#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hx7 s SER 3 N 0.00 6.08 0.66 4.04 0.15 -1.26 -4.89 113.70 118.48 3hx7 s SER 3 Ca 0.00 2.93 0.39 0.00 0.70 0.00 0.00 55.95 59.97 3hx7 s SER 3 Cb 0.00 -2.66 2.13 0.00 -1.71 0.00 0.00 66.02 63.78 3hx7 s SER 3 CO 0.00 -1.03 2.20 0.06 1.20 0.00 0.00 173.24 175.66 3hx7 h GLN 4 N 2.59 0.00 -0.01 5.44 3.07 -2.00 -1.46 115.11 122.74 3hx7 h GLN 4 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.23 3hx7 h GLN 4 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 3hx7 h GLN 4 CO 0.62 0.00 -0.15 0.44 0.09 0.00 0.00 178.83 179.83 3hx7 n ILE 5 N -2.99 0.00 -2.09 1.86 -5.35 -1.26 -5.00 119.36 104.53 3hx7 n ILE 5 Ca -0.03 -0.42 -0.41 0.00 -0.27 0.00 0.00 62.75 61.62 3hx7 n ILE 5 Cb 0.18 1.21 -0.03 0.00 -1.74 0.00 0.00 39.64 39.26 3hx7 n ILE 5 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3hx7 s ARG 6 N -1.40 4.32 -0.29 6.28 3.52 -0.55 -4.78 118.95 126.04 3hx7 s ARG 6 Ca 0.13 2.21 -0.11 0.00 -0.13 0.00 0.00 55.73 57.82 3hx7 s ARG 6 Cb 0.11 -3.14 0.12 0.00 -1.56 0.00 0.00 34.95 30.48 3hx7 s ARG 6 CO 0.26 -0.34 0.65 -1.14 -0.81 0.00 0.00 175.30 173.92 3hx7 s GLN 7 N -0.39 0.60 -1.80 5.12 0.74 -1.26 -4.92 119.66 117.74 3hx7 s GLN 7 Ca 0.58 1.39 0.00 0.00 0.05 0.00 0.00 55.36 57.38 3hx7 s GLN 7 Cb -0.40 0.70 0.00 0.00 1.10 0.00 0.00 33.01 34.41 3hx7 s GLN 7 CO 0.42 -0.19 0.00 -1.71 -0.55 0.00 0.00 175.29 173.26 3hx7 n ASN 8 N 5.20 -5.14 -4.21 6.67 5.15 -1.26 -4.97 115.26 116.70 3hx7 n ASN 8 Ca -0.14 0.34 -0.39 0.00 -0.60 0.00 0.00 54.58 53.79 3hx7 n ASN 8 Cb 0.51 -4.21 -0.10 0.00 -0.53 0.00 0.00 39.78 35.45 3hx7 n ASN 8 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 3hx7 s TYR 9 N -2.71 3.42 0.57 1.20 5.04 -1.26 -4.81 117.35 118.81 3hx7 s TYR 9 Ca 0.00 -1.85 -0.18 0.00 -2.44 0.00 0.00 57.07 52.60 3hx7 s TYR 9 Cb 0.00 -3.13 -0.04 0.00 0.35 0.00 0.00 41.96 39.13 3hx7 s TYR 9 CO 0.00 -0.92 1.12 -1.54 -1.34 0.00 0.00 175.55 172.87 3hx7 s SER 10 N 2.17 5.59 0.36 4.32 1.04 -1.26 -4.94 113.70 120.98 3hx7 s SER 10 Ca 0.05 2.10 0.07 0.00 0.48 0.00 0.00 55.95 58.64 3hx7 s SER 10 Cb -0.24 -2.57 0.68 0.00 0.10 0.00 0.00 66.02 63.99 3hx7 s SER 10 CO -0.00 -1.31 1.88 0.71 0.98 0.00 0.00 173.24 175.50 3hx7 h THR 11 N 0.86 1.20 -0.17 2.02 1.35 -1.99 -2.33 112.91 113.85 3hx7 h THR 11 Ca -0.49 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.51 3hx7 h THR 11 Cb 1.25 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 68.83 3hx7 h THR 11 CO 0.56 0.28 0.11 0.44 -0.25 0.00 0.00 175.52 176.66 3hx7 h ASP 12 N 0.32 0.19 -0.21 5.36 3.45 -1.99 -1.56 116.42 121.99 3hx7 h ASP 12 Ca 0.06 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.50 3hx7 h ASP 12 Cb 0.41 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 39.12 3hx7 h ASP 12 CO 0.02 0.14 0.07 0.58 -1.57 0.00 0.00 179.24 178.48 3hx7 h VAL 13 N 0.22 1.18 -0.84 -1.35 2.07 -1.89 0.80 116.25 116.44 3hx7 h VAL 13 Ca 0.06 -0.58 0.20 0.00 0.82 0.00 0.00 66.70 67.20 3hx7 h VAL 13 Cb -0.02 1.18 -0.12 0.00 -1.52 0.00 0.00 31.29 30.81 3hx7 h VAL 13 CO -0.01 0.18 0.29 -0.08 0.02 0.00 0.00 177.57 177.97 3hx7 h GLU 14 N 0.16 0.32 0.18 1.57 4.81 -1.21 0.28 114.58 120.70 3hx7 h GLU 14 Ca 0.07 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 3hx7 h GLU 14 Cb 0.22 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.53 3hx7 h GLU 14 CO -0.00 0.21 -0.09 0.00 -0.73 0.00 0.00 179.01 178.40 3hx7 h ALA 15 N 1.68 -0.25 -0.23 2.92 0.00 -0.99 -2.51 119.26 119.89 3hx7 h ALA 15 Ca 0.51 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.28 3hx7 h ALA 15 Cb 0.93 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3hx7 h ALA 15 CO -0.54 -0.43 0.27 0.00 0.00 0.00 0.00 179.25 178.56 3hx7 h ALA 16 N 0.02 1.84 0.14 0.00 0.00 0.99 0.44 119.26 122.69 3hx7 h ALA 16 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3hx7 h ALA 16 Cb 0.48 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3hx7 h ALA 16 CO 0.04 -0.39 -0.07 0.28 0.00 0.00 0.00 179.25 179.11 3hx7 h VAL 17 N 0.00 0.76 -0.80 0.00 2.07 -0.40 -2.09 116.25 115.80 3hx7 h VAL 17 Ca 0.11 -1.21 0.15 0.00 0.82 0.00 0.00 66.70 66.56 3hx7 h VAL 17 Cb 0.66 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.70 3hx7 h VAL 17 CO -0.00 0.22 0.53 0.78 0.02 0.00 0.00 177.57 179.11 3hx7 h ASN 18 N -0.92 0.48 0.03 0.57 2.35 -0.81 0.49 115.58 117.76 3hx7 h ASN 18 Ca -0.02 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3hx7 h ASN 18 Cb 0.50 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.80 3hx7 h ASN 18 CO 0.03 0.25 -0.01 -1.28 -1.65 0.00 0.00 177.43 174.76 3hx7 h SER 19 N 0.51 -0.03 -0.23 5.81 0.87 -0.98 -2.33 113.55 117.16 3hx7 h SER 19 Ca 0.39 -0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 3hx7 h SER 19 Cb 0.80 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 3hx7 h SER 19 CO -0.15 0.26 0.05 0.25 -0.53 0.00 0.00 176.83 176.72 3hx7 h LEU 20 N -0.33 0.43 -0.35 2.23 5.85 -0.35 0.51 115.31 123.30 3hx7 h LEU 20 Ca -0.00 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.67 3hx7 h LEU 20 Cb 0.31 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 3hx7 h LEU 20 CO 0.01 0.46 0.19 0.58 -0.34 0.00 0.00 178.44 179.34 3hx7 h VAL 21 N 0.46 1.02 -0.44 1.05 2.07 0.05 0.82 116.25 121.28 3hx7 h VAL 21 Ca 0.11 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 3hx7 h VAL 21 Cb 0.22 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3hx7 h VAL 21 CO 0.00 0.07 0.26 -1.13 0.02 0.00 0.00 177.57 176.79 3hx7 h ASN 22 N 0.40 0.54 -0.00 0.57 -0.73 -0.80 0.25 115.58 115.80 3hx7 h ASN 22 Ca 0.14 -0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.24 3hx7 h ASN 22 Cb 0.02 -0.14 -0.00 0.00 0.27 0.00 0.00 38.32 38.47 3hx7 h ASN 22 CO -0.07 0.45 0.00 0.25 -0.37 0.00 0.00 177.43 177.68 3hx7 h LEU 23 N 0.58 0.00 0.22 0.34 5.85 -0.11 -1.08 115.31 121.11 3hx7 h LEU 23 Ca 0.16 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.54 3hx7 h LEU 23 Cb 0.01 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.07 3hx7 h LEU 23 CO -0.03 0.00 -1.53 1.88 -0.34 0.00 0.00 178.44 178.42 3hx7 h TYR 24 N 0.00 0.86 -0.28 1.25 -1.99 0.86 -2.72 116.97 114.94 3hx7 h TYR 24 Ca 0.00 -0.62 -0.02 0.00 2.00 0.00 0.00 58.73 60.09 3hx7 h TYR 24 Cb 0.00 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 38.68 3hx7 h TYR 24 CO 0.00 1.56 0.09 -0.07 -0.00 0.00 0.00 178.16 179.74 3hx7 h LEU 25 N 0.13 0.36 -0.47 3.88 3.38 -0.39 -0.37 115.31 121.82 3hx7 h LEU 25 Ca -0.27 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.50 3hx7 h LEU 25 Cb 2.13 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.79 3hx7 h LEU 25 CO 0.24 0.35 -0.62 -0.61 0.09 0.00 0.00 178.44 177.89 3hx7 h GLN 26 N 0.40 0.50 -0.13 1.13 4.15 -1.24 -1.97 115.11 117.96 3hx7 h GLN 26 Ca 0.10 -0.35 -0.20 0.00 0.77 0.00 0.00 58.65 58.97 3hx7 h GLN 26 Cb 0.12 0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.87 3hx7 h GLN 26 CO -0.01 0.96 -0.73 0.00 -1.93 0.00 0.00 178.83 177.13 3hx7 h ALA 27 N 0.95 0.48 -0.04 3.38 0.00 -1.06 -2.19 119.26 120.79 3hx7 h ALA 27 Ca -0.01 -0.59 0.03 0.00 0.00 0.00 0.00 54.91 54.34 3hx7 h ALA 27 Cb 1.17 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 3hx7 h ALA 27 CO 0.11 0.72 -0.13 1.03 0.00 0.00 0.00 179.25 180.98 3hx7 h SER 28 N 0.41 -0.39 -0.07 0.00 0.87 -0.94 -0.90 113.55 112.53 3hx7 h SER 28 Ca -0.03 0.06 0.04 0.00 -1.23 0.00 0.00 61.79 60.63 3hx7 h SER 28 Cb 1.32 0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 63.41 3hx7 h SER 28 CO 0.14 -0.18 -0.23 0.22 -0.53 0.00 0.00 176.83 176.24 3hx7 h TYR 29 N -0.20 -0.61 -0.96 2.24 5.03 -1.30 0.14 116.97 121.30 3hx7 h TYR 29 Ca 0.06 0.03 0.15 0.00 2.58 0.00 0.00 58.73 61.55 3hx7 h TYR 29 Cb 0.28 0.28 -0.09 0.00 1.55 0.00 0.00 36.73 38.76 3hx7 h TYR 29 CO -0.21 -0.31 0.61 1.15 -1.32 0.00 0.00 178.16 178.07 3hx7 h THR 30 N -0.32 0.82 -0.05 1.81 2.02 -1.04 -0.52 112.91 115.63 3hx7 h THR 30 Ca 0.08 -0.27 -0.16 0.00 0.77 0.00 0.00 66.41 66.83 3hx7 h THR 30 Cb 0.44 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3hx7 h THR 30 CO -0.26 0.15 -0.67 1.88 0.37 0.00 0.00 175.52 176.98 3hx7 h TYR 31 N 0.80 0.28 -0.72 3.16 0.05 0.29 -0.89 116.97 119.93 3hx7 h TYR 31 Ca 0.50 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 59.11 3hx7 h TYR 31 Cb 0.73 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.39 3hx7 h TYR 31 CO -0.00 0.82 0.23 1.25 -1.05 0.00 0.00 178.16 179.40 3hx7 h LEU 32 N 0.15 1.04 0.09 3.88 5.85 0.68 0.99 115.31 127.99 3hx7 h LEU 32 Ca -0.02 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 3hx7 h LEU 32 Cb 1.21 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.97 3hx7 h LEU 32 CO 0.10 0.96 -0.04 -1.28 -0.34 0.00 0.00 178.44 177.84 3hx7 h SER 33 N 1.07 -0.10 -0.85 1.25 0.87 -0.97 -2.47 113.55 112.35 3hx7 h SER 33 Ca 0.23 -0.41 0.14 0.00 -1.23 0.00 0.00 61.79 60.53 3hx7 h SER 33 Cb 0.29 0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 62.22 3hx7 h SER 33 CO -0.01 0.39 0.55 -0.07 -0.53 0.00 0.00 176.83 177.16 3hx7 h LEU 34 N -0.63 0.58 0.48 2.23 3.38 -1.00 0.60 115.31 120.96 3hx7 h LEU 34 Ca -0.01 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3hx7 h LEU 34 Cb 0.51 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3hx7 h LEU 34 CO 0.02 0.30 -0.23 1.23 0.09 0.00 0.00 178.44 179.85 3hx7 h GLY 35 N 0.62 -0.68 2.00 0.83 0.00 -0.71 -2.88 103.07 102.26 3hx7 h GLY 35 Ca 0.42 0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.99 3hx7 h GLY 35 CO -0.18 -0.25 -0.06 0.74 0.00 0.00 0.00 176.54 176.80 3hx7 h PHE 36 N -0.78 0.00 -0.64 5.60 -1.00 -0.95 -2.65 116.94 116.53 3hx7 h PHE 36 Ca -0.07 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.64 3hx7 h PHE 36 Cb 0.56 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.09 3hx7 h PHE 36 CO -0.01 0.06 0.10 -0.92 -1.61 0.00 0.00 178.31 175.92 3hx7 h TYR 37 N 0.00 1.11 -0.00 -0.55 3.20 -0.83 -2.05 116.97 117.86 3hx7 h TYR 37 Ca -0.00 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.72 3hx7 h TYR 37 Cb 0.58 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.55 3hx7 h TYR 37 CO 0.00 0.94 -0.03 1.19 -1.64 0.00 0.00 178.16 178.62 3hx7 n PHE 38 N -4.22 0.00 0.96 -3.82 3.72 -1.01 -2.79 117.46 110.30 3hx7 n PHE 38 Ca 0.04 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.57 3hx7 n PHE 38 Cb 0.29 -0.43 0.39 0.00 -0.94 0.00 0.00 39.48 38.80 3hx7 n PHE 38 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3hx7 n ASP 39 N -1.43 0.33 -4.76 4.37 4.64 -0.79 -1.84 116.55 117.07 3hx7 n ASP 39 Ca 0.09 0.10 -0.41 0.00 -1.38 0.00 0.00 54.79 53.18 3hx7 n ASP 39 Cb 0.32 -0.09 -0.00 0.00 -1.04 0.00 0.00 41.12 40.30 3hx7 n ASP 39 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 3hx7 n ARG 40 N -1.57 2.62 0.21 -0.67 1.74 -1.11 -4.67 116.66 113.21 3hx7 n ARG 40 Ca 0.06 0.92 0.14 0.00 -0.77 0.00 0.00 57.85 58.20 3hx7 n ARG 40 Cb 0.35 -2.65 0.75 0.00 -1.02 0.00 0.00 32.46 29.89 3hx7 n ARG 40 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 3hx7 h ASP 41 N 3.34 0.00 -0.06 0.55 2.03 -1.91 0.76 116.42 121.13 3hx7 h ASP 41 Ca -0.49 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.81 3hx7 h ASP 41 Cb 1.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.74 3hx7 h ASP 41 CO 0.67 0.00 0.00 -0.90 -1.03 0.00 0.00 179.24 177.98 3hx7 n ASP 42 N -4.18 1.41 -0.01 4.15 3.85 -1.26 -4.16 116.55 116.34 3hx7 n ASP 42 Ca 0.00 -1.53 -0.04 0.00 -0.71 0.00 0.00 54.79 52.51 3hx7 n ASP 42 Cb 0.24 -0.04 -0.01 0.00 -1.35 0.00 0.00 41.12 39.96 3hx7 n ASP 42 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 3hx7 n VAL 43 N 0.12 0.50 -3.69 2.12 0.31 0.13 -5.09 118.33 112.72 3hx7 n VAL 43 Ca 0.18 0.04 -0.23 0.00 -0.01 0.00 0.00 64.34 64.32 3hx7 n VAL 43 Cb 0.32 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 3hx7 n VAL 43 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hx7 n ALA 44 N -3.31 -2.66 -3.64 3.52 0.00 0.24 -4.98 120.51 109.69 3hx7 n ALA 44 Ca -0.07 -0.24 -0.28 0.00 0.00 0.00 0.00 53.44 52.84 3hx7 n ALA 44 Cb 0.45 -0.66 -0.12 0.00 0.00 0.00 0.00 19.45 19.12 3hx7 n ALA 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hx7 s LEU 45 N -4.68 2.75 0.37 0.00 1.43 -0.77 -4.99 118.68 112.79 3hx7 s LEU 45 Ca 0.01 -3.13 0.10 0.00 -1.03 0.00 0.00 54.13 50.08 3hx7 s LEU 45 Cb -0.00 -0.95 0.85 0.00 0.03 0.00 0.00 46.19 46.12 3hx7 s LEU 45 CO 0.82 -0.18 1.91 -0.08 0.23 0.00 0.00 176.35 179.05 3hx7 h GLU 46 N 5.95 0.62 0.89 1.70 4.81 -1.94 0.73 114.58 127.34 3hx7 h GLU 46 Ca 0.14 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3hx7 h GLU 46 Cb 0.87 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 30.12 3hx7 h GLU 46 CO 0.50 0.41 -0.43 0.78 -0.73 0.00 0.00 179.01 179.55 3hx7 h GLY 47 N 0.64 -1.24 0.98 1.92 0.00 -1.95 0.12 103.07 103.54 3hx7 h GLY 47 Ca 0.39 0.46 0.05 0.00 0.00 0.00 0.00 47.33 48.23 3hx7 h GLY 47 CO -0.15 -0.45 0.54 -2.08 0.00 0.00 0.00 176.54 174.39 3hx7 h VAL 48 N -1.25 1.08 -0.19 4.60 2.07 -1.89 -0.59 116.25 120.08 3hx7 h VAL 48 Ca -0.12 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.08 3hx7 h VAL 48 Cb 0.91 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3hx7 h VAL 48 CO 0.20 0.17 0.10 -1.28 0.02 0.00 0.00 177.57 176.79 3hx7 h SER 49 N 0.95 0.16 0.00 0.57 0.87 -0.69 -2.18 113.55 113.23 3hx7 h SER 49 Ca 0.35 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.91 3hx7 h SER 49 Cb 0.16 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 3hx7 h SER 49 CO -0.12 0.12 -0.00 -0.74 -0.53 0.00 0.00 176.83 175.57 3hx7 h HIS 50 N 0.22 -0.00 -0.43 2.24 6.17 -0.10 -1.53 115.15 121.71 3hx7 h HIS 50 Ca 0.07 -0.00 0.08 0.00 0.71 0.00 0.00 60.37 61.23 3hx7 h HIS 50 Cb 0.00 0.00 -0.09 0.00 2.52 0.00 0.00 27.41 29.84 3hx7 h HIS 50 CO -0.08 0.01 -0.37 0.35 0.71 0.00 0.00 177.93 178.55 3hx7 h PHE 51 N -0.01 -1.05 -0.05 5.26 3.57 -0.94 -0.33 116.94 123.39 3hx7 h PHE 51 Ca -0.00 0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 3hx7 h PHE 51 Cb 0.01 0.52 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 3hx7 h PHE 51 CO -0.07 -0.41 -0.40 0.74 -2.23 0.00 0.00 178.31 175.94 3hx7 h PHE 52 N -0.27 0.11 -0.29 0.41 0.05 -1.26 -1.95 116.94 113.73 3hx7 h PHE 52 Ca 0.17 -0.03 -0.10 0.00 3.82 0.00 0.00 57.97 61.83 3hx7 h PHE 52 Cb 0.56 -0.03 -0.01 0.00 2.00 0.00 0.00 35.95 38.47 3hx7 h PHE 52 CO -0.59 0.49 -0.25 0.00 -0.18 0.00 0.00 178.31 177.78 3hx7 h ARG 53 N 0.08 0.58 0.07 1.51 3.08 -0.15 -2.06 114.38 117.49 3hx7 h ARG 53 Ca 0.01 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 3hx7 h ARG 53 Cb 0.75 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.77 3hx7 h ARG 53 CO 0.06 0.78 -0.03 0.93 -1.07 0.00 0.00 179.97 180.64 3hx7 h GLU 54 N 0.51 -0.09 -0.80 0.04 5.08 -0.73 -2.54 114.58 116.06 3hx7 h GLU 54 Ca 0.07 0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.66 3hx7 h GLU 54 Cb 0.71 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 3hx7 h GLU 54 CO 0.05 0.22 0.57 -0.07 -1.00 0.00 0.00 179.01 178.78 3hx7 h LEU 55 N -0.40 0.06 -0.41 1.33 3.38 -1.21 0.37 115.31 118.43 3hx7 h LEU 55 Ca -0.01 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3hx7 h LEU 55 Cb 0.35 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3hx7 h LEU 55 CO 0.02 0.03 -0.12 0.00 0.09 0.00 0.00 178.44 178.45 3hx7 h ALA 56 N 1.61 0.57 0.00 1.53 0.00 -0.97 -1.90 119.26 120.11 3hx7 h ALA 56 Ca 0.38 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 3hx7 h ALA 56 Cb 1.43 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 3hx7 h ALA 56 CO -0.03 0.47 -0.50 1.49 0.00 0.00 0.00 179.25 180.68 3hx7 h GLU 57 N 0.63 0.00 -0.17 0.00 4.57 0.01 -2.12 114.58 117.50 3hx7 h GLU 57 Ca 0.10 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 3hx7 h GLU 57 Cb 0.66 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.24 3hx7 h GLU 57 CO 0.05 0.50 -0.02 0.93 -1.18 0.00 0.00 179.01 179.29 3hx7 h GLU 58 N 0.00 0.31 -0.12 1.92 5.08 -0.91 -1.75 114.58 119.11 3hx7 h GLU 58 Ca -0.00 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 3hx7 h GLU 58 Cb 0.95 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 3hx7 h GLU 58 CO 0.06 0.55 0.03 0.87 -1.00 0.00 0.00 179.01 179.53 3hx7 h LYS 59 N 0.04 0.16 -0.31 2.33 1.79 -1.15 -0.42 116.57 119.00 3hx7 h LYS 59 Ca 0.05 -0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.44 3hx7 h LYS 59 Cb 0.42 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 3hx7 h LYS 59 CO 0.01 0.15 -0.04 -0.09 -1.08 0.00 0.00 179.45 178.40 3hx7 h ARG 60 N 0.16 0.58 -0.83 3.15 2.43 -1.06 -2.13 114.38 116.68 3hx7 h ARG 60 Ca 0.04 -0.21 0.03 0.00 -0.81 0.00 0.00 59.98 59.04 3hx7 h ARG 60 Cb 0.06 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.52 3hx7 h ARG 60 CO -0.00 0.75 0.55 0.93 -1.51 0.00 0.00 179.97 180.68 3hx7 h GLU 61 N 0.36 1.01 0.13 0.20 5.08 -0.24 -1.29 114.58 119.82 3hx7 h GLU 61 Ca 0.08 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3hx7 h GLU 61 Cb 0.51 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3hx7 h GLU 61 CO 0.02 0.67 -0.06 0.78 -1.00 0.00 0.00 179.01 179.42 3hx7 h GLY 62 N 1.04 -0.18 2.00 -3.84 0.00 -0.77 0.49 103.07 101.81 3hx7 h GLY 62 Ca 0.33 0.06 -0.05 0.00 0.00 0.00 0.00 47.33 47.67 3hx7 h GLY 62 CO -0.09 -0.06 -0.23 0.10 0.00 0.00 0.00 176.54 176.25 3hx7 h TYR 63 N -0.28 0.00 -0.06 5.60 -0.00 -1.16 -1.45 116.97 119.62 3hx7 h TYR 63 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 58.73 58.56 3hx7 h TYR 63 Cb 0.23 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.95 3hx7 h TYR 63 CO -0.03 0.23 -0.65 0.93 -0.00 0.00 0.00 178.16 178.63 3hx7 h GLU 64 N 0.00 0.26 0.31 0.10 5.08 -1.05 -0.74 114.58 118.55 3hx7 h GLU 64 Ca -0.00 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 3hx7 h GLU 64 Cb 0.84 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3hx7 h GLU 64 CO 0.03 0.82 -0.15 -0.09 -1.00 0.00 0.00 179.01 178.63 3hx7 h ARG 65 N 0.19 -0.40 -0.95 2.33 2.43 -0.36 -0.55 114.38 117.08 3hx7 h ARG 65 Ca -0.01 0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.28 3hx7 h ARG 65 Cb 1.18 0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.75 3hx7 h ARG 65 CO 0.10 -0.10 0.61 -0.07 -1.51 0.00 0.00 179.97 179.00 3hx7 h LEU 66 N -0.71 0.88 -0.63 3.80 3.38 -1.26 0.18 115.31 120.95 3hx7 h LEU 66 Ca -0.04 0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 3hx7 h LEU 66 Cb 0.48 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3hx7 h LEU 66 CO 0.07 0.51 -0.41 -0.07 0.09 0.00 0.00 178.44 178.62 3hx7 h LEU 67 N 0.96 0.65 -0.23 1.67 3.38 -0.99 0.42 115.31 121.17 3hx7 h LEU 67 Ca 0.45 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 3hx7 h LEU 67 Cb 0.41 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3hx7 h LEU 67 CO -0.20 0.98 -0.04 0.50 0.09 0.00 0.00 178.44 179.76 3hx7 h LYS 68 N 0.50 0.44 -0.69 1.13 1.63 0.05 -2.85 116.57 116.77 3hx7 h LYS 68 Ca 0.04 -0.16 -0.03 0.00 -0.85 0.00 0.00 60.65 59.64 3hx7 h LYS 68 Cb 0.93 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.50 3hx7 h LYS 68 CO 0.08 0.66 0.29 1.98 -3.45 0.00 0.00 179.45 179.02 3hx7 h MET 69 N 0.18 1.01 -0.44 1.90 4.05 -0.50 -2.08 114.93 119.05 3hx7 h MET 69 Ca 0.06 -0.16 0.05 0.00 -0.28 0.00 0.00 59.70 59.37 3hx7 h MET 69 Cb 0.49 -0.18 -0.05 0.00 -0.80 0.00 0.00 31.60 31.07 3hx7 h MET 69 CO 0.02 0.81 0.17 0.37 0.23 0.00 0.00 176.91 178.51 3hx7 h GLN 70 N 1.00 0.33 -0.39 0.39 5.75 -0.76 -1.57 115.11 119.86 3hx7 h GLN 70 Ca 0.24 -0.02 -0.13 0.00 -0.15 0.00 0.00 58.65 58.59 3hx7 h GLN 70 Cb 0.16 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 3hx7 h GLN 70 CO -0.02 0.22 -0.28 -0.91 -2.65 0.00 0.00 178.83 175.19 3hx7 h ASN 71 N 0.34 0.86 -0.28 -0.69 4.21 -1.23 0.29 115.58 119.08 3hx7 h ASN 71 Ca 0.21 -0.34 0.05 0.00 1.21 0.00 0.00 56.30 57.42 3hx7 h ASN 71 Cb 0.19 -0.24 -0.04 0.00 -1.12 0.00 0.00 38.32 37.11 3hx7 h ASN 71 CO -0.20 1.08 0.01 1.56 -1.29 0.00 0.00 177.43 178.59 3hx7 h GLN 72 N 0.71 0.10 0.00 0.81 1.08 -0.83 -1.53 115.11 115.45 3hx7 h GLN 72 Ca 0.08 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3hx7 h GLN 72 Cb 0.82 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.23 3hx7 h GLN 72 CO 0.07 0.07 0.00 0.54 -0.95 0.00 0.00 178.83 178.56 3hx7 n ARG 73 N -5.14 0.19 -0.11 1.46 5.12 -0.64 -4.89 116.66 112.64 3hx7 n ARG 73 Ca -0.00 0.38 0.00 0.00 -1.93 0.00 0.00 57.85 56.30 3hx7 n ARG 73 Cb 0.14 -1.83 0.00 0.00 -1.16 0.00 0.00 32.46 29.61 3hx7 n ARG 73 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hx7 n GLY 74 N 0.18 0.70 3.78 -0.13 0.00 -0.58 -4.19 105.19 104.95 3hx7 n GLY 74 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 3hx7 n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hx7 s GLY 75 N -1.45 1.66 -0.06 -0.02 0.00 0.07 -4.53 107.32 102.99 3hx7 s GLY 75 Ca 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 43.81 3hx7 s GLY 75 CO 0.00 -0.18 -0.11 0.50 0.00 0.00 0.00 173.10 173.31 3hx7 s ARG 76 N -5.56 1.59 0.19 2.90 1.81 -1.26 -4.39 118.95 114.22 3hx7 s ARG 76 Ca 0.70 -0.37 -0.30 0.00 -1.72 0.00 0.00 55.73 54.04 3hx7 s ARG 76 Cb -0.09 -1.34 -0.08 0.00 -0.45 0.00 0.00 34.95 32.99 3hx7 s ARG 76 CO 0.54 0.00 1.17 0.00 -0.68 0.00 0.00 175.30 176.33 3hx7 s ALA 77 N 0.73 3.42 -0.25 2.13 0.00 -1.26 -4.98 121.76 121.55 3hx7 s ALA 77 Ca -0.14 0.91 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 3hx7 s ALA 77 Cb -0.16 -3.39 0.07 0.00 0.00 0.00 0.00 23.12 19.64 3hx7 s ALA 77 CO 0.03 -0.32 0.01 -0.51 0.00 0.00 0.00 175.76 174.97 3hx7 s LEU 78 N -0.37 2.21 0.20 0.00 1.43 -1.26 -5.13 118.68 115.76 3hx7 s LEU 78 Ca 0.51 -1.23 -0.16 0.00 -1.03 0.00 0.00 54.13 52.22 3hx7 s LEU 78 Cb -0.32 -0.96 -0.08 0.00 0.03 0.00 0.00 46.19 44.86 3hx7 s LEU 78 CO 0.37 -0.30 0.63 -0.36 0.23 0.00 0.00 176.35 176.91 3hx7 s PHE 79 N 1.55 3.59 0.37 0.29 0.08 -1.26 -4.86 117.98 117.74 3hx7 s PHE 79 Ca 0.00 1.19 0.05 0.00 0.12 0.00 0.00 56.93 58.28 3hx7 s PHE 79 Cb -0.18 -2.47 -0.06 0.00 -0.57 0.00 0.00 43.02 39.74 3hx7 s PHE 79 CO -0.11 0.35 0.05 -0.65 -0.10 0.00 0.00 175.22 174.76 3hx7 s GLN 80 N -2.11 1.80 0.57 0.44 -1.52 -1.26 -5.12 119.66 112.45 3hx7 s GLN 80 Ca 0.42 -2.02 -0.21 0.00 -1.95 0.00 0.00 55.36 51.60 3hx7 s GLN 80 Cb -0.15 -1.12 -0.04 0.00 -0.22 0.00 0.00 33.01 31.48 3hx7 s GLN 80 CO 0.20 -0.18 1.32 -0.25 -0.25 0.00 0.00 175.29 176.13 3hx7 n ASP 81 N -0.85 2.42 -4.30 5.90 10.43 -1.26 -4.97 116.55 123.91 3hx7 n ASP 81 Ca -0.04 0.93 -0.42 0.00 2.57 0.00 0.00 54.79 57.83 3hx7 n ASP 81 Cb 0.67 -1.56 -0.09 0.00 1.84 0.00 0.00 41.12 41.98 3hx7 n ASP 81 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3hx7 s ILE 82 N -1.32 4.53 0.38 0.53 1.01 -1.26 -5.06 121.20 120.00 3hx7 s ILE 82 Ca 0.75 -1.32 -0.26 0.00 0.00 0.00 0.00 60.65 59.82 3hx7 s ILE 82 Cb -0.41 -3.76 -0.12 0.00 0.01 0.00 0.00 42.46 38.18 3hx7 s ILE 82 CO 0.47 -0.54 1.06 0.29 0.00 0.00 0.00 174.94 176.22 3hx7 n LYS 83 N 5.00 1.50 -1.74 2.79 5.02 -1.26 -4.95 118.16 124.52 3hx7 n LYS 83 Ca -0.11 0.53 -0.32 0.00 -2.02 0.00 0.00 58.31 56.39 3hx7 n LYS 83 Cb 0.43 -2.05 0.04 0.00 -0.02 0.00 0.00 35.03 33.43 3hx7 n LYS 83 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 3hx7 s LYS 84 N -1.89 2.90 0.46 1.97 -2.85 -1.26 -4.90 119.74 114.17 3hx7 s LYS 84 Ca 0.61 1.23 -0.23 0.00 -1.00 0.00 0.00 55.97 56.57 3hx7 s LYS 84 Cb -0.59 -1.97 -0.09 0.00 -2.06 0.00 0.00 37.83 33.11 3hx7 s LYS 84 CO 0.59 -1.15 1.07 -2.30 0.10 0.00 0.00 175.35 173.66 3hx7 n PRO 85 N -2.58 1.41 0.00 1.78 -0.02 -1.26 -4.85 135.00 129.47 3hx7 n PRO 85 Ca 0.09 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 3hx7 n PRO 85 Cb 0.53 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3hx7 n PRO 85 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hx7 n ALA 86 N -0.68 1.08 -2.69 3.55 0.00 -1.26 -4.68 120.51 115.83 3hx7 n ALA 86 Ca 0.10 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 3hx7 n ALA 86 Cb 0.41 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 18.81 3hx7 n ALA 86 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hx7 s GLU 87 N -2.79 1.02 -0.06 0.00 0.41 -1.26 -5.03 118.70 111.00 3hx7 s GLU 87 Ca 0.00 -1.02 0.10 0.00 -0.41 0.00 0.00 54.97 53.64 3hx7 s GLU 87 Cb 0.00 0.38 -0.15 0.00 -1.78 0.00 0.00 34.13 32.58 3hx7 s GLU 87 CO 0.00 -0.36 0.15 -0.25 -0.49 0.00 0.00 175.26 174.30 3hx7 n ASP 88 N -0.15 2.48 -4.16 -0.19 8.00 -1.26 -4.95 116.55 116.32 3hx7 n ASP 88 Ca -0.12 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.14 3hx7 n ASP 88 Cb 0.63 1.15 -0.15 0.00 -0.02 0.00 0.00 41.12 42.73 3hx7 n ASP 88 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3hx7 s GLU 89 N -2.52 1.43 0.00 -1.24 2.02 -1.26 -4.99 118.70 112.14 3hx7 s GLU 89 Ca -0.04 -0.61 0.15 0.00 0.02 0.00 0.00 54.97 54.49 3hx7 s GLU 89 Cb 0.05 -1.37 -0.04 0.00 0.10 0.00 0.00 34.13 32.88 3hx7 s GLU 89 CO 0.44 0.35 0.78 0.91 0.02 0.00 0.00 175.26 177.77 3hx7 n TRP 90 N 2.72 0.00 -3.40 1.61 7.02 -1.26 -5.10 117.44 119.02 3hx7 n TRP 90 Ca -0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.33 3hx7 n TRP 90 Cb 0.54 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.43 3hx7 n TRP 90 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3hx7 n GLY 91 N 1.16 -0.18 3.91 6.99 0.00 -1.26 -3.77 105.19 112.05 3hx7 n GLY 91 Ca 0.06 -1.18 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 3hx7 n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hx7 s LYS 92 N 0.00 2.98 0.19 1.61 1.02 -1.26 -4.85 119.74 119.43 3hx7 s LYS 92 Ca 0.00 0.05 -0.19 0.00 0.02 0.00 0.00 55.97 55.85 3hx7 s LYS 92 Cb 0.00 -2.26 0.15 0.00 -0.52 0.00 0.00 37.83 35.20 3hx7 s LYS 92 CO 0.00 -0.68 1.60 1.15 -0.92 0.00 0.00 175.35 176.51 3hx7 h THR 93 N -0.17 0.25 -0.79 2.17 2.02 -1.99 0.15 112.91 114.54 3hx7 h THR 93 Ca -0.45 0.00 0.12 0.00 0.77 0.00 0.00 66.41 66.84 3hx7 h THR 93 Cb 1.25 0.25 -0.06 0.00 -1.74 0.00 0.00 68.15 67.86 3hx7 h THR 93 CO 0.61 0.00 0.52 -0.65 0.37 0.00 0.00 175.52 176.37 3hx7 h PRO 94 N -0.13 0.61 -0.22 6.66 0.11 -1.96 0.17 132.00 137.24 3hx7 h PRO 94 Ca 0.25 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.27 3hx7 h PRO 94 Cb 0.52 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 3hx7 h PRO 94 CO -0.64 0.40 -0.04 -0.44 -0.21 0.00 0.00 178.00 177.08 3hx7 h ASP 95 N 0.62 0.41 -0.54 -2.05 3.45 -1.32 -0.42 116.42 116.57 3hx7 h ASP 95 Ca 0.38 -0.35 -0.07 0.00 0.43 0.00 0.00 57.03 57.42 3hx7 h ASP 95 Cb 0.60 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 39.23 3hx7 h ASP 95 CO -0.14 0.67 0.10 0.00 -1.57 0.00 0.00 179.24 178.29 3hx7 h ALA 96 N 0.76 1.08 0.04 3.45 0.00 -0.11 -2.33 119.26 122.15 3hx7 h ALA 96 Ca 0.06 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hx7 h ALA 96 Cb 0.48 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3hx7 h ALA 96 CO 0.02 0.60 -0.02 1.98 0.00 0.00 0.00 179.25 181.83 3hx7 h MET 97 N 0.89 -0.06 -0.69 0.00 -1.53 -0.52 -1.31 114.93 111.71 3hx7 h MET 97 Ca 0.18 0.00 0.11 0.00 -3.44 0.00 0.00 59.70 56.56 3hx7 h MET 97 Cb 0.38 0.01 -0.04 0.00 -0.55 0.00 0.00 31.60 31.39 3hx7 h MET 97 CO 0.01 0.16 0.46 0.87 0.14 0.00 0.00 176.91 178.55 3hx7 h LYS 98 N -0.27 0.49 -0.35 0.39 1.57 -0.95 0.56 116.57 118.00 3hx7 h LYS 98 Ca -0.01 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 3hx7 h LYS 98 Cb 0.25 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 3hx7 h LYS 98 CO 0.01 0.32 -0.04 0.00 -0.57 0.00 0.00 179.45 179.18 3hx7 h ALA 99 N 1.66 0.48 -0.56 3.86 0.00 -1.01 -1.99 119.26 121.70 3hx7 h ALA 99 Ca 0.32 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3hx7 h ALA 99 Cb 0.58 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3hx7 h ALA 99 CO -0.10 0.28 0.23 0.00 0.00 0.00 0.00 179.25 179.65 3hx7 h ALA 100 N 0.84 0.72 0.18 0.00 0.00 0.16 -1.07 119.26 120.09 3hx7 h ALA 100 Ca 0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hx7 h ALA 100 Cb 0.51 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3hx7 h ALA 100 CO 0.02 0.32 -0.11 1.98 0.00 0.00 0.00 179.25 181.46 3hx7 h MET 101 N 0.76 -0.27 -0.69 0.00 -1.53 -0.88 0.16 114.93 112.47 3hx7 h MET 101 Ca 0.19 0.02 0.06 0.00 -3.44 0.00 0.00 59.70 56.53 3hx7 h MET 101 Cb 0.18 0.06 -0.04 0.00 -0.55 0.00 0.00 31.60 31.25 3hx7 h MET 101 CO -0.02 -0.18 0.46 0.00 0.14 0.00 0.00 176.91 177.31 3hx7 h ALA 102 N 0.53 1.73 -0.53 0.39 0.00 -1.23 0.27 119.26 120.43 3hx7 h ALA 102 Ca -0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 3hx7 h ALA 102 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3hx7 h ALA 102 CO 0.01 0.16 -0.13 1.25 0.00 0.00 0.00 179.25 180.55 3hx7 h LEU 103 N 0.72 1.02 0.12 0.00 5.85 -0.68 -2.19 115.31 120.15 3hx7 h LEU 103 Ca 0.30 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 3hx7 h LEU 103 Cb 0.26 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3hx7 h LEU 103 CO -0.10 1.15 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.76 3hx7 h GLU 104 N 0.89 -0.15 -0.33 1.25 4.39 0.11 -0.86 114.58 119.88 3hx7 h GLU 104 Ca 0.13 0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.94 3hx7 h GLU 104 Cb 0.70 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 3hx7 h GLU 104 CO 0.05 0.15 0.29 0.87 -1.16 0.00 0.00 179.01 179.21 3hx7 h LYS 105 N -0.45 0.00 -0.03 2.33 1.57 -0.55 0.40 116.57 119.83 3hx7 h LYS 105 Ca -0.02 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3hx7 h LYS 105 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3hx7 h LYS 105 CO 0.03 0.00 -0.25 -0.22 -0.57 0.00 0.00 179.45 178.43 3hx7 h LYS 106 N 0.00 0.23 -0.81 3.15 3.64 -1.03 -1.46 116.57 120.29 3hx7 h LYS 106 Ca 0.16 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 3hx7 h LYS 106 Cb 0.74 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.57 3hx7 h LYS 106 CO -0.00 0.88 0.39 -0.07 -2.27 0.00 0.00 179.45 178.37 3hx7 h LEU 107 N -0.35 1.06 0.55 5.20 3.38 0.44 -1.79 115.31 123.79 3hx7 h LEU 107 Ca -0.02 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3hx7 h LEU 107 Cb 0.94 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3hx7 h LEU 107 CO 0.05 0.90 -0.36 -1.13 0.09 0.00 0.00 178.44 177.99 3hx7 h ASN 108 N 1.16 -0.91 -1.16 -0.43 -1.24 -0.27 -0.40 115.58 112.33 3hx7 h ASN 108 Ca 0.28 0.05 0.33 0.00 0.71 0.00 0.00 56.30 57.67 3hx7 h ASN 108 Cb 0.12 0.27 -0.06 0.00 0.73 0.00 0.00 38.32 39.37 3hx7 h ASN 108 CO -0.04 -0.54 0.81 -0.61 -1.29 0.00 0.00 177.43 175.77 3hx7 h GLN 109 N -0.85 0.11 -0.12 6.67 5.75 -1.14 0.59 115.11 126.11 3hx7 h GLN 109 Ca -0.07 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 58.31 3hx7 h GLN 109 Cb 0.69 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.22 3hx7 h GLN 109 CO 0.06 0.07 -0.34 0.00 -2.65 0.00 0.00 178.83 175.97 3hx7 h ALA 110 N 1.47 0.21 -0.36 3.38 0.00 -0.69 -1.34 119.26 121.94 3hx7 h ALA 110 Ca 0.59 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hx7 h ALA 110 Cb 2.08 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.83 3hx7 h ALA 110 CO -0.11 0.27 0.21 -0.07 0.00 0.00 0.00 179.25 179.55 3hx7 h LEU 111 N 0.04 0.43 -0.69 0.00 3.38 0.17 -1.09 115.31 117.55 3hx7 h LEU 111 Ca -0.01 -0.06 0.06 0.00 0.09 0.00 0.00 57.88 57.96 3hx7 h LEU 111 Cb 0.96 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 3hx7 h LEU 111 CO 0.07 0.36 0.40 -0.07 0.09 0.00 0.00 178.44 179.29 3hx7 h LEU 112 N 0.46 0.60 -0.94 1.67 3.38 -0.64 -0.93 115.31 118.92 3hx7 h LEU 112 Ca 0.13 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 3hx7 h LEU 112 Cb 0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3hx7 h LEU 112 CO -0.02 0.39 -0.08 0.44 0.09 0.00 0.00 178.44 179.26 3hx7 h ASP 113 N 0.74 0.67 -0.04 -0.43 3.45 -0.79 -0.77 116.42 119.25 3hx7 h ASP 113 Ca 0.31 -0.18 -0.11 0.00 0.43 0.00 0.00 57.03 57.48 3hx7 h ASP 113 Cb 0.17 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 3hx7 h ASP 113 CO -0.17 0.79 -0.31 0.25 -1.57 0.00 0.00 179.24 178.23 3hx7 h LEU 114 N 0.64 0.52 -0.03 1.55 5.85 -0.65 -1.44 115.31 121.75 3hx7 h LEU 114 Ca 0.12 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 3hx7 h LEU 114 Cb 0.51 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.40 3hx7 h LEU 114 CO 0.03 0.81 -0.01 -0.74 -0.34 0.00 0.00 178.44 178.19 3hx7 h HIS 115 N 0.44 0.06 -0.81 1.25 2.76 -0.65 0.04 115.15 118.24 3hx7 h HIS 115 Ca 0.05 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.31 3hx7 h HIS 115 Cb 0.76 -0.01 -0.06 0.00 1.55 0.00 0.00 27.41 29.65 3hx7 h HIS 115 CO 0.03 0.41 0.53 0.00 -1.30 0.00 0.00 177.93 177.59 3hx7 h ALA 116 N 0.65 1.77 -0.48 5.26 0.00 -1.03 0.32 119.26 125.74 3hx7 h ALA 116 Ca 0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3hx7 h ALA 116 Cb 0.39 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3hx7 h ALA 116 CO 0.00 0.06 -0.05 1.25 0.00 0.00 0.00 179.25 180.51 3hx7 h LEU 117 N 0.73 0.88 -1.03 0.00 5.85 -0.99 -2.41 115.31 118.34 3hx7 h LEU 117 Ca 0.38 -0.33 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 3hx7 h LEU 117 Cb 0.48 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 3hx7 h LEU 117 CO -0.15 1.00 0.28 1.23 -0.34 0.00 0.00 178.44 180.46 3hx7 h GLY 118 N 0.74 1.04 0.98 3.75 0.00 0.15 -1.57 103.07 108.17 3hx7 h GLY 118 Ca 0.13 -0.53 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 3hx7 h GLY 118 CO 0.03 0.50 -0.44 1.76 0.00 0.00 0.00 176.54 178.40 3hx7 h SER 119 N 0.96 -1.04 -0.74 0.19 0.02 -0.72 0.98 113.55 113.19 3hx7 h SER 119 Ca 0.23 0.03 0.16 0.00 -0.84 0.00 0.00 61.79 61.37 3hx7 h SER 119 Cb 0.16 0.27 -0.14 0.00 0.14 0.00 0.00 62.40 62.83 3hx7 h SER 119 CO -0.02 -0.73 -0.13 0.00 -1.14 0.00 0.00 176.83 174.81 3hx7 h ALA 120 N -1.19 0.57 -0.10 3.77 0.00 -1.22 1.16 119.26 122.25 3hx7 h ALA 120 Ca -0.13 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hx7 h ALA 120 Cb 0.94 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3hx7 h ALA 120 CO 0.21 -0.42 0.00 0.54 0.00 0.00 0.00 179.25 179.58 3hx7 n ARG 121 N -5.45 1.27 -3.72 0.00 5.12 -0.61 -4.92 116.66 108.34 3hx7 n ARG 121 Ca 0.11 -0.41 -0.24 0.00 -1.93 0.00 0.00 57.85 55.38 3hx7 n ARG 121 Cb 0.41 -1.14 0.01 0.00 -1.16 0.00 0.00 32.46 30.57 3hx7 n ARG 121 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3hx7 n THR 122 N -0.21 -4.39 -3.80 0.55 -2.24 0.40 -4.96 114.28 99.62 3hx7 n THR 122 Ca 0.06 -0.19 -0.29 0.00 -2.27 0.00 0.00 64.05 61.37 3hx7 n THR 122 Cb 0.11 -3.51 -0.13 0.00 -2.10 0.00 0.00 70.33 64.70 3hx7 n THR 122 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hx7 s ASP 123 N -3.09 3.93 0.45 3.42 -1.08 0.25 -4.98 116.67 115.57 3hx7 s ASP 123 Ca 0.10 -3.14 0.20 0.00 -0.52 0.00 0.00 52.55 49.19 3hx7 s ASP 123 Cb -0.05 -1.31 1.08 0.00 -1.46 0.00 0.00 42.92 41.19 3hx7 s ASP 123 CO 0.88 -0.19 1.95 1.55 0.52 0.00 0.00 175.17 179.88 3hx7 h PRO 124 N 6.16 0.00 -0.13 4.34 0.13 -1.93 -2.71 132.00 137.85 3hx7 h PRO 124 Ca 0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 3hx7 h PRO 124 Cb 0.86 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 3hx7 h PRO 124 CO 0.59 0.23 0.05 1.25 -0.23 0.00 0.00 178.00 179.89 3hx7 h HIS 125 N 0.00 0.21 -0.36 1.56 2.76 -1.97 0.19 115.15 117.54 3hx7 h HIS 125 Ca -0.00 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 3hx7 h HIS 125 Cb 0.50 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 3hx7 h HIS 125 CO 0.00 0.30 0.20 1.25 -1.30 0.00 0.00 177.93 178.38 3hx7 h LEU 126 N 0.05 0.44 -1.59 0.26 5.85 -1.94 0.26 115.31 118.65 3hx7 h LEU 126 Ca 0.04 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 3hx7 h LEU 126 Cb 0.19 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3hx7 h LEU 126 CO -0.00 0.40 0.12 0.00 -0.34 0.00 0.00 178.44 178.61 3hx7 h ASP 128 N 0.39 -0.06 -0.84 0.00 3.58 0.07 -2.21 116.42 117.35 3hx7 h ASP 128 Ca 0.10 -0.47 0.20 0.00 0.42 0.00 0.00 57.03 57.28 3hx7 h ASP 128 Cb 0.07 0.02 -0.12 0.00 1.72 0.00 0.00 39.33 41.02 3hx7 h ASP 128 CO -0.01 0.46 0.32 0.15 -2.88 0.00 0.00 179.24 177.27 3hx7 h PHE 129 N -0.60 0.52 0.01 0.28 3.04 0.02 0.52 116.94 120.73 3hx7 h PHE 129 Ca -0.01 0.04 -0.20 0.00 3.98 0.00 0.00 57.97 61.78 3hx7 h PHE 129 Cb 0.53 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.93 3hx7 h PHE 129 CO 0.10 -0.05 -0.90 -0.07 -2.02 0.00 0.00 178.31 175.37 3hx7 h LEU 130 N 0.37 0.29 -0.56 0.59 3.38 -1.32 -2.39 115.31 115.67 3hx7 h LEU 130 Ca 0.51 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 58.16 3hx7 h LEU 130 Cb 0.92 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 3hx7 h LEU 130 CO -0.52 1.05 0.06 -0.33 0.09 0.00 0.00 178.44 178.79 3hx7 h GLU 131 N 0.12 0.94 0.46 1.13 5.08 -0.47 0.87 114.58 122.71 3hx7 h GLU 131 Ca -0.05 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.02 3hx7 h GLU 131 Cb 1.53 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.68 3hx7 h GLU 131 CO 0.14 0.92 -0.22 1.15 -1.00 0.00 0.00 179.01 180.00 3hx7 h THR 132 N 0.83 0.05 0.00 1.13 2.02 -1.00 -3.37 112.91 112.57 3hx7 h THR 132 Ca 0.17 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.79 3hx7 h THR 132 Cb 0.45 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 3hx7 h THR 132 CO 0.02 0.01 -0.92 1.41 0.37 0.00 0.00 175.52 176.41 3hx7 n HIS 133 N -5.18 0.45 0.06 3.16 8.25 -0.90 -4.82 115.22 116.24 3hx7 n HIS 133 Ca -0.08 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 3hx7 n HIS 133 Cb 0.25 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 30.78 3hx7 n HIS 133 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3hx7 n PHE 134 N -2.12 -0.27 -0.34 4.41 3.72 -0.86 -4.63 117.46 117.38 3hx7 n PHE 134 Ca 0.02 0.05 0.10 0.00 -0.05 0.00 0.00 57.45 57.56 3hx7 n PHE 134 Cb 0.46 0.07 0.21 0.00 -0.94 0.00 0.00 39.48 39.27 3hx7 n PHE 134 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3hx7 h LEU 135 N 0.00 -0.65 0.03 4.37 3.38 -1.02 -0.35 115.31 121.07 3hx7 h LEU 135 Ca 0.00 0.28 -0.26 0.00 0.09 0.00 0.00 57.88 57.98 3hx7 h LEU 135 Cb 0.07 0.52 0.01 0.00 0.09 0.00 0.00 40.66 41.35 3hx7 h LEU 135 CO 0.00 -0.32 -1.16 -0.78 0.09 0.00 0.00 178.44 176.26 3hx7 h ASP 136 N 0.01 0.51 -0.88 -0.43 -0.00 -1.83 -2.63 116.42 111.18 3hx7 h ASP 136 Ca 0.52 -0.50 0.04 0.00 -0.00 0.00 0.00 57.03 57.09 3hx7 h ASP 136 Cb 0.96 -0.16 -0.05 0.00 -0.00 0.00 0.00 39.33 40.07 3hx7 h ASP 136 CO -0.93 1.35 0.57 -0.33 -0.00 0.00 0.00 179.24 179.90 3hx7 h GLU 137 N 0.14 1.07 0.07 0.28 4.39 -1.42 0.15 114.58 119.26 3hx7 h GLU 137 Ca -0.13 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.50 3hx7 h GLU 137 Cb 1.85 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 30.26 3hx7 h GLU 137 CO 0.20 0.71 -0.03 0.93 -1.16 0.00 0.00 179.01 179.65 3hx7 h GLU 138 N 1.10 -0.09 -0.95 2.33 4.39 -1.15 -2.01 114.58 118.20 3hx7 h GLU 138 Ca 0.36 0.01 0.12 0.00 0.34 0.00 0.00 59.36 60.18 3hx7 h GLU 138 Cb 0.02 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 28.61 3hx7 h GLU 138 CO -0.12 0.23 0.57 0.28 -1.16 0.00 0.00 179.01 178.81 3hx7 h VAL 139 N -0.43 0.88 -0.02 3.13 2.07 -1.09 0.22 116.25 121.02 3hx7 h VAL 139 Ca -0.01 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 3hx7 h VAL 139 Cb 0.37 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.05 3hx7 h VAL 139 CO 0.02 0.16 0.01 0.11 0.02 0.00 0.00 177.57 177.89 3hx7 h LYS 140 N 0.89 0.03 0.10 1.57 1.57 -0.93 -2.48 116.57 117.32 3hx7 h LYS 140 Ca 0.48 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.27 3hx7 h LYS 140 Cb 0.51 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 3hx7 h LYS 140 CO -0.28 0.20 -0.35 1.25 -0.57 0.00 0.00 179.45 179.70 3hx7 h LEU 141 N -0.16 -1.02 -2.49 2.94 5.85 -0.50 0.49 115.31 120.42 3hx7 h LEU 141 Ca 0.01 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.86 3hx7 h LEU 141 Cb 0.19 0.39 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 3hx7 h LEU 141 CO -0.00 -0.43 0.09 0.40 -0.34 0.00 0.00 178.44 178.16 3hx7 h ILE 142 N -0.56 0.34 0.21 4.05 2.04 -1.02 0.11 117.51 122.69 3hx7 h ILE 142 Ca 0.03 0.00 -0.32 0.00 1.00 0.00 0.00 64.86 65.57 3hx7 h ILE 142 Cb 0.61 0.93 0.03 0.00 -0.74 0.00 0.00 36.82 37.64 3hx7 h ILE 142 CO -0.22 0.00 -1.46 0.50 0.00 0.00 0.00 178.15 176.97 3hx7 h LYS 143 N 0.00 0.45 0.03 2.37 1.63 -0.71 -1.94 116.57 118.39 3hx7 h LYS 143 Ca 0.03 -0.77 -0.00 0.00 -0.85 0.00 0.00 60.65 59.06 3hx7 h LYS 143 Cb 0.20 0.29 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 3hx7 h LYS 143 CO -0.00 1.36 -0.01 -0.22 -3.45 0.00 0.00 179.45 177.13 3hx7 h LYS 144 N 0.12 -0.04 0.31 1.90 3.64 0.12 -0.80 116.57 121.82 3hx7 h LYS 144 Ca -0.24 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.13 3hx7 h LYS 144 Cb 2.11 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.94 3hx7 h LYS 144 CO 0.24 0.03 -0.19 0.52 -2.27 0.00 0.00 179.45 177.79 3hx7 h MET 145 N -0.10 -0.46 -1.01 1.90 2.86 -1.01 -0.68 114.93 116.44 3hx7 h MET 145 Ca -0.00 0.03 0.19 0.00 -2.06 0.00 0.00 59.70 57.86 3hx7 h MET 145 Cb 0.09 0.10 -0.11 0.00 0.06 0.00 0.00 31.60 31.75 3hx7 h MET 145 CO 0.01 -0.30 0.61 0.78 1.06 0.00 0.00 176.91 179.07 3hx7 h GLY 146 N -0.47 1.79 0.99 8.32 0.00 -1.23 0.99 103.07 113.47 3hx7 h GLY 146 Ca -0.03 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 3hx7 h GLY 146 CO 0.03 -0.06 -0.00 -0.55 0.00 0.00 0.00 176.54 175.97 3hx7 h ASP 147 N 0.77 -0.00 -0.31 0.19 5.19 0.00 -2.29 116.42 119.97 3hx7 h ASP 147 Ca 0.58 -0.01 0.06 0.00 -0.62 0.00 0.00 57.03 57.04 3hx7 h ASP 147 Cb 0.89 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 40.34 3hx7 h ASP 147 CO -0.38 0.01 -0.09 0.45 -3.12 0.00 0.00 179.24 176.11 3hx7 h HIS 148 N -0.01 -0.19 -0.31 4.55 3.86 0.52 -1.87 115.15 121.70 3hx7 h HIS 148 Ca -0.00 0.03 0.07 0.00 -1.16 0.00 0.00 60.37 59.31 3hx7 h HIS 148 Cb 0.01 0.13 -0.07 0.00 1.06 0.00 0.00 27.41 28.54 3hx7 h HIS 148 CO -0.08 -0.15 -0.20 -0.07 0.86 0.00 0.00 177.93 178.30 3hx7 h LEU 149 N -0.01 -0.65 -1.62 2.43 3.38 -0.62 0.31 115.31 118.54 3hx7 h LEU 149 Ca 0.15 0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.32 3hx7 h LEU 149 Cb 0.24 0.33 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 3hx7 h LEU 149 CO -0.33 -0.23 0.35 0.74 0.09 0.00 0.00 178.44 179.06 3hx7 h THR 150 N -0.16 0.98 0.03 0.22 2.02 -0.84 -0.49 112.91 114.65 3hx7 h THR 150 Ca 0.16 -0.16 -0.27 0.00 0.77 0.00 0.00 66.41 66.91 3hx7 h THR 150 Cb 0.41 0.47 0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3hx7 h THR 150 CO -0.41 0.09 -1.08 0.78 0.37 0.00 0.00 175.52 175.27 3hx7 h ASN 151 N 0.47 0.88 0.52 4.18 2.35 -0.27 -2.88 115.58 120.83 3hx7 h ASN 151 Ca 0.23 -0.73 -0.02 0.00 -0.55 0.00 0.00 56.30 55.23 3hx7 h ASN 151 Cb 0.30 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 3hx7 h ASN 151 CO -0.06 1.53 -0.37 -0.07 -1.65 0.00 0.00 177.43 176.81 3hx7 h LEU 152 N 0.36 -0.95 -1.87 1.61 3.38 0.50 -1.37 115.31 116.97 3hx7 h LEU 152 Ca -0.14 0.06 0.16 0.00 0.09 0.00 0.00 57.88 58.06 3hx7 h LEU 152 Cb 1.74 0.29 -0.02 0.00 0.09 0.00 0.00 40.66 42.76 3hx7 h LEU 152 CO 0.21 -0.55 0.58 -0.74 0.09 0.00 0.00 178.44 178.02 3hx7 h HIS 153 N -0.86 0.00 0.06 1.13 2.76 -1.19 0.57 115.15 117.62 3hx7 h HIS 153 Ca -0.06 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 57.86 3hx7 h HIS 153 Cb 0.72 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.69 3hx7 h HIS 153 CO -0.13 0.00 -1.08 -0.09 -1.30 0.00 0.00 177.93 175.33 3hx7 h ARG 154 N 0.00 0.38 0.00 5.26 2.43 -1.05 -3.19 114.38 118.21 3hx7 h ARG 154 Ca 0.27 -0.48 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 3hx7 h ARG 154 Cb 1.42 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 31.13 3hx7 h ARG 154 CO -0.00 1.17 0.00 1.28 -1.51 0.00 0.00 179.97 180.91 3hx7 n LEU 155 N -3.67 0.37 -4.10 3.80 4.77 0.20 -3.28 117.00 115.09 3hx7 n LEU 155 Ca -0.08 0.65 -0.39 0.00 -0.03 0.00 0.00 56.01 56.17 3hx7 n LEU 155 Cb 0.92 -0.68 -0.04 0.00 -2.33 0.00 0.00 43.42 41.29 3hx7 n LEU 155 CO 0.53 -0.71 0.58 0.61 -1.33 0.00 0.00 177.39 177.06 3hx7 n GLY 156 N -1.08 4.38 0.00 -0.72 0.00 -1.21 -4.84 105.19 101.72 3hx7 n GLY 156 Ca -0.00 -2.62 0.00 0.00 0.00 0.00 0.00 46.02 43.40 3hx7 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hx7 n GLY 157 N 2.11 -0.83 0.26 -0.02 0.00 -1.21 -4.98 105.19 100.53 3hx7 n GLY 157 Ca 0.24 -1.36 -0.01 0.00 0.00 0.00 0.00 46.02 44.88 3hx7 n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hx7 h PRO 158 N 1.53 0.51 -1.04 1.61 0.13 -1.94 -3.12 132.00 129.68 3hx7 h PRO 158 Ca 0.00 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 3hx7 h PRO 158 Cb 0.00 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.07 3hx7 h PRO 158 CO 0.00 0.61 0.00 0.39 -0.23 0.00 0.00 178.00 178.77 3hx7 n GLU 159 N -4.22 0.78 -1.75 0.86 1.02 -1.26 -4.80 120.64 111.27 3hx7 n GLU 159 Ca 0.01 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.92 3hx7 n GLU 159 Cb 0.31 -1.22 -0.05 0.00 -0.02 0.00 0.00 31.44 30.45 3hx7 n GLU 159 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hx7 s ALA 160 N -0.28 1.24 0.00 0.62 0.00 -1.18 -4.73 121.76 117.43 3hx7 s ALA 160 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.09 3hx7 s ALA 160 Cb 0.00 -4.51 0.00 0.00 0.00 0.00 0.00 23.12 18.61 3hx7 s ALA 160 CO 0.00 -5.21 0.00 0.41 0.00 0.00 0.00 175.76 170.96