb 0.46 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 3hx2 h VAL 17 CO 0.02 0.09 0.21 0.78 0.02 0.00 0.00 177.57 178.69 3hx2 h ASN 18 N -0.59 0.32 -0.45 0.57 2.35 -1.30 0.20 115.58 116.68 3hx2 h ASN 18 Ca -0.04 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.62 3hx2 h ASN 18 Cb 0.43 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 3hx2 h ASN 18 CO 0.06 0.23 -0.04 -1.28 -1.65 0.00 0.00 177.43 174.75 3hx2 h SER 19 N 0.37 0.82 0.21 5.81 0.87 -0.51 -2.70 113.55 118.42 3hx2 h SER 19 Ca 0.12 -0.33 -0.15 0.00 -1.23 0.00 0.00 61.79 60.20 3hx2 h SER 19 Cb 0.03 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 3hx2 h SER 19 CO -0.03 0.95 -0.59 0.25 -0.53 0.00 0.00 176.83 176.88 3hx2 h LEU 20 N 0.67 0.44 -0.88 2.23 5.85 0.99 -2.61 115.31 121.99 3hx2 h LEU 20 Ca 0.12 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.63 3hx2 h LEU 20 Cb 0.55 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 3hx2 h LEU 20 CO 0.03 0.93 0.57 0.58 -0.34 0.00 0.00 178.44 180.20 3hx2 h VAL 21 N 0.29 1.15 0.00 1.05 2.07 -0.49 0.19 116.25 120.51 3hx2 h VAL 21 Ca -0.00 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.04 3hx2 h VAL 21 Cb 1.11 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3hx2 h VAL 21 CO 0.10 0.20 -0.49 -1.13 0.02 0.00 0.00 177.57 176.27 3hx2 h ASN 22 N 1.10 0.00 -0.15 0.57 -0.73 -1.35 -1.00 115.58 114.02 3hx2 h ASN 22 Ca 0.35 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.40 3hx2 h ASN 22 Cb -0.00 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.57 3hx2 h ASN 22 CO -0.11 0.49 -0.28 0.25 -0.37 0.00 0.00 177.43 177.41 3hx2 h LEU 23 N 0.00 0.64 0.05 0.34 5.85 -0.65 -0.73 115.31 120.81 3hx2 h LEU 23 Ca -0.00 -0.24 -0.25 0.00 0.84 0.00 0.00 57.88 58.23 3hx2 h LEU 23 Cb 0.91 -0.18 0.02 0.00 0.37 0.00 0.00 40.66 41.78 3hx2 h LEU 23 CO 0.06 0.89 -0.99 1.88 -0.34 0.00 0.00 178.44 179.95 3hx2 h TYR 24 N 0.54 0.90 -0.79 1.25 -1.99 -0.84 -1.31 116.97 114.74 3hx2 h TYR 24 Ca 0.07 -0.52 0.05 0.00 2.00 0.00 0.00 58.73 60.33 3hx2 h TYR 24 Cb 0.76 -0.09 -0.05 0.00 2.00 0.00 0.00 36.73 39.35 3hx2 h TYR 24 CO 0.03 1.36 0.52 -0.07 -0.00 0.00 0.00 178.16 180.01 3hx2 h LEU 25 N 0.19 0.79 -0.21 3.88 3.38 -1.09 0.64 115.31 122.89 3hx2 h LEU 25 Ca -0.14 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3hx2 h LEU 25 Cb 1.67 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 3hx2 h LEU 25 CO 0.19 0.53 0.00 -0.61 0.09 0.00 0.00 178.44 178.64 3hx2 h GLN 26 N 0.91 0.37 -0.02 1.13 5.75 -1.07 -1.48 115.11 120.70 3hx2 h GLN 26 Ca 0.33 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.71 3hx2 h GLN 26 Cb 0.15 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.66 3hx2 h GLN 26 CO -0.11 0.56 0.01 0.00 -2.65 0.00 0.00 178.83 176.64 3hx2 h ALA 27 N 0.80 0.03 -0.70 3.38 0.00 0.07 -1.57 119.26 121.27 3hx2 h ALA 27 Ca 0.06 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.00 3hx2 h ALA 27 Cb 0.39 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 3hx2 h ALA 27 CO 0.01 -0.39 0.31 1.03 0.00 0.00 0.00 179.25 180.21 3hx2 h SER 28 N -0.12 0.36 -0.60 0.00 0.87 0.27 -0.69 113.55 113.64 3hx2 h SER 28 Ca 0.01 0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.60 3hx2 h SER 28 Cb 0.15 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.11 3hx2 h SER 28 CO -0.00 0.20 0.22 0.22 -0.53 0.00 0.00 176.83 176.94 3hx2 h TYR 29 N 0.52 0.93 -0.48 2.24 3.20 -1.10 -2.11 116.97 120.18 3hx2 h TYR 29 Ca 0.36 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 62.16 3hx2 h TYR 29 Cb 0.43 -0.28 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 3hx2 h TYR 29 CO -0.13 0.75 0.30 1.15 -1.64 0.00 0.00 178.16 178.59 3hx2 h THR 30 N 0.84 1.08 -0.06 1.81 2.02 -0.15 -2.07 112.91 116.38 3hx2 h THR 30 Ca 0.20 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 3hx2 h THR 30 Cb 0.23 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3hx2 h THR 30 CO -0.01 0.11 -0.20 1.88 0.37 0.00 0.00 175.52 177.67 3hx2 h TYR 31 N 0.60 0.11 -0.41 3.16 0.05 -0.95 -2.34 116.97 117.19 3hx2 h TYR 31 Ca 0.19 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.90 3hx2 h TYR 31 Cb -0.02 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 3hx2 h TYR 31 CO -0.06 0.30 0.07 1.25 -1.05 0.00 0.00 178.16 178.68 3hx2 h LEU 32 N 0.10 0.65 -0.97 3.88 5.85 -0.69 -0.69 115.31 123.44 3hx2 h LEU 32 Ca 0.02 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.42 3hx2 h LEU 32 Cb 0.41 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3hx2 h LEU 32 CO 0.03 0.74 0.09 -1.28 -0.34 0.00 0.00 178.44 177.68 3hx2 h SER 33 N 0.54 0.79 0.33 1.25 0.87 -1.10 -2.62 113.55 113.62 3hx2 h SER 33 Ca 0.13 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 3hx2 h SER 33 Cb 0.36 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 3hx2 h SER 33 CO 0.01 0.81 -0.16 -0.07 -0.53 0.00 0.00 176.83 176.88 3hx2 h LEU 34 N 0.80 -0.38 -0.29 2.23 3.38 -1.09 -1.44 115.31 118.52 3hx2 h LEU 34 Ca 0.17 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.15 3hx2 h LEU 34 Cb 0.36 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 3hx2 h LEU 34 CO 0.01 -0.20 -0.03 1.23 0.09 0.00 0.00 178.44 179.54 3hx2 h GLY 35 N -0.53 0.25 2.00 0.83 0.00 -1.03 -1.32 103.07 103.27 3hx2 h GLY 35 Ca -0.05 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3hx2 h GLY 35 CO 0.07 -0.08 0.00 0.74 0.00 0.00 0.00 176.54 177.27 3hx2 h PHE 36 N 0.05 0.00 -0.07 5.60 -1.00 -1.47 -2.74 116.94 117.31 3hx2 h PHE 36 Ca 0.14 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.85 3hx2 h PHE 36 Cb 0.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.76 3hx2 h PHE 36 CO -0.24 0.00 -0.22 -0.92 -1.61 0.00 0.00 178.31 175.31 3hx2 h TYR 37 N 0.00 0.37 0.00 -0.55 3.20 -0.13 -3.05 116.97 116.81 3hx2 h TYR 37 Ca 0.00 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.72 3hx2 h TYR 37 Cb 0.46 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.67 3hx2 h TYR 37 CO 0.00 0.84 0.00 1.19 -1.64 0.00 0.00 178.16 178.55 3hx2 n PHE 38 N -4.52 0.00 0.12 -3.82 3.72 -0.88 -2.20 117.46 109.89 3hx2 n PHE 38 Ca -0.08 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.38 3hx2 n PHE 38 Cb 0.44 -0.41 0.02 0.00 -0.94 0.00 0.00 39.48 38.59 3hx2 n PHE 38 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 3hx2 h ASP 39 N 0.00 0.00 -2.57 4.37 1.82 -1.39 -2.14 116.42 116.51 3hx2 h ASP 39 Ca 0.00 0.00 -0.60 0.00 -0.39 0.00 0.00 57.03 56.04 3hx2 h ASP 39 Cb 0.27 0.00 0.14 0.00 0.68 0.00 0.00 39.33 40.42 3hx2 h ASP 39 CO 0.00 0.30 -0.20 0.54 -1.61 0.00 0.00 179.24 178.27 3hx2 n ARG 40 N -2.99 0.82 0.25 0.28 1.74 -0.93 -4.55 116.66 111.28 3hx2 n ARG 40 Ca -0.01 0.30 0.09 0.00 -0.77 0.00 0.00 57.85 57.46 3hx2 n ARG 40 Cb 0.68 -1.69 0.63 0.00 -1.02 0.00 0.00 32.46 31.06 3hx2 n ARG 40 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 3hx2 h ASP 41 N 1.05 0.00 0.26 0.55 2.03 -1.90 0.24 116.42 118.65 3hx2 h ASP 41 Ca -0.41 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.89 3hx2 h ASP 41 Cb 1.38 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.88 3hx2 h ASP 41 CO 0.53 0.13 -0.11 -0.90 -1.03 0.00 0.00 179.24 177.86 3hx2 n ASP 42 N -4.07 0.66 -0.02 4.15 3.85 -1.26 -4.20 116.55 115.65 3hx2 n ASP 42 Ca -0.02 -0.78 -0.04 0.00 -0.71 0.00 0.00 54.79 53.24 3hx2 n ASP 42 Cb 0.21 -0.02 -0.01 0.00 -1.35 0.00 0.00 41.12 39.95 3hx2 n ASP 42 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 3hx2 n VAL 43 N -0.76 1.09 -3.53 2.12 0.31 -0.80 -5.08 118.33 111.68 3hx2 n VAL 43 Ca 0.15 0.27 -0.23 0.00 -0.01 0.00 0.00 64.34 64.53 3hx2 n VAL 43 Cb 0.29 -1.82 0.03 0.00 -0.91 0.00 0.00 33.84 31.42 3hx2 n VAL 43 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hx2 n ALA 44 N -3.68 -2.57 -3.61 3.52 0.00 0.79 -4.99 120.51 109.96 3hx2 n ALA 44 Ca -0.06 -0.15 -0.28 0.00 0.00 0.00 0.00 53.44 52.95 3hx2 n ALA 44 Cb 0.21 -3.38 -0.11 0.00 0.00 0.00 0.00 19.45 16.17 3hx2 n ALA 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hx2 s LEU 45 N -5.67 2.83 0.42 0.00 1.43 -0.81 -4.97 118.68 111.91 3hx2 s LEU 45 Ca 0.32 -3.37 0.17 0.00 -1.03 0.00 0.00 54.13 50.22 3hx2 s LEU 45 Cb -0.10 -0.94 1.07 0.00 0.03 0.00 0.00 46.19 46.24 3hx2 s LEU 45 CO 0.83 -0.14 1.88 -0.08 0.23 0.00 0.00 176.35 179.08 3hx2 h GLU 46 N 5.59 0.40 -0.04 1.70 4.81 -1.95 -0.12 114.58 124.98 3hx2 h GLU 46 Ca 0.21 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 3hx2 h GLU 46 Cb 0.85 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.14 3hx2 h GLU 46 CO 0.51 0.27 0.01 0.78 -0.73 0.00 0.00 179.01 179.85 3hx2 h GLY 47 N 0.41 0.06 0.99 1.92 0.00 -1.95 0.01 103.07 104.51 3hx2 h GLY 47 Ca 0.42 -0.04 -0.08 0.00 0.00 0.00 0.00 47.33 47.64 3hx2 h GLY 47 CO -0.15 0.03 -0.03 -2.08 0.00 0.00 0.00 176.54 174.31 3hx2 h VAL 48 N -0.14 1.27 0.18 4.60 2.07 -1.77 -2.03 116.25 120.43 3hx2 h VAL 48 Ca 0.01 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.45 3hx2 h VAL 48 Cb 0.21 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 3hx2 h VAL 48 CO -0.00 0.38 -0.32 -1.28 0.02 0.00 0.00 177.57 176.37 3hx2 h SER 49 N 0.65 -0.89 -0.30 0.57 0.87 -0.91 -1.87 113.55 111.66 3hx2 h SER 49 Ca 0.12 0.10 0.03 0.00 -1.23 0.00 0.00 61.79 60.81 3hx2 h SER 49 Cb 0.54 0.33 -0.02 0.00 -0.44 0.00 0.00 62.40 62.81 3hx2 h SER 49 CO 0.03 -0.42 0.20 -0.74 -0.53 0.00 0.00 176.83 175.37 3hx2 h HIS 50 N -0.58 0.26 -0.23 2.24 6.17 -0.94 -1.86 115.15 120.21 3hx2 h HIS 50 Ca 0.02 0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.08 3hx2 h HIS 50 Cb 0.58 -0.09 -0.01 0.00 2.52 0.00 0.00 27.41 30.41 3hx2 h HIS 50 CO -0.25 0.15 0.05 0.35 0.71 0.00 0.00 177.93 178.93 3hx2 h PHE 51 N 0.27 0.41 -0.16 5.26 3.57 -0.60 -1.75 116.94 123.94 3hx2 h PHE 51 Ca 0.13 -0.05 -0.16 0.00 3.53 0.00 0.00 57.97 61.41 3hx2 h PHE 51 Cb 0.17 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3hx2 h PHE 51 CO -0.00 0.50 -0.58 0.74 -2.23 0.00 0.00 178.31 176.74 3hx2 h PHE 52 N 0.20 0.63 -0.75 0.41 0.05 -0.98 -2.49 116.94 114.02 3hx2 h PHE 52 Ca 0.07 -0.23 -0.05 0.00 3.82 0.00 0.00 57.97 61.58 3hx2 h PHE 52 Cb 0.31 -0.12 -0.03 0.00 2.00 0.00 0.00 35.95 38.11 3hx2 h PHE 52 CO 0.02 0.96 0.27 0.00 -0.18 0.00 0.00 178.31 179.37 3hx2 h ARG 53 N 0.38 1.13 -0.32 1.51 3.08 -1.31 -0.18 114.38 118.67 3hx2 h ARG 53 Ca 0.00 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.75 3hx2 h ARG 53 Cb 1.12 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.97 3hx2 h ARG 53 CO 0.10 0.93 -0.15 1.49 -1.07 0.00 0.00 179.97 181.28 3hx2 h GLU 54 N 1.09 0.57 -0.25 0.04 4.57 -1.22 -2.57 114.58 116.81 3hx2 h GLU 54 Ca 0.25 -0.18 -0.16 0.00 -1.18 0.00 0.00 59.36 58.09 3hx2 h GLU 54 Cb 0.25 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 3hx2 h GLU 54 CO -0.02 0.70 -0.47 -0.07 -1.18 0.00 0.00 179.01 177.97 3hx2 h LEU 55 N 0.52 0.73 -0.92 1.64 3.38 -0.91 -2.30 115.31 117.45 3hx2 h LEU 55 Ca 0.09 -0.36 0.07 0.00 0.09 0.00 0.00 57.88 57.78 3hx2 h LEU 55 Cb 0.56 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.04 3hx2 h LEU 55 CO 0.04 1.08 0.58 0.00 0.09 0.00 0.00 178.44 180.23 3hx2 h ALA 56 N 0.94 1.29 0.00 1.53 0.00 -0.67 0.60 119.26 122.96 3hx2 h ALA 56 Ca 0.03 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3hx2 h ALA 56 Cb 1.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3hx2 h ALA 56 CO 0.10 0.31 -0.31 1.49 0.00 0.00 0.00 179.25 180.83 3hx2 h GLU 57 N 1.02 0.00 -0.12 0.00 4.57 -1.28 -2.19 114.58 116.59 3hx2 h GLU 57 Ca 0.41 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.40 3hx2 h GLU 57 Cb 0.23 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.82 3hx2 h GLU 57 CO -0.19 0.31 -0.72 0.93 -1.18 0.00 0.00 179.01 178.16 3hx2 h GLU 58 N 0.00 0.55 -0.05 1.92 5.08 -0.36 -2.35 114.58 119.37 3hx2 h GLU 58 Ca -0.00 -0.43 -0.16 0.00 -1.00 0.00 0.00 59.36 57.77 3hx2 h GLU 58 Cb 0.92 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 3hx2 h GLU 58 CO 0.04 1.06 -0.66 0.87 -1.00 0.00 0.00 179.01 179.32 3hx2 h LYS 59 N 0.38 0.22 -0.44 2.33 1.79 -1.02 -1.95 116.57 117.89 3hx2 h LYS 59 Ca -0.03 -0.17 -0.03 0.00 -2.18 0.00 0.00 60.65 58.23 3hx2 h LYS 59 Cb 1.31 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.97 3hx2 h LYS 59 CO 0.13 0.80 0.14 -0.09 -1.08 0.00 0.00 179.45 179.36 3hx2 h ARG 60 N 0.16 0.68 0.00 3.15 2.43 -1.32 -0.65 114.38 118.83 3hx2 h ARG 60 Ca -0.01 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 3hx2 h ARG 60 Cb 1.18 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.63 3hx2 h ARG 60 CO 0.10 0.66 -0.12 0.93 -1.51 0.00 0.00 179.97 180.03 3hx2 h GLU 61 N 0.57 0.00 0.51 0.20 5.08 -1.26 -1.22 114.58 118.46 3hx2 h GLU 61 Ca 0.14 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 3hx2 h GLU 61 Cb 0.26 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.51 3hx2 h GLU 61 CO -0.01 0.12 -0.25 0.78 -1.00 0.00 0.00 179.01 178.65 3hx2 h GLY 62 N 1.06 -0.72 2.00 -3.84 0.00 -0.37 -2.05 103.07 99.16 3hx2 h GLY 62 Ca -0.00 0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.55 3hx2 h GLY 62 CO 0.02 -0.26 -0.22 0.10 0.00 0.00 0.00 176.54 176.17 3hx2 h TYR 63 N -1.17 0.00 -0.22 5.60 -0.00 -1.15 -1.49 116.97 118.55 3hx2 h TYR 63 Ca -0.07 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.52 3hx2 h TYR 63 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.25 3hx2 h TYR 63 CO 0.00 0.22 -0.43 0.93 -0.00 0.00 0.00 178.16 178.88 3hx2 h GLU 64 N 0.00 0.54 0.00 0.10 5.08 -1.29 -1.06 114.58 117.95 3hx2 h GLU 64 Ca -0.00 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 57.98 3hx2 h GLU 64 Cb 0.45 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 3hx2 h GLU 64 CO 0.03 0.87 -0.45 -0.09 -1.00 0.00 0.00 179.01 178.37 3hx2 h ARG 65 N 0.44 0.00 -0.06 2.33 2.43 -0.58 -2.06 114.38 116.88 3hx2 h ARG 65 Ca 0.03 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.14 3hx2 h ARG 65 Cb 0.94 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 3hx2 h ARG 65 CO 0.08 0.45 -0.21 -0.07 -1.51 0.00 0.00 179.97 178.72 3hx2 h LEU 66 N 0.00 0.29 -1.18 3.80 3.38 -0.88 -2.72 115.31 118.00 3hx2 h LEU 66 Ca -0.00 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.32 3hx2 h LEU 66 Cb 0.92 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 3hx2 h LEU 66 CO 0.06 0.86 0.22 -0.07 0.09 0.00 0.00 178.44 179.59 3hx2 h LEU 67 N -0.27 0.72 -0.84 1.67 3.38 -1.12 0.48 115.31 119.33 3hx2 h LEU 67 Ca -0.01 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 3hx2 h LEU 67 Cb 0.83 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 3hx2 h LEU 67 CO 0.04 0.65 -0.19 0.50 0.09 0.00 0.00 178.44 179.53 3hx2 h LYS 68 N 0.78 0.66 -0.21 1.13 1.63 -1.41 -2.33 116.57 116.82 3hx2 h LYS 68 Ca 0.19 -0.24 -0.20 0.00 -0.85 0.00 0.00 60.65 59.55 3hx2 h LYS 68 Cb 0.15 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 3hx2 h LYS 68 CO -0.02 0.81 -0.65 1.98 -3.45 0.00 0.00 179.45 178.12 3hx2 h MET 69 N 0.59 0.77 0.11 1.90 4.05 -1.03 -2.69 114.93 118.63 3hx2 h MET 69 Ca 0.09 -0.55 0.02 0.00 -0.28 0.00 0.00 59.70 58.98 3hx2 h MET 69 Cb 0.65 0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 31.49 3hx2 h MET 69 CO 0.05 1.17 -0.39 0.37 0.23 0.00 0.00 176.91 178.34 3hx2 h GLN 70 N 0.56 -0.59 0.00 0.39 5.75 -0.59 -1.23 115.11 119.39 3hx2 h GLN 70 Ca -0.02 0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 3hx2 h GLN 70 Cb 1.26 0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.94 3hx2 h GLN 70 CO 0.13 -0.40 -0.12 -0.91 -2.65 0.00 0.00 178.83 174.89 3hx2 h ASN 71 N -0.62 0.00 0.37 -0.69 2.35 -1.48 -1.60 115.58 113.92 3hx2 h ASN 71 Ca 0.03 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.62 3hx2 h ASN 71 Cb 0.65 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 3hx2 h ASN 71 CO -0.24 0.12 -0.65 1.56 -1.65 0.00 0.00 177.43 176.58 3hx2 h GLN 72 N 0.00 0.26 0.00 0.81 1.08 -0.95 -3.15 115.11 113.16 3hx2 h GLN 72 Ca -0.00 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.00 3hx2 h GLN 72 Cb 0.31 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 3hx2 h GLN 72 CO 0.02 0.82 -0.34 0.00 -0.95 0.00 0.00 178.83 178.38 3hx2 h ARG 73 N 0.19 0.00 0.00 1.46 2.47 -0.75 -3.48 114.38 114.27 3hx2 h ARG 73 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 3hx2 h ARG 73 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 3hx2 h ARG 73 CO 0.10 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.04 3hx2 n GLY 74 N 1.16 0.77 3.87 0.04 0.00 -1.01 -3.76 105.19 106.26 3hx2 n GLY 74 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3hx2 n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hx2 s GLY 75 N -0.89 1.65 -0.07 -0.02 0.00 -0.65 -4.37 107.32 102.97 3hx2 s GLY 75 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 44.72 43.92 3hx2 s GLY 75 CO 0.00 -0.21 -0.13 0.50 0.00 0.00 0.00 173.10 173.26 3hx2 s ARG 76 N -5.62 1.87 0.26 2.90 1.81 -1.26 -4.18 118.95 114.73 3hx2 s ARG 76 Ca 0.67 -0.47 -0.30 0.00 -1.72 0.00 0.00 55.73 53.92 3hx2 s ARG 76 Cb -0.09 -1.53 -0.09 0.00 -0.45 0.00 0.00 34.95 32.78 3hx2 s ARG 76 CO 0.51 0.03 1.14 0.00 -0.68 0.00 0.00 175.30 176.30 3hx2 s ALA 77 N 0.68 3.42 -0.13 2.13 0.00 -1.26 -4.99 121.76 121.61 3hx2 s ALA 77 Ca -0.14 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 52.74 3hx2 s ALA 77 Cb -0.16 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.64 3hx2 s ALA 77 CO 0.04 -0.25 -0.00 -0.51 0.00 0.00 0.00 175.76 175.03 3hx2 s LEU 78 N -1.17 0.99 0.15 0.00 1.43 -1.26 -5.14 118.68 113.69 3hx2 s LEU 78 Ca 0.47 -0.44 -0.10 0.00 -1.03 0.00 0.00 54.13 53.04 3hx2 s LEU 78 Cb -0.33 -0.60 -0.06 0.00 0.03 0.00 0.00 46.19 45.23 3hx2 s LEU 78 CO 0.41 -0.22 0.47 -0.36 0.23 0.00 0.00 176.35 176.88 3hx2 s PHE 79 N 1.86 3.51 0.37 0.29 0.08 -1.26 -4.87 117.98 117.96 3hx2 s PHE 79 Ca 0.02 0.82 0.06 0.00 0.12 0.00 0.00 56.93 57.96 3hx2 s PHE 79 Cb -0.14 -2.20 -0.07 0.00 -0.57 0.00 0.00 43.02 40.03 3hx2 s PHE 79 CO -0.07 0.40 0.00 -0.65 -0.10 0.00 0.00 175.22 174.81 3hx2 s GLN 80 N -2.36 1.83 0.34 0.44 -1.52 -1.26 -5.11 119.66 112.03 3hx2 s GLN 80 Ca 0.40 -2.01 -0.29 0.00 -1.95 0.00 0.00 55.36 51.51 3hx2 s GLN 80 Cb -0.13 -1.41 -0.11 0.00 -0.22 0.00 0.00 33.01 31.14 3hx2 s GLN 80 CO 0.21 -0.05 1.38 -0.51 -0.25 0.00 0.00 175.29 176.06 3hx2 s ASP 81 N -3.62 6.62 -0.34 5.90 -0.00 -1.26 -4.96 116.67 119.01 3hx2 s ASP 81 Ca 0.35 2.82 -0.17 0.00 -0.00 0.00 0.00 52.55 55.54 3hx2 s ASP 81 Cb 0.08 -2.65 -0.01 0.00 -0.00 0.00 0.00 42.92 40.34 3hx2 s ASP 81 CO 0.17 -0.66 0.47 -0.63 -0.00 0.00 0.00 175.17 174.52 3hx2 s ILE 82 N -1.08 5.06 0.33 0.77 1.01 -1.26 -5.05 121.20 120.98 3hx2 s ILE 82 Ca 0.51 0.32 -0.28 0.00 0.00 0.00 0.00 60.65 61.19 3hx2 s ILE 82 Cb -0.42 -3.91 -0.10 0.00 0.01 0.00 0.00 42.46 38.04 3hx2 s ILE 82 CO 0.56 -0.15 1.26 -0.54 0.00 0.00 0.00 174.94 176.07 3hx2 s LYS 83 N 2.29 4.36 0.66 2.79 1.02 -1.26 -5.00 119.74 124.60 3hx2 s LYS 83 Ca 0.17 2.12 -0.16 0.00 0.02 0.00 0.00 55.97 58.13 3hx2 s LYS 83 Cb -0.16 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.11 3hx2 s LYS 83 CO 0.12 -0.15 1.16 -1.59 -0.92 0.00 0.00 175.35 173.98 3hx2 s LYS 84 N -1.79 2.64 0.64 1.68 -2.85 -1.26 -4.89 119.74 113.91 3hx2 s LYS 84 Ca 0.49 1.60 -0.17 0.00 -1.00 0.00 0.00 55.97 56.89 3hx2 s LYS 84 Cb -0.38 -1.91 -0.06 0.00 -2.06 0.00 0.00 37.83 33.42 3hx2 s LYS 84 CO 0.50 -1.42 0.60 -2.30 0.10 0.00 0.00 175.35 172.83 3hx2 n PRO 85 N -2.31 0.48 0.32 1.78 -0.02 -1.26 -4.88 135.00 129.11 3hx2 n PRO 85 Ca 0.12 0.20 0.21 0.00 -2.02 0.00 0.00 63.50 62.01 3hx2 n PRO 85 Cb 0.51 -1.83 1.08 0.00 -0.02 0.00 0.00 33.50 33.24 3hx2 n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hx2 h ALA 86 N 0.01 1.00 -2.27 3.55 0.00 -1.96 -3.44 119.26 116.15 3hx2 h ALA 86 Ca -0.46 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 3hx2 h ALA 86 Cb 1.37 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 19.01 3hx2 h ALA 86 CO 0.46 0.00 -0.68 -1.21 0.00 0.00 0.00 179.25 177.82 3hx2 s GLU 87 N -4.02 0.71 -0.07 0.00 0.41 -1.26 -5.03 118.70 109.44 3hx2 s GLU 87 Ca -0.03 -1.28 0.18 0.00 -0.41 0.00 0.00 54.97 53.42 3hx2 s GLU 87 Cb 0.12 0.13 -0.27 0.00 -1.78 0.00 0.00 34.13 32.33 3hx2 s GLU 87 CO 0.43 -0.12 0.32 -0.25 -0.49 0.00 0.00 175.26 175.15 3hx2 n ASP 88 N 0.04 0.62 -3.89 -0.19 8.00 -1.26 -4.91 116.55 114.96 3hx2 n ASP 88 Ca -0.12 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.20 3hx2 n ASP 88 Cb 0.61 1.60 -0.16 0.00 -0.02 0.00 0.00 41.12 43.16 3hx2 n ASP 88 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3hx2 s GLU 89 N -3.07 0.52 0.00 -1.24 2.02 -1.26 -5.02 118.70 110.66 3hx2 s GLU 89 Ca -0.08 -0.07 0.21 0.00 0.02 0.00 0.00 54.97 55.05 3hx2 s GLU 89 Cb 0.10 -0.58 0.57 0.00 0.10 0.00 0.00 34.13 34.32 3hx2 s GLU 89 CO 0.78 -0.04 1.48 0.91 0.02 0.00 0.00 175.26 178.41 3hx2 n TRP 90 N 3.73 0.85 -1.87 1.61 7.02 -1.26 -5.07 117.44 122.44 3hx2 n TRP 90 Ca -0.22 -0.47 0.00 0.00 -1.02 0.00 0.00 57.50 55.79 3hx2 n TRP 90 Cb 0.53 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.41 3hx2 n TRP 90 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3hx2 n GLY 91 N 1.47 1.71 3.98 6.99 0.00 -1.26 -3.63 105.19 114.44 3hx2 n GLY 91 Ca 0.22 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 3hx2 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hx2 s LYS 92 N 0.00 2.71 0.19 1.61 1.02 -1.26 -4.92 119.74 119.09 3hx2 s LYS 92 Ca 0.00 -0.83 -0.18 0.00 0.02 0.00 0.00 55.97 54.98 3hx2 s LYS 92 Cb 0.00 -2.56 0.15 0.00 -0.52 0.00 0.00 37.83 34.90 3hx2 s LYS 92 CO 0.00 -0.52 1.61 1.15 -0.92 0.00 0.00 175.35 176.67 3hx2 h THR 93 N 0.27 0.30 -0.77 2.17 2.02 -2.00 -1.99 112.91 112.91 3hx2 h THR 93 Ca -0.43 0.00 0.07 0.00 0.77 0.00 0.00 66.41 66.83 3hx2 h THR 93 Cb 1.28 0.30 -0.06 0.00 -1.74 0.00 0.00 68.15 67.93 3hx2 h THR 93 CO 0.52 0.00 0.44 -0.65 0.37 0.00 0.00 175.52 176.20 3hx2 h PRO 94 N -0.11 0.76 -0.04 6.66 0.11 -1.95 -0.68 132.00 136.75 3hx2 h PRO 94 Ca 0.24 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.30 3hx2 h PRO 94 Cb 0.49 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 3hx2 h PRO 94 CO -0.60 0.50 0.02 -0.44 -0.21 0.00 0.00 178.00 177.27 3hx2 h ASP 95 N 0.79 0.05 -0.61 -2.05 3.45 -1.72 -1.69 116.42 114.64 3hx2 h ASP 95 Ca 0.36 -0.17 0.05 0.00 0.43 0.00 0.00 57.03 57.70 3hx2 h ASP 95 Cb 0.26 -0.01 -0.05 0.00 -0.56 0.00 0.00 39.33 38.96 3hx2 h ASP 95 CO -0.21 0.21 0.33 0.00 -1.57 0.00 0.00 179.24 178.00 3hx2 h ALA 96 N 0.85 0.80 -0.70 3.45 0.00 -1.01 -1.56 119.26 121.09 3hx2 h ALA 96 Ca 0.01 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3hx2 h ALA 96 Cb 0.17 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3hx2 h ALA 96 CO -0.00 0.01 0.27 1.98 0.00 0.00 0.00 179.25 181.51 3hx2 h MET 97 N 0.63 1.04 -0.69 0.00 -1.53 -0.99 -1.96 114.93 111.42 3hx2 h MET 97 Ca 0.27 -0.18 -0.03 0.00 -3.44 0.00 0.00 59.70 56.31 3hx2 h MET 97 Cb 0.14 -0.17 -0.03 0.00 -0.55 0.00 0.00 31.60 30.99 3hx2 h MET 97 CO -0.16 0.85 0.30 0.87 0.14 0.00 0.00 176.91 178.91 3hx2 h LYS 98 N 1.01 1.02 -0.51 0.39 1.57 -0.59 -0.78 116.57 118.68 3hx2 h LYS 98 Ca 0.23 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3hx2 h LYS 98 Cb 0.21 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 3hx2 h LYS 98 CO -0.02 0.83 0.32 0.00 -0.57 0.00 0.00 179.45 180.01 3hx2 h ALA 99 N 1.14 0.64 -0.63 3.86 0.00 -0.79 -0.25 119.26 123.23 3hx2 h ALA 99 Ca 0.23 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 3hx2 h ALA 99 Cb 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hx2 h ALA 99 CO -0.02 0.04 0.08 0.00 0.00 0.00 0.00 179.25 179.35 3hx2 h ALA 100 N 1.21 0.95 -0.45 0.00 0.00 -0.97 -1.01 119.26 118.98 3hx2 h ALA 100 Ca 0.19 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hx2 h ALA 100 Cb -0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3hx2 h ALA 100 CO -0.07 0.65 0.27 1.98 0.00 0.00 0.00 179.25 182.09 3hx2 h MET 101 N 0.98 0.61 -0.17 0.00 -1.53 -0.70 -0.23 114.93 113.89 3hx2 h MET 101 Ca 0.19 -0.05 0.02 0.00 -3.44 0.00 0.00 59.70 56.41 3hx2 h MET 101 Cb 0.45 -0.13 -0.02 0.00 -0.55 0.00 0.00 31.60 31.35 3hx2 h MET 101 CO 0.02 0.45 0.06 0.00 0.14 0.00 0.00 176.91 177.57 3hx2 h ALA 102 N 1.13 0.18 -0.73 0.39 0.00 -0.65 -1.12 119.26 118.46 3hx2 h ALA 102 Ca 0.16 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3hx2 h ALA 102 Cb -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3hx2 h ALA 102 CO -0.03 -0.38 0.43 1.25 0.00 0.00 0.00 179.25 180.52 3hx2 h LEU 103 N 0.14 0.88 -0.62 0.00 5.85 -0.87 -1.60 115.31 119.09 3hx2 h LEU 103 Ca 0.07 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 3hx2 h LEU 103 Cb 0.04 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3hx2 h LEU 103 CO -0.07 0.69 0.13 -0.33 -0.34 0.00 0.00 178.44 178.51 3hx2 h GLU 104 N 0.99 1.01 -0.89 1.25 4.39 -0.76 -0.75 114.58 119.84 3hx2 h GLU 104 Ca 0.26 -0.26 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 3hx2 h GLU 104 Cb -0.02 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 28.46 3hx2 h GLU 104 CO -0.05 0.93 0.46 0.87 -1.16 0.00 0.00 179.01 180.07 3hx2 h LYS 105 N 0.93 1.25 -0.21 2.33 1.57 -0.92 0.20 116.57 121.71 3hx2 h LYS 105 Ca 0.19 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3hx2 h LYS 105 Cb 0.40 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3hx2 h LYS 105 CO 0.01 0.93 0.08 -0.22 -0.57 0.00 0.00 179.45 179.68 3hx2 h LYS 106 N 1.25 0.31 -0.50 3.15 3.64 -0.97 0.56 116.57 124.01 3hx2 h LYS 106 Ca 0.31 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 3hx2 h LYS 106 Cb 0.06 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 3hx2 h LYS 106 CO -0.05 0.37 0.24 -0.07 -2.27 0.00 0.00 179.45 177.68 3hx2 h LEU 107 N 0.19 0.65 -0.33 5.20 3.38 -0.77 -0.81 115.31 122.82 3hx2 h LEU 107 Ca 0.07 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.92 3hx2 h LEU 107 Cb 0.17 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3hx2 h LEU 107 CO -0.01 0.59 0.21 -1.13 0.09 0.00 0.00 178.44 178.19 3hx2 h ASN 108 N 0.66 0.35 -0.65 -0.43 -1.24 -0.43 0.49 115.58 114.33 3hx2 h ASN 108 Ca 0.17 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.18 3hx2 h ASN 108 Cb 0.11 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.05 3hx2 h ASN 108 CO -0.02 0.25 0.41 -0.61 -1.29 0.00 0.00 177.43 176.17 3hx2 h GLN 109 N 0.42 0.87 -0.88 6.67 5.75 -0.61 0.17 115.11 127.50 3hx2 h GLN 109 Ca 0.12 -0.07 0.04 0.00 -0.15 0.00 0.00 58.65 58.60 3hx2 h GLN 109 Cb -0.03 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 28.28 3hx2 h GLN 109 CO -0.04 0.60 0.58 0.00 -2.65 0.00 0.00 178.83 177.31 3hx2 h ALA 110 N 1.22 1.46 -0.40 3.38 0.00 -0.60 0.02 119.26 124.33 3hx2 h ALA 110 Ca 0.24 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 3hx2 h ALA 110 Cb -0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3hx2 h ALA 110 CO -0.05 0.45 -0.35 -0.07 0.00 0.00 0.00 179.25 179.24 3hx2 h LEU 111 N 1.09 0.99 -0.51 0.00 3.38 0.05 -2.43 115.31 117.88 3hx2 h LEU 111 Ca 0.35 -0.44 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 3hx2 h LEU 111 Cb 0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3hx2 h LEU 111 CO -0.11 1.23 -0.34 -0.07 0.09 0.00 0.00 178.44 179.24 3hx2 h LEU 112 N 0.78 0.89 -0.94 1.67 3.38 -0.24 -1.81 115.31 119.03 3hx2 h LEU 112 Ca 0.07 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 3hx2 h LEU 112 Cb 0.93 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 3hx2 h LEU 112 CO 0.09 1.14 0.15 0.44 0.09 0.00 0.00 178.44 180.35 3hx2 h ASP 113 N 0.70 0.86 -0.33 -0.43 3.45 -1.00 -0.39 116.42 119.29 3hx2 h ASP 113 Ca 0.07 -0.16 -0.12 0.00 0.43 0.00 0.00 57.03 57.25 3hx2 h ASP 113 Cb 0.91 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.44 3hx2 h ASP 113 CO 0.08 0.84 -0.25 0.25 -1.57 0.00 0.00 179.24 178.59 3hx2 h LEU 114 N 0.89 0.80 -0.89 1.55 5.85 -1.28 -0.89 115.31 121.34 3hx2 h LEU 114 Ca 0.19 -0.44 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 3hx2 h LEU 114 Cb 0.31 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3hx2 h LEU 114 CO -0.00 1.07 0.27 -0.74 -0.34 0.00 0.00 178.44 178.69 3hx2 h HIS 115 N 0.53 1.10 -0.35 1.25 2.76 -1.04 0.22 115.15 119.62 3hx2 h HIS 115 Ca 0.06 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 3hx2 h HIS 115 Cb 0.81 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 3hx2 h HIS 115 CO 0.07 0.85 0.23 0.00 -1.30 0.00 0.00 177.93 177.77 3hx2 h ALA 116 N 1.24 0.44 -0.91 5.26 0.00 -0.85 0.49 119.26 124.93 3hx2 h ALA 116 Ca 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3hx2 h ALA 116 Cb 0.23 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3hx2 h ALA 116 CO -0.02 -0.09 0.50 1.25 0.00 0.00 0.00 179.25 180.89 3hx2 h LEU 117 N 0.47 1.14 -1.28 0.00 5.85 -0.47 -1.23 115.31 119.79 3hx2 h LEU 117 Ca 0.13 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 3hx2 h LEU 117 Cb -0.05 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.67 3hx2 h LEU 117 CO -0.03 0.91 0.14 1.23 -0.34 0.00 0.00 178.44 180.35 3hx2 h GLY 118 N 1.28 0.68 1.00 3.75 0.00 0.38 -0.96 103.07 109.20 3hx2 h GLY 118 Ca 0.32 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 47.18 3hx2 h GLY 118 CO -0.05 0.33 -0.30 1.76 0.00 0.00 0.00 176.54 178.28 3hx2 h SER 119 N 0.63 0.79 -0.88 0.19 0.02 -0.16 0.13 113.55 114.27 3hx2 h SER 119 Ca 0.15 -0.47 -0.02 0.00 -0.84 0.00 0.00 61.79 60.61 3hx2 h SER 119 Cb 0.18 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 3hx2 h SER 119 CO -0.01 1.10 0.47 0.00 -1.14 0.00 0.00 176.83 177.25 3hx2 h ALA 120 N 0.72 1.15 -0.24 3.77 0.00 -0.76 -1.81 119.26 122.09 3hx2 h ALA 120 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hx2 h ALA 120 Cb 0.87 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hx2 h ALA 120 CO 0.07 0.67 0.00 0.54 0.00 0.00 0.00 179.25 180.53 3hx2 n ARG 121 N -4.32 1.65 -3.83 0.00 5.12 -0.41 -4.94 116.66 109.92 3hx2 n ARG 121 Ca 0.09 -0.99 -0.36 0.00 -1.93 0.00 0.00 57.85 54.65 3hx2 n ARG 121 Cb 0.11 -1.28 0.03 0.00 -1.16 0.00 0.00 32.46 30.17 3hx2 n ARG 121 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3hx2 n THR 122 N 0.27 -4.63 -3.82 0.55 -2.24 -0.68 -4.95 114.28 98.78 3hx2 n THR 122 Ca 0.12 -0.82 -0.32 0.00 -2.27 0.00 0.00 64.05 60.76 3hx2 n THR 122 Cb 0.26 -3.55 -0.11 0.00 -2.10 0.00 0.00 70.33 64.83 3hx2 n THR 122 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hx2 s ASP 123 N -3.55 5.07 0.50 3.42 2.15 0.38 -4.95 116.67 119.69 3hx2 s ASP 123 Ca 0.45 -3.49 0.18 0.00 0.43 0.00 0.00 52.55 50.12 3hx2 s ASP 123 Cb -0.19 -1.74 1.22 0.00 -0.30 0.00 0.00 42.92 41.91 3hx2 s ASP 123 CO 0.90 -0.18 2.06 1.55 -0.17 0.00 0.00 175.17 179.33 3hx2 h PRO 124 N 6.03 0.13 0.13 4.34 0.13 -1.93 -2.74 132.00 138.09 3hx2 h PRO 124 Ca 0.08 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.19 3hx2 h PRO 124 Cb 0.83 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3hx2 h PRO 124 CO 0.74 0.09 -0.06 1.25 -0.23 0.00 0.00 178.00 179.79 3hx2 h HIS 125 N 0.13 -0.16 -0.68 1.56 2.76 -1.97 0.13 115.15 116.93 3hx2 h HIS 125 Ca 0.15 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.32 3hx2 h HIS 125 Cb 0.41 0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.39 3hx2 h HIS 125 CO -0.00 0.06 0.45 1.25 -1.30 0.00 0.00 177.93 178.39 3hx2 h LEU 126 N -0.36 0.77 0.04 0.26 5.85 -1.91 0.99 115.31 120.96 3hx2 h LEU 126 Ca -0.02 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 3hx2 h LEU 126 Cb 0.29 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3hx2 h LEU 126 CO 0.03 0.55 -0.02 0.00 -0.34 0.00 0.00 178.44 178.66 3hx2 h ASP 128 N -0.33 0.25 -0.49 0.00 3.58 -0.29 -1.04 116.42 118.09 3hx2 h ASP 128 Ca -0.01 0.02 0.06 0.00 0.42 0.00 0.00 57.03 57.53 3hx2 h ASP 128 Cb 0.30 -0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.27 3hx2 h ASP 128 CO 0.01 0.18 0.20 0.15 -2.88 0.00 0.00 179.24 176.90 3hx2 h PHE 129 N 0.36 0.35 -0.32 0.28 3.04 -0.75 0.23 116.94 120.13 3hx2 h PHE 129 Ca 0.16 0.02 -0.14 0.00 3.98 0.00 0.00 57.97 62.00 3hx2 h PHE 129 Cb 0.09 -0.08 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 3hx2 h PHE 129 CO -0.11 0.13 -0.35 -0.07 -2.02 0.00 0.00 178.31 175.89 3hx2 h LEU 130 N 0.39 0.85 -0.65 0.59 3.38 -1.03 -1.86 115.31 116.98 3hx2 h LEU 130 Ca 0.23 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.72 3hx2 h LEU 130 Cb 0.22 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3hx2 h LEU 130 CO -0.22 1.16 0.41 -0.33 0.09 0.00 0.00 178.44 179.55 3hx2 h GLU 131 N 0.57 0.87 -0.10 1.13 5.08 -0.82 0.17 114.58 121.47 3hx2 h GLU 131 Ca 0.05 -0.07 -0.18 0.00 -1.00 0.00 0.00 59.36 58.16 3hx2 h GLU 131 Cb 0.93 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.00 3hx2 h GLU 131 CO 0.08 0.60 -0.62 1.15 -1.00 0.00 0.00 179.01 179.22 3hx2 h THR 132 N 0.88 1.34 -0.00 1.13 2.02 -0.95 -3.37 112.91 113.95 3hx2 h THR 132 Ca 0.23 -1.92 0.00 0.00 0.77 0.00 0.00 66.41 65.50 3hx2 h THR 132 Cb -0.06 2.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 3hx2 h THR 132 CO -0.05 0.58 -0.30 1.41 0.37 0.00 0.00 175.52 177.53 3hx2 n HIS 133 N -4.13 0.00 0.01 3.16 8.25 -0.70 -4.89 115.22 116.91 3hx2 n HIS 133 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 3hx2 n HIS 133 Cb 0.67 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.78 3hx2 n HIS 133 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3hx2 n PHE 134 N -0.72 -0.09 -0.00 4.41 3.72 -0.22 -4.76 117.46 119.79 3hx2 n PHE 134 Ca 0.03 0.02 -0.15 0.00 -0.05 0.00 0.00 57.45 57.30 3hx2 n PHE 134 Cb 0.17 0.15 -0.09 0.00 -0.94 0.00 0.00 39.48 38.76 3hx2 n PHE 134 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3hx2 h LEU 135 N 0.00 -1.64 -1.24 4.37 3.38 -1.21 -1.77 115.31 117.21 3hx2 h LEU 135 Ca 0.00 0.20 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 3hx2 h LEU 135 Cb 0.63 0.64 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 3hx2 h LEU 135 CO 0.00 -0.48 -0.37 -0.78 0.09 0.00 0.00 178.44 176.90 3hx2 h ASP 136 N -0.57 0.00 -0.46 -0.43 -0.00 -1.84 -2.75 116.42 110.36 3hx2 h ASP 136 Ca 0.04 0.00 -0.08 0.00 -0.00 0.00 0.00 57.03 56.99 3hx2 h ASP 136 Cb 0.68 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.99 3hx2 h ASP 136 CO -0.43 0.37 0.00 -0.33 -0.00 0.00 0.00 179.24 178.86 3hx2 h GLU 137 N 0.00 0.88 -0.10 0.28 4.39 -1.77 -2.16 114.58 116.09 3hx2 h GLU 137 Ca -0.00 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.41 3hx2 h GLU 137 Cb 0.69 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 3hx2 h GLU 137 CO 0.05 0.87 -0.08 0.93 -1.16 0.00 0.00 179.01 179.62 3hx2 h GLU 138 N 0.81 0.23 -0.09 2.33 4.39 -1.11 -2.25 114.58 118.89 3hx2 h GLU 138 Ca 0.15 -0.12 0.04 0.00 0.34 0.00 0.00 59.36 59.77 3hx2 h GLU 138 Cb 0.48 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.09 3hx2 h GLU 138 CO 0.02 0.64 -0.17 0.28 -1.16 0.00 0.00 179.01 178.62 3hx2 h VAL 139 N -0.16 0.57 -1.00 3.13 2.07 -1.44 0.58 116.25 119.99 3hx2 h VAL 139 Ca 0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.61 3hx2 h VAL 139 Cb 0.59 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 3hx2 h VAL 139 CO 0.02 0.00 0.64 0.11 0.02 0.00 0.00 177.57 178.36 3hx2 h LYS 140 N -0.23 1.12 -0.13 1.57 1.57 -1.42 -1.26 116.57 117.79 3hx2 h LYS 140 Ca 0.08 -0.07 -0.20 0.00 -1.87 0.00 0.00 60.65 58.60 3hx2 h LYS 140 Cb 0.35 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3hx2 h LYS 140 CO -0.23 0.74 -0.72 1.25 -0.57 0.00 0.00 179.45 179.92 3hx2 h LEU 141 N 1.15 0.69 -0.35 2.94 5.85 -0.78 -1.91 115.31 122.90 3hx2 h LEU 141 Ca 0.44 -0.44 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3hx2 h LEU 141 Cb 0.21 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3hx2 h LEU 141 CO -0.19 1.20 -0.01 0.40 -0.34 0.00 0.00 178.44 179.51 3hx2 h ILE 142 N 0.41 1.26 -0.29 4.05 2.04 -0.44 -1.43 117.51 123.10 3hx2 h ILE 142 Ca -0.03 -0.99 0.02 0.00 1.00 0.00 0.00 64.86 64.86 3hx2 h ILE 142 Cb 1.31 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.58 3hx2 h ILE 142 CO 0.14 0.33 0.15 0.50 0.00 0.00 0.00 178.15 179.27 3hx2 h LYS 143 N 0.43 0.31 -0.83 2.37 1.63 -1.26 0.33 116.57 119.55 3hx2 h LYS 143 Ca 0.10 -0.02 0.07 0.00 -0.85 0.00 0.00 60.65 59.95 3hx2 h LYS 143 Cb 0.46 -0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 31.96 3hx2 h LYS 143 CO 0.02 0.21 0.50 -0.22 -3.45 0.00 0.00 179.45 176.50 3hx2 h LYS 144 N 0.32 0.86 -0.05 1.90 3.64 -1.16 -0.36 116.57 121.72 3hx2 h LYS 144 Ca 0.12 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.31 3hx2 h LYS 144 Cb 0.03 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 3hx2 h LYS 144 CO -0.07 0.57 -0.60 0.52 -2.27 0.00 0.00 179.45 177.59 3hx2 h MET 145 N 0.88 0.16 0.10 1.90 2.86 -0.71 -2.22 114.93 117.91 3hx2 h MET 145 Ca 0.38 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.90 3hx2 h MET 145 Cb 0.25 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.92 3hx2 h MET 145 CO -0.20 0.71 -0.05 0.78 1.06 0.00 0.00 176.91 179.21 3hx2 h GLY 146 N 1.57 -0.14 0.30 8.32 0.00 0.39 0.10 103.07 113.62 3hx2 h GLY 146 Ca -0.01 0.05 0.08 0.00 0.00 0.00 0.00 47.33 47.46 3hx2 h GLY 146 CO 0.09 -0.05 0.02 -0.55 0.00 0.00 0.00 176.54 176.05 3hx2 h ASP 147 N -0.26 -0.14 -0.38 0.19 5.19 -1.03 -0.38 116.42 119.61 3hx2 h ASP 147 Ca -0.01 0.10 0.06 0.00 -0.62 0.00 0.00 57.03 56.55 3hx2 h ASP 147 Cb 0.22 0.17 -0.05 0.00 0.18 0.00 0.00 39.33 39.84 3hx2 h ASP 147 CO 0.02 -0.04 0.09 0.45 -3.12 0.00 0.00 179.24 176.64 3hx2 h HIS 148 N 0.14 0.14 -0.60 4.55 3.86 -1.11 0.14 115.15 122.27 3hx2 h HIS 148 Ca 0.22 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.48 3hx2 h HIS 148 Cb 0.32 -0.01 -0.04 0.00 1.06 0.00 0.00 27.41 28.75 3hx2 h HIS 148 CO -0.27 0.03 0.37 -0.07 0.86 0.00 0.00 177.93 178.85 3hx2 h LEU 149 N 0.21 0.62 -0.07 2.43 3.38 0.34 0.68 115.31 122.90 3hx2 h LEU 149 Ca 0.18 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3hx2 h LEU 149 Cb 0.20 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 3hx2 h LEU 149 CO -0.23 0.44 0.04 0.74 0.09 0.00 0.00 178.44 179.52 3hx2 h THR 150 N 0.74 1.07 0.00 0.22 2.02 -0.50 -0.76 112.91 115.70 3hx2 h THR 150 Ca 0.24 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 3hx2 h THR 150 Cb -0.01 1.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3hx2 h THR 150 CO -0.09 0.06 -0.03 0.78 0.37 0.00 0.00 175.52 176.61 3hx2 h ASN 151 N 0.04 0.00 0.16 4.18 2.35 -0.62 -0.38 115.58 121.30 3hx2 h ASN 151 Ca 0.03 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.52 3hx2 h ASN 151 Cb 0.06 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.46 3hx2 h ASN 151 CO -0.00 0.03 -1.11 -0.07 -1.65 0.00 0.00 177.43 174.63 3hx2 h LEU 152 N 0.00 0.70 -0.61 1.61 3.38 -0.29 -3.00 115.31 117.10 3hx2 h LEU 152 Ca -0.00 -0.89 -0.07 0.00 0.09 0.00 0.00 57.88 57.01 3hx2 h LEU 152 Cb 0.38 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3hx2 h LEU 152 CO 0.00 1.53 0.09 -0.74 0.09 0.00 0.00 178.44 179.42 3hx2 h HIS 153 N -0.02 1.08 -0.71 1.13 2.76 -0.79 -2.99 115.15 115.62 3hx2 h HIS 153 Ca -0.18 -0.15 0.06 0.00 -2.20 0.00 0.00 60.37 57.90 3hx2 h HIS 153 Cb 1.84 -0.29 -0.06 0.00 1.55 0.00 0.00 27.41 30.45 3hx2 h HIS 153 CO 0.15 0.93 0.40 -0.09 -1.30 0.00 0.00 177.93 178.02 3hx2 h ARG 154 N 0.92 0.71 -4.05 5.26 2.43 -1.14 -3.29 114.38 115.22 3hx2 h ARG 154 Ca 0.18 -0.04 -0.60 0.00 -0.81 0.00 0.00 59.98 58.71 3hx2 h ARG 154 Cb 0.44 -0.16 0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3hx2 h ARG 154 CO 0.01 0.47 2.63 1.28 -1.51 0.00 0.00 179.97 182.86 3hx2 n LEU 155 N -4.76 5.11 0.05 3.80 4.77 -1.13 -3.83 117.00 121.01 3hx2 n LEU 155 Ca 0.09 -3.22 0.00 0.00 -0.03 0.00 0.00 56.01 52.85 3hx2 n LEU 155 Cb 0.19 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 3hx2 n LEU 155 CO 0.29 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 3hx2 n GLY 156 N 4.21 -0.48 0.00 -0.72 0.00 -1.24 -5.01 105.19 101.95 3hx2 n GLY 156 Ca 0.51 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.59 3hx2 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hx2 n GLY 157 N 1.05 0.75 0.08 -0.02 0.00 -1.25 -4.92 105.19 100.89 3hx2 n GLY 157 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3hx2 n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hx2 h PRO 158 N 0.00 -0.10 -1.21 1.61 0.13 -2.00 -3.31 132.00 127.12 3hx2 h PRO 158 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3hx2 h PRO 158 Cb 0.00 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.15 3hx2 h PRO 158 CO 0.00 0.13 0.00 0.39 -0.23 0.00 0.00 178.00 178.29 3hx2 n GLU 159 N -5.03 0.72 0.00 0.86 1.02 -1.26 -5.14 120.64 111.81 3hx2 n GLU 159 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 3hx2 n GLU 159 Cb 0.15 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 3hx2 n GLU 159 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31