#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hx2 s SER 3 N 0.00 7.17 0.61 4.04 0.15 -1.26 -4.93 113.70 119.48 3hx2 s SER 3 Ca 0.00 2.03 0.30 0.00 0.70 0.00 0.00 55.95 58.98 3hx2 s SER 3 Cb 0.00 -2.59 1.69 0.00 -1.71 0.00 0.00 66.02 63.41 3hx2 s SER 3 CO 0.00 -0.35 2.06 -0.61 1.20 0.00 0.00 173.24 175.53 3hx2 h GLN 4 N 6.07 0.00 -0.01 5.44 4.15 -1.99 -2.10 115.11 126.67 3hx2 h GLN 4 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.99 3hx2 h GLN 4 Cb 1.21 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.90 3hx2 h GLN 4 CO 0.77 0.00 -0.01 0.44 -1.93 0.00 0.00 178.83 178.10 3hx2 n ILE 5 N -3.57 0.00 -1.86 2.39 -5.35 -1.26 -5.05 119.36 104.66 3hx2 n ILE 5 Ca 0.02 -0.50 -0.40 0.00 -0.27 0.00 0.00 62.75 61.61 3hx2 n ILE 5 Cb 0.37 1.14 0.01 0.00 -1.74 0.00 0.00 39.64 39.43 3hx2 n ILE 5 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3hx2 s ARG 6 N -0.60 3.73 -0.29 6.28 3.52 -0.79 -4.80 118.95 126.00 3hx2 s ARG 6 Ca 0.08 2.35 -0.14 0.00 -0.13 0.00 0.00 55.73 57.89 3hx2 s ARG 6 Cb 0.06 -2.66 0.14 0.00 -1.56 0.00 0.00 34.95 30.92 3hx2 s ARG 6 CO 0.09 -0.76 0.88 -1.14 -0.81 0.00 0.00 175.30 173.56 3hx2 s GLN 7 N -2.42 0.44 -1.80 5.12 0.74 -1.26 -4.95 119.66 115.52 3hx2 s GLN 7 Ca 0.60 0.92 0.00 0.00 0.05 0.00 0.00 55.36 56.93 3hx2 s GLN 7 Cb -0.42 0.37 0.00 0.00 1.10 0.00 0.00 33.01 34.05 3hx2 s GLN 7 CO 0.54 -0.12 0.00 -1.71 -0.55 0.00 0.00 175.29 173.45 3hx2 n ASN 8 N 4.57 -4.47 -4.26 6.67 5.15 -1.26 -4.94 115.26 116.72 3hx2 n ASN 8 Ca -0.14 0.42 -0.44 0.00 -0.60 0.00 0.00 54.58 53.82 3hx2 n ASN 8 Cb 0.54 -4.04 -0.05 0.00 -0.53 0.00 0.00 39.78 35.70 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 -2.44 3.52 0.51 1.20 5.04 -1.26 -4.76 117.35 119.15 3hx2 s TYR 9 Ca 0.00 -1.94 -0.22 0.00 -2.44 0.00 0.00 57.07 52.47 3hx2 s TYR 9 Cb 0.00 -3.63 -0.06 0.00 0.35 0.00 0.00 41.96 38.62 3hx2 s TYR 9 CO 0.00 -0.97 1.23 -1.54 -1.34 0.00 0.00 175.55 172.93 3hx2 s SER 10 N 2.33 5.72 0.46 4.32 1.04 -1.26 -4.87 113.70 121.44 3hx2 s SER 10 Ca 0.12 2.47 0.17 0.00 0.48 0.00 0.00 55.95 59.18 3hx2 s SER 10 Cb -0.20 -2.61 1.08 0.00 0.10 0.00 0.00 66.02 64.39 3hx2 s SER 10 CO -0.04 -1.24 2.00 0.71 0.98 0.00 0.00 173.24 175.66 3hx2 h THR 11 N 1.57 1.03 -0.34 2.02 1.35 -1.99 -1.62 112.91 114.94 3hx2 h THR 11 Ca -0.50 -0.63 0.03 0.00 -0.55 0.00 0.00 66.41 64.76 3hx2 h THR 11 Cb 1.27 1.35 -0.03 0.00 -1.73 0.00 0.00 68.15 69.01 3hx2 h THR 11 CO 0.58 0.17 0.16 0.44 -0.25 0.00 0.00 175.52 176.63 3hx2 h ASP 12 N 0.00 0.23 0.05 5.36 3.45 -1.99 -1.04 116.42 122.48 3hx2 h ASP 12 Ca -0.00 0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.48 3hx2 h ASP 12 Cb 0.34 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.09 3hx2 h ASP 12 CO 0.02 0.17 -0.03 0.58 -1.57 0.00 0.00 179.24 178.42 3hx2 h VAL 13 N 0.33 1.16 -0.93 -1.35 2.07 -1.77 -0.46 116.25 115.31 3hx2 h VAL 13 Ca 0.15 -0.72 0.22 0.00 0.82 0.00 0.00 66.70 67.16 3hx2 h VAL 13 Cb 0.07 1.64 -0.12 0.00 -1.52 0.00 0.00 31.29 31.36 3hx2 h VAL 13 CO -0.11 0.18 0.48 -0.08 0.02 0.00 0.00 177.57 178.06 3hx2 h GLU 14 N -0.39 0.50 0.18 1.57 4.81 -1.20 0.19 114.58 120.23 3hx2 h GLU 14 Ca -0.01 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 3hx2 h GLU 14 Cb 0.35 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3hx2 h GLU 14 CO 0.01 0.33 -0.09 0.00 -0.73 0.00 0.00 179.01 178.54 3hx2 h ALA 15 N 1.69 -0.24 0.00 2.92 0.00 -1.02 -2.55 119.26 120.06 3hx2 h ALA 15 Ca 0.58 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 3hx2 h ALA 15 Cb 1.06 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 3hx2 h ALA 15 CO -0.48 -0.47 -0.02 0.00 0.00 0.00 0.00 179.25 178.29 3hx2 h ALA 16 N 0.16 1.18 0.33 0.00 0.00 0.39 -1.44 119.26 119.88 3hx2 h ALA 16 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3hx2 h ALA 16 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3hx2 h ALA 16 CO 0.04 0.02 -0.16 0.28 0.00 0.00 0.00 179.25 179.43 3hx2 h VAL 17 N 0.00 0.19 -1.00 0.00 2.07 -0.55 -1.59 116.25 115.37 3hx2 h VAL 17 Ca -0.00 -0.74 0.22 0.00 0.82 0.00 0.00 66.70 67.00 3hx2 h VAL 17 Cb 0.10 0.32 -0.10 0.00 -1.52 0.00 0.00 31.29 30.08 3hx2 h VAL 17 CO 0.00 0.05 0.62 0.78 0.02 0.00 0.00 177.57 179.04 3hx2 h ASN 18 N -1.07 0.62 -0.49 0.57 2.35 -1.06 0.47 115.58 116.97 3hx2 h ASN 18 Ca -0.05 0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.70 3hx2 h ASN 18 Cb 0.42 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 3hx2 h ASN 18 CO 0.07 0.19 -0.04 -1.28 -1.65 0.00 0.00 177.43 174.72 3hx2 h SER 19 N 0.58 0.88 0.09 5.81 0.87 -1.32 -2.65 113.55 117.82 3hx2 h SER 19 Ca 0.57 -0.33 -0.13 0.00 -1.23 0.00 0.00 61.79 60.67 3hx2 h SER 19 Cb 1.14 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.86 3hx2 h SER 19 CO -0.34 1.00 -0.44 0.25 -0.53 0.00 0.00 176.83 176.77 3hx2 h LEU 20 N 0.74 0.46 -0.19 2.23 5.85 0.78 -2.17 115.31 123.01 3hx2 h LEU 20 Ca 0.13 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.66 3hx2 h LEU 20 Cb 0.57 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3hx2 h LEU 20 CO 0.03 0.85 0.04 0.58 -0.34 0.00 0.00 178.44 179.60 3hx2 h VAL 21 N 0.35 0.92 -0.90 1.05 2.07 -0.34 -0.96 116.25 118.44 3hx2 h VAL 21 Ca 0.03 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.56 3hx2 h VAL 21 Cb 0.92 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 3hx2 h VAL 21 CO 0.08 0.02 0.57 -1.13 0.02 0.00 0.00 177.57 177.13 3hx2 h ASN 22 N 0.12 0.91 0.32 0.57 -0.73 -1.32 0.44 115.58 115.90 3hx2 h ASN 22 Ca 0.09 0.01 -0.04 0.00 1.87 0.00 0.00 56.30 58.23 3hx2 h ASN 22 Cb 0.08 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.48 3hx2 h ASN 22 CO -0.11 0.59 -0.19 0.25 -0.37 0.00 0.00 177.43 177.60 3hx2 h LEU 23 N 1.05 0.00 0.08 0.34 5.85 -0.72 -0.80 115.31 121.11 3hx2 h LEU 23 Ca 0.38 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.98 3hx2 h LEU 23 Cb 0.13 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.18 3hx2 h LEU 23 CO -0.16 0.19 -0.54 1.88 -0.34 0.00 0.00 178.44 179.47 3hx2 h TYR 24 N 0.00 0.38 -0.96 1.25 -1.99 0.35 -2.29 116.97 113.71 3hx2 h TYR 24 Ca -0.00 -0.27 0.06 0.00 2.00 0.00 0.00 58.73 60.52 3hx2 h TYR 24 Cb 0.40 -0.02 -0.06 0.00 2.00 0.00 0.00 36.73 39.05 3hx2 h TYR 24 CO 0.00 1.19 0.62 -0.07 -0.00 0.00 0.00 178.16 179.90 3hx2 h LEU 25 N -0.54 0.99 -0.33 3.88 3.38 -0.96 0.34 115.31 122.07 3hx2 h LEU 25 Ca -0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3hx2 h LEU 25 Cb 1.40 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 3hx2 h LEU 25 CO 0.10 0.64 0.19 -0.61 0.09 0.00 0.00 178.44 178.85 3hx2 h GLN 26 N 1.13 0.45 -0.55 1.13 4.15 -1.18 -1.29 115.11 118.94 3hx2 h GLN 26 Ca 0.41 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.68 3hx2 h GLN 26 Cb 0.15 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 3hx2 h GLN 26 CO -0.15 0.37 -0.04 0.00 -1.93 0.00 0.00 178.83 177.08 3hx2 h ALA 27 N 1.06 0.75 -0.53 3.38 0.00 -0.60 -1.96 119.26 121.35 3hx2 h ALA 27 Ca 0.12 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.76 3hx2 h ALA 27 Cb 0.04 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.59 3hx2 h ALA 27 CO -0.02 0.61 0.26 1.03 0.00 0.00 0.00 179.25 181.13 3hx2 h SER 28 N 0.88 0.37 -0.54 0.00 0.87 -0.16 -1.57 113.55 113.41 3hx2 h SER 28 Ca 0.15 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 3hx2 h SER 28 Cb 0.59 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.48 3hx2 h SER 28 CO 0.04 0.26 0.34 0.22 -0.53 0.00 0.00 176.83 177.15 3hx2 h TYR 29 N 0.51 0.64 0.00 2.24 3.20 -0.92 -0.59 116.97 122.05 3hx2 h TYR 29 Ca 0.23 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.10 3hx2 h TYR 29 Cb 0.15 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 3hx2 h TYR 29 CO -0.10 0.39 -0.13 1.15 -1.64 0.00 0.00 178.16 177.82 3hx2 h THR 30 N 0.69 0.69 0.12 1.81 2.02 -0.82 -1.52 112.91 115.90 3hx2 h THR 30 Ca 0.21 -0.52 -0.28 0.00 0.77 0.00 0.00 66.41 66.58 3hx2 h THR 30 Cb -0.03 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3hx2 h THR 30 CO -0.07 0.13 -1.30 1.88 0.37 0.00 0.00 175.52 176.52 3hx2 h TYR 31 N 0.00 0.47 -0.52 3.16 0.05 -0.28 -2.63 116.97 117.23 3hx2 h TYR 31 Ca -0.00 -0.34 -0.01 0.00 0.05 0.00 0.00 58.73 58.43 3hx2 h TYR 31 Cb 0.31 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 38.01 3hx2 h TYR 31 CO 0.00 1.29 0.29 1.25 -1.05 0.00 0.00 178.16 179.94 3hx2 h LEU 32 N 0.07 0.62 0.00 3.88 5.85 -0.51 0.73 115.31 125.96 3hx2 h LEU 32 Ca -0.16 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.53 3hx2 h LEU 32 Cb 1.98 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.85 3hx2 h LEU 32 CO 0.19 0.50 0.00 -0.24 -0.34 0.00 0.00 178.44 178.55 3hx2 n SER 33 N -4.41 0.00 -0.37 1.25 2.88 -0.63 -2.41 113.62 109.93 3hx2 n SER 33 Ca 0.04 0.78 0.33 0.00 -1.33 0.00 0.00 58.87 58.69 3hx2 n SER 33 Cb 0.09 -0.45 0.59 0.00 -0.75 0.00 0.00 64.21 63.69 3hx2 n SER 33 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3hx2 h LEU 34 N 0.00 0.32 0.08 2.46 3.38 -1.40 -0.28 115.31 119.88 3hx2 h LEU 34 Ca 0.00 0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 3hx2 h LEU 34 Cb 0.00 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3hx2 h LEU 34 CO 0.00 -0.31 -0.08 1.23 0.09 0.00 0.00 178.44 179.37 3hx2 h GLY 35 N 0.07 -0.76 2.00 0.83 0.00 -0.80 -2.42 103.07 102.00 3hx2 h GLY 35 Ca 0.83 0.33 -0.01 0.00 0.00 0.00 0.00 47.33 48.48 3hx2 h GLY 35 CO -0.64 -0.27 -0.03 0.74 0.00 0.00 0.00 176.54 176.34 3hx2 h PHE 36 N -0.16 0.00 -0.30 5.60 -1.00 -0.88 -1.51 116.94 118.69 3hx2 h PHE 36 Ca -0.01 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.66 3hx2 h PHE 36 Cb 0.14 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 3hx2 h PHE 36 CO -0.08 0.03 -0.27 -0.92 -1.61 0.00 0.00 178.31 175.46 3hx2 h TYR 37 N 0.00 0.68 0.00 -0.55 3.20 -0.97 -2.34 116.97 116.99 3hx2 h TYR 37 Ca -0.00 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.71 3hx2 h TYR 37 Cb 0.23 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.34 3hx2 h TYR 37 CO 0.00 0.81 0.00 1.19 -1.64 0.00 0.00 178.16 178.52 3hx2 n PHE 38 N -4.10 0.10 0.80 -3.82 3.72 -0.58 -2.75 117.46 110.82 3hx2 n PHE 38 Ca -0.00 0.03 0.13 0.00 -0.05 0.00 0.00 57.45 57.55 3hx2 n PHE 38 Cb 0.44 -0.55 0.32 0.00 -0.94 0.00 0.00 39.48 38.75 3hx2 n PHE 38 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3hx2 n ASP 39 N -1.58 0.51 -4.73 4.37 -0.08 -0.90 -2.10 116.55 112.05 3hx2 n ASP 39 Ca 0.07 0.15 -0.42 0.00 -1.51 0.00 0.00 54.79 53.07 3hx2 n ASP 39 Cb 0.35 -0.08 -0.01 0.00 2.34 0.00 0.00 41.12 43.71 3hx2 n ASP 39 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 3hx2 n ARG 40 N -1.82 2.50 0.33 -0.67 1.74 -1.11 -4.64 116.66 112.99 3hx2 n ARG 40 Ca 0.05 0.88 0.21 0.00 -0.77 0.00 0.00 57.85 58.23 3hx2 n ARG 40 Cb 0.39 -2.61 1.14 0.00 -1.02 0.00 0.00 32.46 30.37 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 3.97 0.00 0.01 0.55 2.03 -1.91 0.81 116.42 121.88 3hx2 h ASP 41 Ca -0.47 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.83 3hx2 h ASP 41 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 3hx2 h ASP 41 CO 0.73 0.00 -0.03 -0.90 -1.03 0.00 0.00 179.24 178.01 3hx2 n ASP 42 N -3.18 1.63 0.01 4.15 3.85 -1.26 -4.31 116.55 117.43 3hx2 n ASP 42 Ca -0.03 -1.49 -0.02 0.00 -0.71 0.00 0.00 54.79 52.54 3hx2 n ASP 42 Cb 0.09 0.02 -0.01 0.00 -1.35 0.00 0.00 41.12 39.88 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 0.22 0.70 -3.52 2.12 0.31 0.27 -5.11 118.33 113.32 3hx2 n VAL 43 Ca 0.18 0.16 -0.36 0.00 -0.01 0.00 0.00 64.34 64.31 3hx2 n VAL 43 Cb 0.38 -1.61 0.03 0.00 -0.91 0.00 0.00 33.84 31.74 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 -3.37 -2.40 -3.27 3.52 0.00 0.26 -4.98 120.51 110.27 3hx2 n ALA 44 Ca -0.04 0.29 -0.24 0.00 0.00 0.00 0.00 53.44 53.45 3hx2 n ALA 44 Cb 0.31 -2.10 -0.08 0.00 0.00 0.00 0.00 19.45 17.58 3hx2 n ALA 44 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hx2 n LEU 45 N -0.54 -0.57 -0.33 0.00 4.77 -0.89 -4.99 117.00 114.45 3hx2 n LEU 45 Ca -0.11 -4.34 0.20 0.00 -0.03 0.00 0.00 56.01 51.73 3hx2 n LEU 45 Cb 0.68 0.60 0.44 0.00 -2.33 0.00 0.00 43.42 42.81 3hx2 n LEU 45 CO 0.57 1.93 1.20 -0.08 -1.33 0.00 0.00 177.39 179.68 3hx2 h GLU 46 N 5.06 0.49 0.57 3.23 4.81 -1.94 -0.59 114.58 126.22 3hx2 h GLU 46 Ca 0.19 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 3hx2 h GLU 46 Cb 0.92 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 3hx2 h GLU 46 CO 0.37 0.33 -0.46 0.78 -0.73 0.00 0.00 179.01 179.29 3hx2 h GLY 47 N 0.51 -1.25 1.02 1.92 0.00 -1.94 -0.32 103.07 103.01 3hx2 h GLY 47 Ca 0.60 0.55 -0.01 0.00 0.00 0.00 0.00 47.33 48.48 3hx2 h GLY 47 CO -0.35 -0.39 0.57 -2.08 0.00 0.00 0.00 176.54 174.28 3hx2 h VAL 48 N -1.01 1.26 0.01 4.60 2.07 -1.84 -1.50 116.25 119.84 3hx2 h VAL 48 Ca -0.07 -0.56 0.03 0.00 0.82 0.00 0.00 66.70 66.91 3hx2 h VAL 48 Cb 0.84 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 3hx2 h VAL 48 CO 0.00 0.27 -0.24 -1.28 0.02 0.00 0.00 177.57 176.34 3hx2 h SER 49 N 1.30 -0.71 -0.65 0.57 0.87 -0.92 -1.77 113.55 112.24 3hx2 h SER 49 Ca 0.34 0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.97 3hx2 h SER 49 Cb -0.05 0.29 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 3hx2 h SER 49 CO -0.06 -0.31 0.32 -0.74 -0.53 0.00 0.00 176.83 175.51 3hx2 h HIS 50 N -0.38 0.95 0.11 2.24 6.17 -0.79 -0.51 115.15 122.94 3hx2 h HIS 50 Ca 0.06 -0.04 0.02 0.00 0.71 0.00 0.00 60.37 61.12 3hx2 h HIS 50 Cb 0.46 -0.30 -0.04 0.00 2.52 0.00 0.00 27.41 30.05 3hx2 h HIS 50 CO -0.28 0.69 -0.28 0.35 0.71 0.00 0.00 177.93 179.13 3hx2 h PHE 51 N 0.95 -0.75 -0.19 5.26 3.57 -0.65 -0.66 116.94 124.47 3hx2 h PHE 51 Ca 0.23 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.66 3hx2 h PHE 51 Cb 0.10 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 3hx2 h PHE 51 CO 0.01 -0.38 -0.28 0.74 -2.23 0.00 0.00 178.31 176.17 3hx2 h PHE 52 N -0.48 0.42 -0.36 0.41 0.05 -0.99 -1.91 116.94 114.08 3hx2 h PHE 52 Ca 0.03 -0.09 -0.02 0.00 3.82 0.00 0.00 57.97 61.72 3hx2 h PHE 52 Cb 0.52 -0.10 -0.02 0.00 2.00 0.00 0.00 35.95 38.35 3hx2 h PHE 52 CO -0.26 0.62 0.14 0.00 -0.18 0.00 0.00 178.31 178.64 3hx2 h ARG 53 N 0.33 0.50 0.08 1.51 3.08 -0.55 -1.24 114.38 118.10 3hx2 h ARG 53 Ca 0.05 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3hx2 h ARG 53 Cb 0.67 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.62 3hx2 h ARG 53 CO 0.05 0.42 -0.04 0.93 -1.07 0.00 0.00 179.97 180.26 3hx2 h GLU 54 N 0.51 -0.11 -0.95 0.04 5.08 -0.51 -2.89 114.58 115.75 3hx2 h GLU 54 Ca 0.13 0.01 0.24 0.00 -1.00 0.00 0.00 59.36 58.74 3hx2 h GLU 54 Cb 0.11 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.32 3hx2 h GLU 54 CO -0.01 0.37 0.64 -0.07 -1.00 0.00 0.00 179.01 178.94 3hx2 h LEU 55 N -0.64 0.28 0.63 1.33 3.38 -1.06 0.11 115.31 119.33 3hx2 h LEU 55 Ca -0.01 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3hx2 h LEU 55 Cb 0.53 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.27 3hx2 h LEU 55 CO 0.02 0.09 -0.30 0.00 0.09 0.00 0.00 178.44 178.34 3hx2 h ALA 56 N 1.58 -0.85 -0.14 1.53 0.00 -1.10 -1.24 119.26 119.04 3hx2 h ALA 56 Ca 0.49 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3hx2 h ALA 56 Cb 1.47 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 3hx2 h ALA 56 CO -0.15 -0.94 0.09 1.49 0.00 0.00 0.00 179.25 179.75 3hx2 h GLU 57 N -0.92 0.19 0.01 0.00 4.57 -0.84 -1.72 114.58 115.86 3hx2 h GLU 57 Ca -0.09 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3hx2 h GLU 57 Cb 0.67 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 3hx2 h GLU 57 CO 0.14 0.12 -0.00 0.93 -1.18 0.00 0.00 179.01 179.02 3hx2 h GLU 58 N 0.19 -0.01 -0.15 1.92 5.08 -0.48 -1.37 114.58 119.76 3hx2 h GLU 58 Ca 0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3hx2 h GLU 58 Cb -0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3hx2 h GLU 58 CO -0.01 0.23 0.02 0.87 -1.00 0.00 0.00 179.01 179.12 3hx2 h LYS 59 N -0.25 0.21 -0.10 2.33 1.79 -0.69 -0.34 116.57 119.52 3hx2 h LYS 59 Ca -0.00 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.44 3hx2 h LYS 59 Cb 0.25 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.85 3hx2 h LYS 59 CO 0.00 0.22 0.05 -0.09 -1.08 0.00 0.00 179.45 178.55 3hx2 h ARG 60 N 0.21 0.14 -0.32 3.15 2.43 -0.99 -1.28 114.38 117.72 3hx2 h ARG 60 Ca 0.05 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3hx2 h ARG 60 Cb 0.11 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3hx2 h ARG 60 CO -0.00 0.17 0.21 0.93 -1.51 0.00 0.00 179.97 179.77 3hx2 h GLU 61 N 0.07 0.38 0.30 0.20 5.08 0.02 -0.17 114.58 120.46 3hx2 h GLU 61 Ca 0.03 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3hx2 h GLU 61 Cb 0.07 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3hx2 h GLU 61 CO -0.01 0.25 -0.15 0.78 -1.00 0.00 0.00 179.01 178.89 3hx2 h GLY 62 N 0.39 -0.43 2.00 -3.84 0.00 -0.36 -0.80 103.07 100.04 3hx2 h GLY 62 Ca 0.12 0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.51 3hx2 h GLY 62 CO -0.03 -0.15 -0.46 0.10 0.00 0.00 0.00 176.54 176.00 3hx2 h TYR 63 N -0.64 0.00 0.00 5.60 -0.00 -0.83 -0.99 116.97 120.10 3hx2 h TYR 63 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.60 3hx2 h TYR 63 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.17 3hx2 h TYR 63 CO 0.00 0.46 -0.42 0.93 -0.00 0.00 0.00 178.16 179.13 3hx2 h GLU 64 N 0.00 0.00 0.24 0.10 5.08 -1.00 -1.01 114.58 117.99 3hx2 h GLU 64 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3hx2 h GLU 64 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3hx2 h GLU 64 CO 0.06 0.42 -0.11 -0.09 -1.00 0.00 0.00 179.01 178.29 3hx2 h ARG 65 N 0.00 -0.31 -1.01 2.33 2.43 -0.29 -2.25 114.38 115.29 3hx2 h ARG 65 Ca -0.00 0.02 0.22 0.00 -0.81 0.00 0.00 59.98 59.41 3hx2 h ARG 65 Cb 0.78 0.07 -0.11 0.00 -0.42 0.00 0.00 29.97 30.29 3hx2 h ARG 65 CO 0.06 0.06 0.62 -0.07 -1.51 0.00 0.00 179.97 179.12 3hx2 h LEU 66 N -0.90 0.67 -0.42 3.80 3.38 -1.08 0.28 115.31 121.05 3hx2 h LEU 66 Ca -0.03 0.11 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 3hx2 h LEU 66 Cb 0.50 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 3hx2 h LEU 66 CO 0.05 0.18 -0.65 -0.07 0.09 0.00 0.00 178.44 178.03 3hx2 h LEU 67 N 0.62 0.61 -0.42 1.67 3.38 -1.22 -0.69 115.31 119.26 3hx2 h LEU 67 Ca 0.60 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 3hx2 h LEU 67 Cb 1.14 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 3hx2 h LEU 67 CO -0.39 1.10 0.13 0.50 0.09 0.00 0.00 178.44 179.87 3hx2 h LYS 68 N 0.38 0.65 -0.73 1.13 1.63 0.02 -2.36 116.57 117.29 3hx2 h LYS 68 Ca -0.02 -0.14 -0.01 0.00 -0.85 0.00 0.00 60.65 59.63 3hx2 h LYS 68 Cb 1.22 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.72 3hx2 h LYS 68 CO 0.12 0.64 0.41 1.98 -3.45 0.00 0.00 179.45 179.15 3hx2 h MET 69 N 0.53 1.01 0.28 1.90 4.05 -0.52 -2.83 114.93 119.36 3hx2 h MET 69 Ca 0.13 -0.11 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 3hx2 h MET 69 Cb 0.26 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 30.83 3hx2 h MET 69 CO -0.00 0.74 -0.45 0.37 0.23 0.00 0.00 176.91 177.80 3hx2 h GLN 70 N 1.00 -0.77 -0.24 0.39 5.75 -0.64 -1.88 115.11 118.72 3hx2 h GLN 70 Ca 0.26 0.05 0.07 0.00 -0.15 0.00 0.00 58.65 58.88 3hx2 h GLN 70 Cb 0.02 0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 3hx2 h GLN 70 CO -0.04 -0.51 0.17 -0.91 -2.65 0.00 0.00 178.83 174.88 3hx2 h ASN 71 N -0.80 0.02 -0.22 -0.69 4.21 -1.32 -1.76 115.58 115.02 3hx2 h ASN 71 Ca -0.02 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.36 3hx2 h ASN 71 Cb 0.76 -0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.95 3hx2 h ASN 71 CO -0.16 0.01 -0.38 1.56 -1.29 0.00 0.00 177.43 177.17 3hx2 h GLN 72 N 0.02 0.65 0.00 0.81 4.20 -1.16 -3.07 115.11 116.56 3hx2 h GLN 72 Ca 0.11 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.42 3hx2 h GLN 72 Cb 0.42 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.25 3hx2 h GLN 72 CO -0.00 1.02 0.00 0.00 -0.67 0.00 0.00 178.83 179.18 3hx2 h ARG 73 N 0.34 0.00 0.00 1.46 2.47 -1.03 -3.47 114.38 114.16 3hx2 h ARG 73 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3hx2 h ARG 73 Cb 0.98 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.30 3hx2 h ARG 73 CO 0.09 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.03 3hx2 n GLY 74 N 0.08 0.66 3.54 0.04 0.00 -0.99 -4.13 105.19 104.39 3hx2 n GLY 74 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.35 1.53 -0.06 -0.02 0.00 -0.70 -4.66 107.32 102.07 3hx2 s GLY 75 Ca 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.30 3hx2 s GLY 75 CO 0.00 0.31 -0.14 0.50 0.00 0.00 0.00 173.10 173.77 3hx2 s ARG 76 N -4.85 1.83 0.14 2.90 1.81 -1.26 -4.30 118.95 115.22 3hx2 s ARG 76 Ca 0.68 -0.50 -0.30 0.00 -1.72 0.00 0.00 55.73 53.89 3hx2 s ARG 76 Cb -0.19 -1.51 -0.07 0.00 -0.45 0.00 0.00 34.95 32.73 3hx2 s ARG 76 CO 0.60 0.09 1.12 0.00 -0.68 0.00 0.00 175.30 176.44 3hx2 s ALA 77 N 0.48 3.37 -0.27 2.13 0.00 -1.26 -4.94 121.76 121.26 3hx2 s ALA 77 Ca -0.12 0.82 -0.03 0.00 0.00 0.00 0.00 51.96 52.62 3hx2 s ALA 77 Cb -0.15 -3.38 0.09 0.00 0.00 0.00 0.00 23.12 19.68 3hx2 s ALA 77 CO 0.04 -0.28 0.10 -0.51 0.00 0.00 0.00 175.76 175.12 3hx2 s LEU 78 N 0.05 1.09 0.47 0.00 1.43 -1.26 -5.14 118.68 115.31 3hx2 s LEU 78 Ca 0.52 -1.25 -0.14 0.00 -1.03 0.00 0.00 54.13 52.23 3hx2 s LEU 78 Cb -0.29 -0.52 -0.07 0.00 0.03 0.00 0.00 46.19 45.34 3hx2 s LEU 78 CO 0.33 -0.40 0.89 -0.36 0.23 0.00 0.00 176.35 177.04 3hx2 s PHE 79 N 1.93 3.46 0.42 0.29 0.08 -1.26 -4.85 117.98 118.05 3hx2 s PHE 79 Ca 0.07 1.28 0.03 0.00 0.12 0.00 0.00 56.93 58.43 3hx2 s PHE 79 Cb -0.16 -2.64 -0.03 0.00 -0.57 0.00 0.00 43.02 39.62 3hx2 s PHE 79 CO -0.27 -0.26 0.10 -0.65 -0.10 0.00 0.00 175.22 174.04 3hx2 s GLN 80 N -3.99 1.95 0.46 0.44 -1.52 -1.26 -5.12 119.66 110.62 3hx2 s GLN 80 Ca 0.55 -2.19 -0.23 0.00 -1.95 0.00 0.00 55.36 51.54 3hx2 s GLN 80 Cb -0.10 -0.83 -0.07 0.00 -0.22 0.00 0.00 33.01 31.79 3hx2 s GLN 80 CO 0.32 -0.42 1.23 -0.51 -0.25 0.00 0.00 175.29 175.66 3hx2 s ASP 81 N -3.65 6.03 -0.45 5.90 -0.00 -1.26 -4.97 116.67 118.28 3hx2 s ASP 81 Ca 0.22 2.47 -0.18 0.00 -0.00 0.00 0.00 52.55 55.06 3hx2 s ASP 81 Cb 0.03 -2.62 0.04 0.00 -0.00 0.00 0.00 42.92 40.37 3hx2 s ASP 81 CO 0.12 -1.02 0.48 -0.63 -0.00 0.00 0.00 175.17 174.12 3hx2 s ILE 82 N -1.43 5.05 0.12 0.77 1.01 -1.26 -5.04 121.20 120.43 3hx2 s ILE 82 Ca 0.63 -0.47 -0.31 0.00 0.00 0.00 0.00 60.65 60.50 3hx2 s ILE 82 Cb -0.33 -4.11 -0.10 0.00 0.01 0.00 0.00 42.46 37.93 3hx2 s ILE 82 CO 0.40 -0.53 1.70 -0.54 0.00 0.00 0.00 174.94 175.97 3hx2 s LYS 83 N 2.19 4.17 0.70 2.79 1.02 -1.26 -4.96 119.74 124.39 3hx2 s LYS 83 Ca 0.12 2.46 -0.17 0.00 0.02 0.00 0.00 55.97 58.40 3hx2 s LYS 83 Cb -0.18 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.69 3hx2 s LYS 83 CO 0.12 -0.75 1.19 0.36 -0.92 0.00 0.00 175.35 175.35 3hx2 n LYS 84 N 5.10 0.76 -1.57 1.68 2.85 -1.26 -4.89 118.16 120.84 3hx2 n LYS 84 Ca 0.16 0.32 -0.43 0.00 -1.05 0.00 0.00 58.31 57.31 3hx2 n LYS 84 Cb 0.39 -2.43 -0.00 0.00 -0.65 0.00 0.00 35.03 32.34 3hx2 n LYS 84 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 3hx2 n PRO 85 N -2.16 1.16 0.00 -1.58 -0.02 -1.26 -4.84 135.00 126.29 3hx2 n PRO 85 Ca 0.15 0.41 0.01 0.00 -2.02 0.00 0.00 63.50 62.05 3hx2 n PRO 85 Cb 0.49 -1.83 0.04 0.00 -0.02 0.00 0.00 33.50 32.18 3hx2 n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hx2 n ALA 86 N -0.28 1.96 -3.29 3.55 0.00 -1.26 -4.73 120.51 116.47 3hx2 n ALA 86 Ca 0.10 -0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 3hx2 n ALA 86 Cb 0.36 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.74 3hx2 n ALA 86 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hx2 s GLU 87 N -2.00 1.09 -0.03 0.00 0.41 -1.26 -5.03 118.70 111.88 3hx2 s GLU 87 Ca 0.02 -0.35 0.08 0.00 -0.41 0.00 0.00 54.97 54.32 3hx2 s GLU 87 Cb 0.01 0.50 -0.12 0.00 -1.78 0.00 0.00 34.13 32.73 3hx2 s GLU 87 CO 0.02 -0.42 0.15 -0.25 -0.49 0.00 0.00 175.26 174.27 3hx2 n ASP 88 N 0.15 3.04 -3.88 -0.19 8.00 -1.26 -4.93 116.55 117.49 3hx2 n ASP 88 Ca -0.18 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.11 3hx2 n ASP 88 Cb 0.62 1.23 -0.17 0.00 -0.02 0.00 0.00 41.12 42.78 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 -2.50 0.93 -0.01 -1.24 2.02 -1.26 -5.00 118.70 111.63 3hx2 s GLU 89 Ca -0.03 -0.10 0.20 0.00 0.02 0.00 0.00 54.97 55.05 3hx2 s GLU 89 Cb 0.05 -1.00 0.59 0.00 0.10 0.00 0.00 34.13 33.87 3hx2 s GLU 89 CO 0.35 -0.14 1.49 0.91 0.02 0.00 0.00 175.26 177.89 3hx2 n TRP 90 N 4.38 0.94 -4.54 1.61 7.02 -1.26 -5.06 117.44 120.52 3hx2 n TRP 90 Ca -0.19 -0.45 0.00 0.00 -1.02 0.00 0.00 57.50 55.84 3hx2 n TRP 90 Cb 0.51 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 29.36 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 1.10 3.92 6.99 0.00 -1.26 -3.69 105.19 113.72 3hx2 n GLY 91 Ca 0.22 -0.73 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 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 3.35 0.25 1.61 1.02 -1.26 -4.86 119.74 119.85 3hx2 s LYS 92 Ca 0.00 0.03 -0.08 0.00 0.02 0.00 0.00 55.97 55.94 3hx2 s LYS 92 Cb 0.00 -2.40 0.41 0.00 -0.52 0.00 0.00 37.83 35.32 3hx2 s LYS 92 CO 0.00 -0.28 1.61 1.15 -0.92 0.00 0.00 175.35 176.91 3hx2 h THR 93 N 0.21 0.26 -0.67 2.17 2.02 -1.99 0.52 112.91 115.42 3hx2 h THR 93 Ca -0.47 -0.02 0.08 0.00 0.77 0.00 0.00 66.41 66.78 3hx2 h THR 93 Cb 1.22 0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 3hx2 h THR 93 CO 0.61 0.01 0.44 -0.65 0.37 0.00 0.00 175.52 176.30 3hx2 h PRO 94 N 0.05 0.58 -0.05 6.66 0.11 -1.95 0.13 132.00 137.52 3hx2 h PRO 94 Ca 0.41 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.41 3hx2 h PRO 94 Cb 0.69 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.68 3hx2 h PRO 94 CO -0.75 0.38 -0.25 -0.44 -0.21 0.00 0.00 178.00 176.74 3hx2 h ASP 95 N 0.59 0.30 -0.80 -2.05 3.45 -1.24 -2.03 116.42 114.65 3hx2 h ASP 95 Ca 0.30 -0.66 0.04 0.00 0.43 0.00 0.00 57.03 57.15 3hx2 h ASP 95 Cb 0.40 -0.09 -0.05 0.00 -0.56 0.00 0.00 39.33 39.03 3hx2 h ASP 95 CO -0.10 0.91 0.53 0.00 -1.57 0.00 0.00 179.24 179.01 3hx2 h ALA 96 N 0.40 1.55 -0.15 3.45 0.00 -0.77 -1.44 119.26 122.30 3hx2 h ALA 96 Ca -0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3hx2 h ALA 96 Cb 0.91 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3hx2 h ALA 96 CO 0.05 0.36 -0.04 1.98 0.00 0.00 0.00 179.25 181.60 3hx2 h MET 97 N 0.95 0.29 -0.34 0.00 -1.53 -0.95 -1.29 114.93 112.06 3hx2 h MET 97 Ca 0.33 -0.11 0.05 0.00 -3.44 0.00 0.00 59.70 56.53 3hx2 h MET 97 Cb 0.10 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.12 3hx2 h MET 97 CO -0.10 0.57 0.23 0.87 0.14 0.00 0.00 176.91 178.62 3hx2 h LYS 98 N -0.02 0.22 -0.16 0.39 1.57 -0.83 0.43 116.57 118.17 3hx2 h LYS 98 Ca 0.04 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 3hx2 h LYS 98 Cb 0.47 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 3hx2 h LYS 98 CO 0.01 0.14 -0.14 0.00 -0.57 0.00 0.00 179.45 178.90 3hx2 h ALA 99 N 1.82 0.23 -0.33 3.86 0.00 -1.01 -1.24 119.26 122.59 3hx2 h ALA 99 Ca 0.15 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 3hx2 h ALA 99 Cb 0.31 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3hx2 h ALA 99 CO -0.03 0.10 -0.13 0.00 0.00 0.00 0.00 179.25 179.19 3hx2 h ALA 100 N 0.62 1.15 0.35 0.00 0.00 0.02 0.36 119.26 121.77 3hx2 h ALA 100 Ca 0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 3hx2 h ALA 100 Cb 0.66 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hx2 h ALA 100 CO 0.04 0.54 -0.17 1.98 0.00 0.00 0.00 179.25 181.63 3hx2 h MET 101 N 0.53 -0.46 -0.10 0.00 -1.53 -0.07 -1.40 114.93 111.90 3hx2 h MET 101 Ca 0.09 0.03 -0.03 0.00 -3.44 0.00 0.00 59.70 56.35 3hx2 h MET 101 Cb 0.54 0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.69 3hx2 h MET 101 CO 0.03 -0.26 -0.09 0.00 0.14 0.00 0.00 176.91 176.74 3hx2 h ALA 102 N 0.07 1.68 -0.59 0.39 0.00 -1.06 -0.18 119.26 119.58 3hx2 h ALA 102 Ca -0.05 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3hx2 h ALA 102 Cb 0.41 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3hx2 h ALA 102 CO 0.08 0.24 0.09 1.25 0.00 0.00 0.00 179.25 180.91 3hx2 h LEU 103 N 0.14 0.94 -0.12 0.00 5.85 -0.63 -2.19 115.31 119.31 3hx2 h LEU 103 Ca 0.03 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 3hx2 h LEU 103 Cb 0.25 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 3hx2 h LEU 103 CO 0.01 0.97 -0.12 -0.33 -0.34 0.00 0.00 178.44 178.64 3hx2 h GLU 104 N 0.88 0.28 -0.03 1.25 4.39 -0.42 -1.21 114.58 119.72 3hx2 h GLU 104 Ca 0.18 -0.15 0.01 0.00 0.34 0.00 0.00 59.36 59.74 3hx2 h GLU 104 Cb 0.43 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.08 3hx2 h GLU 104 CO 0.01 0.69 0.03 0.87 -1.16 0.00 0.00 179.01 179.46 3hx2 h LYS 105 N -0.11 0.00 0.00 2.33 1.57 -1.02 0.73 116.57 120.07 3hx2 h LYS 105 Ca 0.02 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3hx2 h LYS 105 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3hx2 h LYS 105 CO 0.03 0.00 -0.00 -0.22 -0.57 0.00 0.00 179.45 178.69 3hx2 h LYS 106 N 0.00 -0.00 -0.50 3.15 3.64 -1.18 -2.20 116.57 119.47 3hx2 h LYS 106 Ca 0.02 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.45 3hx2 h LYS 106 Cb 0.08 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.86 3hx2 h LYS 106 CO -0.00 0.76 0.23 -0.07 -2.27 0.00 0.00 179.45 178.11 3hx2 h LEU 107 N -0.76 0.31 0.02 5.20 3.38 -0.04 -1.34 115.31 122.08 3hx2 h LEU 107 Ca -0.00 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.04 3hx2 h LEU 107 Cb 0.76 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 3hx2 h LEU 107 CO 0.00 0.22 -0.26 -1.13 0.09 0.00 0.00 178.44 177.36 3hx2 h ASN 108 N 0.45 -0.75 -0.36 -0.43 -1.24 0.38 -1.63 115.58 112.00 3hx2 h ASN 108 Ca 0.23 0.10 0.02 0.00 0.71 0.00 0.00 56.30 57.36 3hx2 h ASN 108 Cb 0.17 0.30 -0.02 0.00 0.73 0.00 0.00 38.32 39.50 3hx2 h ASN 108 CO -0.18 -0.33 0.24 -0.61 -1.29 0.00 0.00 177.43 175.26 3hx2 h GLN 109 N -0.41 0.39 -0.33 6.67 5.75 -1.03 0.14 115.11 126.29 3hx2 h GLN 109 Ca 0.06 -0.02 -0.11 0.00 -0.15 0.00 0.00 58.65 58.42 3hx2 h GLN 109 Cb 0.48 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.93 3hx2 h GLN 109 CO -0.21 0.25 -0.24 0.00 -2.65 0.00 0.00 178.83 175.98 3hx2 h ALA 110 N 1.79 0.95 -0.01 3.38 0.00 -0.70 -1.75 119.26 122.92 3hx2 h ALA 110 Ca 0.15 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 3hx2 h ALA 110 Cb 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3hx2 h ALA 110 CO -0.03 0.61 -0.01 -0.07 0.00 0.00 0.00 179.25 179.75 3hx2 h LEU 111 N 0.58 0.02 -0.88 0.00 3.38 0.11 -0.58 115.31 117.94 3hx2 h LEU 111 Ca 0.08 -0.44 0.08 0.00 0.09 0.00 0.00 57.88 57.69 3hx2 h LEU 111 Cb 0.72 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.40 3hx2 h LEU 111 CO 0.06 0.46 0.54 -0.07 0.09 0.00 0.00 178.44 179.51 3hx2 h LEU 112 N -0.41 0.81 -0.69 1.67 3.38 -0.88 0.15 115.31 119.34 3hx2 h LEU 112 Ca 0.00 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 3hx2 h LEU 112 Cb 0.45 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3hx2 h LEU 112 CO 0.00 0.48 -0.19 0.44 0.09 0.00 0.00 178.44 179.27 3hx2 h ASP 113 N 0.93 0.83 0.48 -0.43 3.45 -1.25 0.12 116.42 120.54 3hx2 h ASP 113 Ca 0.41 -0.29 -0.09 0.00 0.43 0.00 0.00 57.03 57.49 3hx2 h ASP 113 Cb 0.29 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 38.83 3hx2 h ASP 113 CO -0.22 1.00 -0.43 0.25 -1.57 0.00 0.00 179.24 178.28 3hx2 h LEU 114 N 0.72 0.00 -0.10 1.55 5.85 -0.05 -1.63 115.31 121.65 3hx2 h LEU 114 Ca 0.10 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3hx2 h LEU 114 Cb 0.71 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.74 3hx2 h LEU 114 CO 0.05 0.43 -0.16 -0.74 -0.34 0.00 0.00 178.44 177.68 3hx2 h HIS 115 N 0.00 0.35 -0.93 1.25 2.76 0.01 -2.18 115.15 116.42 3hx2 h HIS 115 Ca -0.00 -0.12 0.15 0.00 -2.20 0.00 0.00 60.37 58.19 3hx2 h HIS 115 Cb 0.79 -0.07 -0.08 0.00 1.55 0.00 0.00 27.41 29.60 3hx2 h HIS 115 CO 0.00 0.76 0.59 0.00 -1.30 0.00 0.00 177.93 177.99 3hx2 h ALA 116 N 0.53 1.79 -0.45 5.26 0.00 -0.50 0.45 119.26 126.33 3hx2 h ALA 116 Ca 0.01 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3hx2 h ALA 116 Cb 0.73 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3hx2 h ALA 116 CO 0.04 -0.05 0.06 1.25 0.00 0.00 0.00 179.25 180.55 3hx2 h LEU 117 N 0.73 0.73 -1.10 0.00 5.85 -1.17 -2.34 115.31 118.01 3hx2 h LEU 117 Ca 0.48 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 3hx2 h LEU 117 Cb 0.74 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 3hx2 h LEU 117 CO -0.24 0.82 0.31 1.23 -0.34 0.00 0.00 178.44 180.22 3hx2 h GLY 118 N 0.62 1.01 0.84 3.75 0.00 -0.30 -0.51 103.07 108.48 3hx2 h GLY 118 Ca 0.14 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 3hx2 h GLY 118 CO 0.01 0.46 0.01 1.76 0.00 0.00 0.00 176.54 178.78 3hx2 h SER 119 N 0.94 0.05 -0.54 0.19 0.02 -1.05 0.20 113.55 113.36 3hx2 h SER 119 Ca 0.23 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 3hx2 h SER 119 Cb 0.11 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 3hx2 h SER 119 CO -0.03 0.21 0.20 0.00 -1.14 0.00 0.00 176.83 176.06 3hx2 h ALA 120 N 0.84 1.25 -0.48 3.77 0.00 -1.11 -1.84 119.26 121.70 3hx2 h ALA 120 Ca 0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3hx2 h ALA 120 Cb 0.17 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3hx2 h ALA 120 CO -0.00 0.53 0.00 0.54 0.00 0.00 0.00 179.25 180.32 3hx2 n ARG 121 N -4.30 2.28 -3.83 0.00 5.12 -0.23 -4.96 116.66 110.74 3hx2 n ARG 121 Ca 0.05 -1.80 -0.28 0.00 -1.93 0.00 0.00 57.85 53.89 3hx2 n ARG 121 Cb 0.19 -1.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 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 0.89 -3.02 -3.92 0.55 -2.24 -0.33 -4.93 114.28 101.28 3hx2 n THR 122 Ca 0.17 -0.11 -0.30 0.00 -2.27 0.00 0.00 64.05 61.54 3hx2 n THR 122 Cb 0.46 -2.67 -0.14 0.00 -2.10 0.00 0.00 70.33 65.88 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 -3.07 4.30 0.33 3.42 -1.08 0.56 -4.97 116.67 116.18 3hx2 s ASP 123 Ca 0.08 -3.09 0.05 0.00 -0.52 0.00 0.00 52.55 49.07 3hx2 s ASP 123 Cb -0.05 -1.58 0.60 0.00 -1.46 0.00 0.00 42.92 40.43 3hx2 s ASP 123 CO 0.89 -0.21 1.84 1.55 0.52 0.00 0.00 175.17 179.75 3hx2 h PRO 124 N 6.37 0.42 0.31 4.34 0.13 -1.93 -2.44 132.00 139.20 3hx2 h PRO 124 Ca -0.04 -0.11 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 3hx2 h PRO 124 Cb 0.88 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 3hx2 h PRO 124 CO 0.67 0.54 -0.18 1.25 -0.23 0.00 0.00 178.00 180.06 3hx2 h HIS 125 N 0.39 -0.47 -0.28 1.56 2.76 -1.97 -0.31 115.15 116.84 3hx2 h HIS 125 Ca 0.08 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.27 3hx2 h HIS 125 Cb 0.45 0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.54 3hx2 h HIS 125 CO 0.01 -0.28 0.10 1.25 -1.30 0.00 0.00 177.93 177.71 3hx2 h LEU 126 N -0.47 0.13 -1.26 0.26 5.85 -1.95 -0.18 115.31 117.68 3hx2 h LEU 126 Ca -0.04 0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.79 3hx2 h LEU 126 Cb 0.38 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 3hx2 h LEU 126 CO 0.04 0.11 0.54 0.00 -0.34 0.00 0.00 178.44 178.79 3hx2 h ASP 128 N 0.86 0.04 -1.03 0.00 3.58 -0.61 -2.43 116.42 116.85 3hx2 h ASP 128 Ca 0.36 -0.52 0.27 0.00 0.42 0.00 0.00 57.03 57.57 3hx2 h ASP 128 Cb 0.30 -0.01 -0.08 0.00 1.72 0.00 0.00 39.33 41.26 3hx2 h ASP 128 CO -0.14 0.55 0.68 0.15 -2.88 0.00 0.00 179.24 177.60 3hx2 h PHE 129 N -0.47 0.48 0.08 0.28 3.04 -0.42 0.22 116.94 120.16 3hx2 h PHE 129 Ca 0.00 0.02 -0.28 0.00 3.98 0.00 0.00 57.97 61.69 3hx2 h PHE 129 Cb 0.54 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.89 3hx2 h PHE 129 CO 0.10 0.06 -1.41 -0.07 -2.02 0.00 0.00 178.31 174.98 3hx2 h LEU 130 N 0.31 0.27 -0.32 0.59 3.38 -1.28 -2.96 115.31 115.30 3hx2 h LEU 130 Ca 0.55 -0.36 -0.18 0.00 0.09 0.00 0.00 57.88 57.98 3hx2 h LEU 130 Cb 1.58 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.24 3hx2 h LEU 130 CO -0.21 1.30 -0.56 -0.33 0.09 0.00 0.00 178.44 178.73 3hx2 h GLU 131 N 0.05 0.84 0.70 1.13 5.08 -0.47 0.23 114.58 122.13 3hx2 h GLU 131 Ca -0.19 -0.54 -0.03 0.00 -1.00 0.00 0.00 59.36 57.60 3hx2 h GLU 131 Cb 1.96 0.07 0.01 0.00 0.50 0.00 0.00 28.75 31.28 3hx2 h GLU 131 CO 0.15 1.17 -0.33 1.15 -1.00 0.00 0.00 179.01 180.15 3hx2 h THR 132 N 0.64 0.00 -0.06 1.13 2.02 -0.78 -3.38 112.91 112.48 3hx2 h THR 132 Ca 0.01 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.90 3hx2 h THR 132 Cb 1.16 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 3hx2 h THR 132 CO 0.12 0.00 0.00 1.41 0.37 0.00 0.00 175.52 177.42 3hx2 n HIS 133 N -5.33 0.04 0.08 3.16 8.25 -1.12 -4.84 115.22 115.47 3hx2 n HIS 133 Ca -0.12 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 3hx2 n HIS 133 Cb 0.37 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.48 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 1.27 -1.00 -0.28 4.41 3.72 -0.54 -4.72 117.46 120.31 3hx2 n PHE 134 Ca 0.13 0.18 0.07 0.00 -0.05 0.00 0.00 57.45 57.79 3hx2 n PHE 134 Cb 0.56 0.26 0.19 0.00 -0.94 0.00 0.00 39.48 39.55 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 -0.35 -0.10 4.37 3.38 -1.20 -0.22 115.31 121.19 3hx2 h LEU 135 Ca 0.00 0.21 -0.16 0.00 0.09 0.00 0.00 57.88 58.02 3hx2 h LEU 135 Cb 0.00 0.37 0.01 0.00 0.09 0.00 0.00 40.66 41.13 3hx2 h LEU 135 CO 0.00 -0.21 -0.57 -0.78 0.09 0.00 0.00 178.44 176.97 3hx2 h ASP 136 N 0.10 0.67 -0.74 -0.43 -0.00 -1.83 -2.45 116.42 111.74 3hx2 h ASP 136 Ca 0.46 -0.65 0.11 0.00 -0.00 0.00 0.00 57.03 56.95 3hx2 h ASP 136 Cb 0.84 -0.20 -0.08 0.00 -0.00 0.00 0.00 39.33 39.89 3hx2 h ASP 136 CO -0.72 1.22 0.36 -0.33 -0.00 0.00 0.00 179.24 179.77 3hx2 h GLU 137 N 0.18 0.56 0.11 0.28 4.39 -1.64 0.37 114.58 118.82 3hx2 h GLU 137 Ca -0.04 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 3hx2 h GLU 137 Cb 1.22 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 3hx2 h GLU 137 CO 0.12 0.37 -0.05 0.93 -1.16 0.00 0.00 179.01 179.22 3hx2 h GLU 138 N 0.58 -0.14 -0.78 2.33 4.39 -1.02 -1.33 114.58 118.60 3hx2 h GLU 138 Ca 0.38 0.01 0.06 0.00 0.34 0.00 0.00 59.36 60.15 3hx2 h GLU 138 Cb 0.46 0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.09 3hx2 h GLU 138 CO -0.31 0.01 0.47 0.28 -1.16 0.00 0.00 179.01 178.30 3hx2 h VAL 139 N -0.27 1.02 0.21 3.13 2.07 -0.91 0.13 116.25 121.64 3hx2 h VAL 139 Ca -0.01 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 3hx2 h VAL 139 Cb 0.22 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 3hx2 h VAL 139 CO 0.02 0.16 -0.10 0.11 0.02 0.00 0.00 177.57 177.78 3hx2 h LYS 140 N 0.86 -0.28 -0.82 1.57 1.57 -0.80 -1.36 116.57 117.32 3hx2 h LYS 140 Ca 0.34 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 59.15 3hx2 h LYS 140 Cb 0.16 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 3hx2 h LYS 140 CO -0.17 -0.18 0.54 1.25 -0.57 0.00 0.00 179.45 180.32 3hx2 h LEU 141 N -0.29 0.93 -0.35 2.94 5.85 -0.79 -0.70 115.31 122.91 3hx2 h LEU 141 Ca -0.03 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 3hx2 h LEU 141 Cb 0.22 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3hx2 h LEU 141 CO 0.05 0.67 0.20 0.40 -0.34 0.00 0.00 178.44 179.41 3hx2 h ILE 142 N 1.10 1.13 -0.66 4.05 2.04 -0.55 -1.18 117.51 123.45 3hx2 h ILE 142 Ca 0.30 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3hx2 h ILE 142 Cb -0.11 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 3hx2 h ILE 142 CO -0.07 0.13 0.39 0.50 0.00 0.00 0.00 178.15 179.10 3hx2 h LYS 143 N 0.44 0.74 -0.23 2.37 1.63 -0.80 0.20 116.57 120.92 3hx2 h LYS 143 Ca 0.12 -0.04 0.03 0.00 -0.85 0.00 0.00 60.65 59.91 3hx2 h LYS 143 Cb 0.04 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.47 3hx2 h LYS 143 CO -0.02 0.49 0.04 -0.22 -3.45 0.00 0.00 179.45 176.28 3hx2 h LYS 144 N 0.76 0.12 -0.36 1.90 3.64 -0.74 -1.30 116.57 120.59 3hx2 h LYS 144 Ca 0.27 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 3hx2 h LYS 144 Cb 0.07 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3hx2 h LYS 144 CO -0.13 0.08 0.13 0.52 -2.27 0.00 0.00 179.45 177.78 3hx2 h MET 145 N 0.12 0.54 -0.29 1.90 2.86 -0.36 -1.80 114.93 117.91 3hx2 h MET 145 Ca 0.11 -0.10 0.08 0.00 -2.06 0.00 0.00 59.70 57.73 3hx2 h MET 145 Cb 0.11 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 3hx2 h MET 145 CO -0.15 0.54 0.22 0.78 1.06 0.00 0.00 176.91 179.35 3hx2 h GLY 146 N 0.43 0.00 0.32 8.32 0.00 -0.21 0.25 103.07 112.18 3hx2 h GLY 146 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.45 3hx2 h GLY 146 CO -0.01 0.00 -0.01 -0.55 0.00 0.00 0.00 176.54 175.97 3hx2 h ASP 147 N 0.00 -0.03 -0.29 0.19 3.32 -0.51 -2.82 116.42 116.28 3hx2 h ASP 147 Ca 0.14 -0.63 0.06 0.00 0.02 0.00 0.00 57.03 56.62 3hx2 h ASP 147 Cb 0.57 0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.06 3hx2 h ASP 147 CO -0.00 0.64 -0.14 0.45 -1.72 0.00 0.00 179.24 178.46 3hx2 h HIS 148 N -0.71 -0.34 -0.92 4.55 3.86 -0.68 0.18 115.15 121.08 3hx2 h HIS 148 Ca -0.00 0.03 0.16 0.00 -1.16 0.00 0.00 60.37 59.40 3hx2 h HIS 148 Cb 0.65 0.20 -0.10 0.00 1.06 0.00 0.00 27.41 29.22 3hx2 h HIS 148 CO 0.15 -0.21 0.52 -0.07 0.86 0.00 0.00 177.93 179.18 3hx2 h LEU 149 N -0.10 0.67 -0.70 2.43 3.38 -1.03 0.68 115.31 120.64 3hx2 h LEU 149 Ca 0.15 0.09 -0.14 0.00 0.09 0.00 0.00 57.88 58.07 3hx2 h LEU 149 Cb 0.33 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3hx2 h LEU 149 CO -0.36 0.27 -0.57 0.74 0.09 0.00 0.00 178.44 178.62 3hx2 h THR 150 N 0.72 1.37 -0.05 0.22 2.02 -1.00 -1.33 112.91 114.87 3hx2 h THR 150 Ca 0.51 -1.90 -0.14 0.00 0.77 0.00 0.00 66.41 65.65 3hx2 h THR 150 Cb 0.72 1.94 0.01 0.00 -1.74 0.00 0.00 68.15 69.08 3hx2 h THR 150 CO -0.36 0.56 -0.51 0.78 0.37 0.00 0.00 175.52 176.36 3hx2 h ASN 151 N 0.18 0.54 -0.19 4.18 2.35 0.11 -2.33 115.58 120.43 3hx2 h ASN 151 Ca -0.00 -0.69 0.00 0.00 -0.55 0.00 0.00 56.30 55.06 3hx2 h ASN 151 Cb 1.05 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.25 3hx2 h ASN 151 CO 0.09 1.16 0.12 -0.07 -1.65 0.00 0.00 177.43 177.08 3hx2 h LEU 152 N -0.02 0.22 -1.48 1.61 3.38 0.27 -1.55 115.31 117.74 3hx2 h LEU 152 Ca -0.05 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 57.99 3hx2 h LEU 152 Cb 1.19 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 3hx2 h LEU 152 CO 0.10 0.17 0.45 -0.74 0.09 0.00 0.00 178.44 178.52 3hx2 h HIS 153 N 0.25 0.63 -0.23 1.13 2.76 -1.29 -1.35 115.15 117.05 3hx2 h HIS 153 Ca 0.07 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.12 3hx2 h HIS 153 Cb -0.01 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.73 3hx2 h HIS 153 CO -0.06 0.31 -0.41 -0.09 -1.30 0.00 0.00 177.93 176.38 3hx2 h ARG 154 N 0.61 0.55 -1.66 5.26 2.43 -0.77 -3.26 114.38 117.53 3hx2 h ARG 154 Ca 0.31 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3hx2 h ARG 154 Cb 0.41 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3hx2 h ARG 154 CO -0.10 0.86 0.00 1.28 -1.51 0.00 0.00 179.97 180.50 3hx2 n LEU 155 N -4.03 2.17 0.00 3.80 4.77 -0.51 -3.87 117.00 119.34 3hx2 n LEU 155 Ca -0.02 -1.03 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 3hx2 n LEU 155 Cb 0.52 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3hx2 n LEU 155 CO 0.45 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 3hx2 n GLY 156 N 1.10 -0.21 0.00 -0.72 0.00 -1.23 -5.08 105.19 99.06 3hx2 n GLY 156 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 2.77 0.86 0.15 -0.02 0.00 -1.25 -4.94 105.19 102.75 3hx2 n GLY 157 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 0.19 0.00 1.61 0.13 -1.99 -3.52 132.00 128.42 3hx2 h PRO 158 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3hx2 h PRO 158 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.09 3hx2 h PRO 158 CO 0.00 0.13 0.00 0.39 -0.23 0.00 0.00 178.00 178.29