#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q7m n ASP 2 N 0.00 1.93 -0.29 7.83 8.00 -1.26 -4.83 116.55 127.94 2q7m n ASP 2 Ca 0.00 0.13 0.25 0.00 0.71 0.00 0.00 54.79 55.88 2q7m n ASP 2 Cb 0.00 -1.30 0.47 0.00 -0.02 0.00 0.00 41.12 40.27 2q7m n ASP 2 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2q7m n GLN 3 N 8.49 -0.06 0.22 -1.24 -0.06 -1.26 0.05 117.38 123.53 2q7m n GLN 3 Ca 0.44 1.23 -0.15 0.00 -2.00 0.00 0.00 57.00 56.52 2q7m n GLN 3 Cb 0.29 -2.17 -0.08 0.00 -4.06 0.00 0.00 30.24 24.22 2q7m n GLN 3 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 2q7m h GLU 4 N 0.00 -0.53 -0.01 3.69 4.22 -2.01 -2.91 114.58 117.04 2q7m h GLU 4 Ca 0.71 0.04 0.03 0.00 0.08 0.00 0.00 59.36 60.22 2q7m h GLU 4 Cb 1.82 0.12 -0.05 0.00 0.50 0.00 0.00 28.75 31.14 2q7m h GLU 4 CO -0.71 -0.27 -0.29 1.79 -2.18 0.00 0.00 179.01 177.35 2q7m h THR 5 N -0.71 0.35 -1.11 0.32 1.35 -0.75 -0.77 112.91 111.59 2q7m h THR 5 Ca -0.06 0.00 0.32 0.00 -0.55 0.00 0.00 66.41 66.12 2q7m h THR 5 Cb 0.50 0.35 -0.11 0.00 -1.73 0.00 0.00 68.15 67.16 2q7m h THR 5 CO 0.09 0.00 0.71 0.58 -0.25 0.00 0.00 175.52 176.65 2q7m h VAL 6 N -0.43 0.40 0.06 6.82 2.07 -1.35 0.12 116.25 123.94 2q7m h VAL 6 Ca 0.07 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.50 2q7m h VAL 6 Cb 0.53 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 2q7m h VAL 6 CO -0.26 0.06 -0.17 1.23 0.02 0.00 0.00 177.57 178.45 2q7m h GLY 7 N 0.31 -0.28 -3.07 2.17 0.00 -0.92 -0.29 103.07 100.98 2q7m h GLY 7 Ca 0.67 0.20 -0.13 0.00 0.00 0.00 0.00 47.33 48.06 2q7m h GLY 7 CO -0.35 -0.16 0.17 1.16 0.00 0.00 0.00 176.54 177.35 2q7m n ASN 8 N -5.30 5.39 0.00 0.19 0.23 0.41 -3.16 115.26 113.03 2q7m n ASN 8 Ca -0.06 -2.63 0.00 0.00 -0.53 0.00 0.00 54.58 51.36 2q7m n ASN 8 Cb 0.22 -1.01 0.00 0.00 -2.08 0.00 0.00 39.78 36.90 2q7m n ASN 8 CO 0.00 0.00 0.00 0.55 -0.93 0.00 0.00 177.26 176.88 2q7m n VAL 9 N 0.87 0.00 -0.49 3.53 3.14 -1.10 -4.90 118.33 119.37 2q7m n VAL 9 Ca 0.13 0.00 0.41 0.00 -2.96 0.00 0.00 64.34 61.92 2q7m n VAL 9 Cb 0.57 0.01 0.72 0.00 -1.06 0.00 0.00 33.84 34.08 2q7m n VAL 9 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 2q7m h VAL 10 N 0.00 0.18 -0.03 1.55 2.07 -1.00 0.18 116.25 119.20 2q7m h VAL 10 Ca 0.00 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 2q7m h VAL 10 Cb 0.00 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 2q7m h VAL 10 CO 0.00 0.01 -0.25 -0.07 0.02 0.00 0.00 177.57 177.28 2q7m h LEU 11 N 0.06 0.27 -1.16 2.57 -0.00 -1.87 -0.30 115.31 114.89 2q7m h LEU 11 Ca 0.78 -0.69 -0.02 0.00 -0.00 0.00 0.00 57.88 57.95 2q7m h LEU 11 Cb 2.82 -0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 43.37 2q7m h LEU 11 CO -0.17 0.92 0.33 -0.07 -0.00 0.00 0.00 178.44 179.45 2q7m h LEU 12 N -0.35 0.82 0.23 1.67 3.38 -1.03 0.14 115.31 120.17 2q7m h LEU 12 Ca -0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2q7m h LEU 12 Cb 0.93 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2q7m h LEU 12 CO 0.05 0.69 -0.11 0.00 0.09 0.00 0.00 178.44 179.16 2q7m h ALA 13 N 1.44 -0.31 0.22 1.53 0.00 -0.89 0.77 119.26 122.02 2q7m h ALA 13 Ca 0.23 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2q7m h ALA 13 Cb 0.07 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2q7m h ALA 13 CO -0.03 -0.61 -0.33 0.82 0.00 0.00 0.00 179.25 179.10 2q7m h ILE 14 N -0.44 0.00 -0.83 0.00 5.03 -0.47 0.57 117.51 121.37 2q7m h ILE 14 Ca -0.03 0.00 0.18 0.00 -0.12 0.00 0.00 64.86 64.89 2q7m h ILE 14 Cb 0.33 0.00 -0.11 0.00 -3.03 0.00 0.00 36.82 34.01 2q7m h ILE 14 CO 0.05 0.00 0.33 1.62 -0.68 0.00 0.00 178.15 179.47 2q7m h VAL 15 N -0.57 0.54 0.02 1.67 3.04 -0.79 0.73 116.25 120.89 2q7m h VAL 15 Ca -0.03 -0.14 -0.00 0.00 -1.01 0.00 0.00 66.70 65.53 2q7m h VAL 15 Cb 0.52 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 29.91 2q7m h VAL 15 CO -0.10 0.07 -0.01 0.74 -1.01 0.00 0.00 177.57 177.26 2q7m h THR 16 N 0.40 1.05 0.00 3.17 2.02 -0.13 -0.12 112.91 119.30 2q7m h THR 16 Ca 0.49 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 67.44 2q7m h THR 16 Cb 0.86 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 68.46 2q7m h THR 16 CO -0.49 0.06 -0.05 -0.07 0.37 0.00 0.00 175.52 175.33 2q7m h LEU 17 N -0.12 0.00 0.41 2.58 4.07 0.14 0.28 115.31 122.67 2q7m h LEU 17 Ca -0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 2q7m h LEU 17 Cb 0.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.86 2q7m h LEU 17 CO 0.00 0.05 -0.20 0.40 -1.08 0.00 0.00 178.44 177.62 2q7m h ILE 18 N 0.00 0.00 -0.81 1.22 5.03 -0.20 -2.36 117.51 120.39 2q7m h ILE 18 Ca -0.00 -0.22 0.20 0.00 -0.12 0.00 0.00 64.86 64.72 2q7m h ILE 18 Cb 0.12 0.00 -0.05 0.00 -3.03 0.00 0.00 36.82 33.87 2q7m h ILE 18 CO 0.01 0.00 0.56 0.77 -0.68 0.00 0.00 178.15 178.80 2q7m h SER 19 N -0.77 0.19 -0.46 1.72 4.64 -0.58 0.31 113.55 118.59 2q7m h SER 19 Ca -0.06 0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.21 2q7m h SER 19 Cb 0.42 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 2q7m h SER 19 CO 0.09 0.08 0.03 1.62 -0.87 0.00 0.00 176.83 177.78 2q7m h VAL 20 N 0.19 1.25 0.06 0.95 3.04 -0.37 -0.37 116.25 121.00 2q7m h VAL 20 Ca 0.40 -1.00 -0.21 0.00 -1.01 0.00 0.00 66.70 64.87 2q7m h VAL 20 Cb 1.27 0.82 0.02 0.00 -2.01 0.00 0.00 31.29 31.39 2q7m h VAL 20 CO -0.08 0.36 -0.86 0.58 -1.01 0.00 0.00 177.57 176.56 2q7m h VAL 21 N 0.81 1.39 -0.36 1.51 2.07 0.05 -2.79 116.25 118.93 2q7m h VAL 21 Ca 0.16 -2.30 -0.01 0.00 0.82 0.00 0.00 66.70 65.37 2q7m h VAL 21 Cb 0.44 2.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.94 2q7m h VAL 21 CO 0.02 0.68 0.17 0.06 0.02 0.00 0.00 177.57 178.52 2q7m h GLN 22 N -0.02 0.49 0.17 1.57 3.07 -0.90 -2.43 115.11 117.06 2q7m h GLN 22 Ca -0.13 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 58.56 2q7m h GLN 22 Cb 1.58 -0.10 -0.00 0.00 0.08 0.00 0.00 27.48 29.04 2q7m h GLN 22 CO 0.17 0.39 -0.10 -0.91 0.09 0.00 0.00 178.83 178.46 2q7m h ASN 23 N 0.50 -0.25 -0.01 0.06 4.21 -1.00 -1.09 115.58 118.00 2q7m h ASN 23 Ca 0.13 0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.65 2q7m h ASN 23 Cb 0.05 0.07 -0.00 0.00 -1.12 0.00 0.00 38.32 37.33 2q7m h ASN 23 CO -0.02 -0.17 0.14 1.23 -1.29 0.00 0.00 177.43 177.32 2q7m h GLY 24 N -0.26 0.00 0.23 2.83 0.00 -1.17 -0.98 103.07 103.72 2q7m h GLY 24 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2q7m h GLY 24 CO 0.02 0.00 -0.06 -2.75 0.00 0.00 0.00 176.54 173.75 2q7m h PHE 25 N 0.00 -0.15 -0.94 5.60 3.57 -0.90 -2.76 116.94 121.36 2q7m h PHE 25 Ca 0.00 -0.00 0.22 0.00 3.53 0.00 0.00 57.97 61.72 2q7m h PHE 25 Cb 0.27 0.05 -0.12 0.00 2.79 0.00 0.00 35.95 38.95 2q7m h PHE 25 CO 0.00 0.27 0.49 0.74 -2.23 0.00 0.00 178.31 177.58 2q7m h PHE 26 N -0.94 0.84 -0.01 0.41 -1.00 -0.49 0.78 116.94 116.53 2q7m h PHE 26 Ca -0.02 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.80 2q7m h PHE 26 Cb 0.49 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 39.82 2q7m h PHE 26 CO 0.09 0.05 0.00 0.00 -1.61 0.00 0.00 178.31 176.84 2q7m n ALA 27 N -2.40 2.61 -0.11 2.45 0.00 -0.67 -2.94 120.51 119.45 2q7m n ALA 27 Ca 0.23 -0.16 -0.15 0.00 0.00 0.00 0.00 53.44 53.36 2q7m n ALA 27 Cb 0.65 -1.32 -0.10 0.00 0.00 0.00 0.00 19.45 18.69 2q7m n ALA 27 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2q7m n HIS 28 N -0.74 0.00 0.59 0.00 -0.00 0.26 -3.94 115.22 111.39 2q7m n HIS 28 Ca 0.15 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.94 2q7m n HIS 28 Cb 0.09 -0.82 0.33 0.00 -0.00 0.00 0.00 29.99 29.59 2q7m n HIS 28 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2q7m n LYS 29 N -3.18 0.13 0.05 1.57 4.01 -0.27 -0.46 118.16 120.01 2q7m n LYS 29 Ca -0.38 0.19 0.11 0.00 -0.51 0.00 0.00 58.31 57.72 2q7m n LYS 29 Cb 0.90 -1.50 -0.08 0.00 -0.51 0.00 0.00 35.03 33.84 2q7m n LYS 29 CO 0.00 0.00 0.00 1.55 -1.11 0.00 0.00 177.40 177.84 2q7m n VAL 30 N -1.35 0.31 0.10 -0.18 3.14 -1.15 -3.76 118.33 115.44 2q7m n VAL 30 Ca 0.05 -0.52 -0.16 0.00 -2.96 0.00 0.00 64.34 60.76 2q7m n VAL 30 Cb 0.12 -0.16 -0.14 0.00 -1.06 0.00 0.00 33.84 32.60 2q7m n VAL 30 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 2q7m h GLU 31 N 0.00 0.26 -0.90 1.45 4.57 -0.89 -2.88 114.58 116.19 2q7m h GLU 31 Ca 0.00 -0.45 0.01 0.00 -1.18 0.00 0.00 59.36 57.74 2q7m h GLU 31 Cb 0.99 0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 29.70 2q7m h GLU 31 CO 0.00 1.20 0.60 0.45 -1.18 0.00 0.00 179.01 180.08 2q7m h HIS 32 N 0.07 1.13 0.00 0.92 3.86 -1.56 -1.61 115.15 117.96 2q7m h HIS 32 Ca -0.14 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 58.96 2q7m h HIS 32 Cb 1.97 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 30.04 2q7m h HIS 32 CO 0.06 0.71 -0.61 0.93 0.86 0.00 0.00 177.93 179.88 2q7m h GLU 33 N 1.22 0.00 -0.00 2.45 3.07 -1.65 -2.04 114.58 117.64 2q7m h GLU 33 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 2q7m h GLU 33 Cb -0.14 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.77 2q7m h GLU 33 CO -0.07 0.61 -0.27 0.45 -1.40 0.00 0.00 179.01 178.33 2q7m n SER 34 N -3.57 0.61 -0.12 1.42 2.88 -1.05 -3.11 113.62 110.68 2q7m n SER 34 Ca -0.00 -0.46 -0.26 0.00 -1.33 0.00 0.00 58.87 56.82 2q7m n SER 34 Cb 0.66 0.05 -0.10 0.00 -0.75 0.00 0.00 64.21 64.07 2q7m n SER 34 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2q7m n ARG 35 N -1.09 0.58 0.21 -1.46 3.00 -0.63 -4.01 116.66 113.25 2q7m n ARG 35 Ca 0.10 0.41 0.06 0.00 -0.01 0.00 0.00 57.85 58.41 2q7m n ARG 35 Cb 0.32 -1.61 0.44 0.00 0.00 0.00 0.00 32.46 31.62 2q7m n ARG 35 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 2q7m h THR 36 N -1.00 0.98 0.00 0.55 1.35 -1.52 -2.78 112.91 110.49 2q7m h THR 36 Ca -0.53 -1.16 -0.17 0.00 -0.55 0.00 0.00 66.41 64.00 2q7m h THR 36 Cb 1.45 1.67 -0.06 0.00 -1.73 0.00 0.00 68.15 69.48 2q7m h THR 36 CO -0.32 0.30 -0.34 0.00 -0.25 0.00 0.00 175.52 174.91 2q7m n GLN 37 N -3.82 1.89 0.00 4.72 3.00 -1.18 -4.84 117.38 117.15 2q7m n GLN 37 Ca -0.01 -0.92 0.00 0.00 -0.01 0.00 0.00 57.00 56.06 2q7m n GLN 37 Cb 0.39 -1.93 0.00 0.00 0.00 0.00 0.00 30.24 28.70 2q7m n GLN 37 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2q7m n ASN 38 N 2.46 0.00 -4.90 1.08 3.02 -1.05 -4.82 115.26 111.05 2q7m n ASN 38 Ca 0.39 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.65 2q7m n ASN 38 Cb 0.87 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 40.00 2q7m n ASN 38 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2q7m s GLY 39 N 0.00 2.05 0.00 7.41 0.00 -1.26 -5.05 107.32 110.48 2q7m s GLY 39 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 44.72 44.15 2q7m s GLY 39 CO 0.00 -0.48 0.01 0.54 0.00 0.00 0.00 173.10 173.17 2q7m n ARG 40 N -0.38 0.00 0.00 2.90 5.12 -1.26 -4.90 116.66 118.13 2q7m n ARG 40 Ca -0.02 0.31 0.00 0.00 -1.93 0.00 0.00 57.85 56.21 2q7m n ARG 40 Cb 0.53 -0.82 0.00 0.00 -1.16 0.00 0.00 32.46 31.01 2q7m n ARG 40 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2q7m n SER 41 N -1.43 0.00 0.00 0.55 3.41 -1.26 -5.10 113.62 109.79 2q7m n SER 41 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2q7m n SER 41 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2q7m n SER 41 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2q7m n PHE 42 N 0.00 0.00 -3.50 7.33 7.35 -1.26 -5.10 117.46 122.28 2q7m n PHE 42 Ca 0.00 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.49 2q7m n PHE 42 Cb 0.00 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.81 2q7m n PHE 42 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2q7m s GLN 43 N 0.00 2.70 0.00 -4.13 -0.21 -1.26 -5.01 119.66 111.75 2q7m s GLN 43 Ca 0.00 -1.36 0.30 0.00 0.02 0.00 0.00 55.36 54.31 2q7m s GLN 43 Cb 0.00 -2.53 1.45 0.00 1.00 0.00 0.00 33.01 32.94 2q7m s GLN 43 CO 0.00 -0.12 2.00 -2.13 -2.12 0.00 0.00 175.29 172.93 2q7m n ARG 44 N -1.58 0.56 -4.15 2.91 0.63 -1.26 -4.84 116.66 108.94 2q7m n ARG 44 Ca 0.03 -0.08 -0.16 0.00 -0.92 0.00 0.00 57.85 56.72 2q7m n ARG 44 Cb 0.60 -1.50 -0.12 0.00 0.45 0.00 0.00 32.46 31.90 2q7m n ARG 44 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2q7m s THR 45 N -2.49 0.86 0.00 5.15 2.01 -1.26 -4.79 115.64 115.12 2q7m s THR 45 Ca 0.30 -1.15 0.00 0.00 0.31 0.00 0.00 61.69 61.15 2q7m s THR 45 Cb 0.20 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.86 2q7m s THR 45 CO 0.46 -0.25 0.00 0.61 -0.69 0.00 0.00 174.62 174.75 2q7m n GLY 46 N 1.47 -0.03 0.00 4.40 0.00 -1.26 -5.06 105.19 104.71 2q7m n GLY 46 Ca -0.21 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2q7m n GLY 46 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2q7m n THR 47 N 0.00 0.00 0.52 2.61 -1.04 -1.26 -4.75 114.28 110.36 2q7m n THR 47 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.07 2q7m n THR 47 Cb 0.00 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.50 2q7m n THR 47 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2q7m n LEU 48 N 0.00 1.21 -0.01 -4.42 7.99 -1.26 -3.14 117.00 117.37 2q7m n LEU 48 Ca 0.00 -0.73 -0.20 0.00 -0.01 0.00 0.00 56.01 55.08 2q7m n LEU 48 Cb 0.00 0.00 -0.14 0.00 -0.11 0.00 0.00 43.42 43.17 2q7m n LEU 48 CO 0.00 0.24 -0.84 0.00 -1.51 0.00 0.00 177.39 175.28 2q7m n ALA 49 N -0.37 1.00 0.04 -1.18 0.00 -1.26 -2.66 120.51 116.08 2q7m n ALA 49 Ca 0.04 -0.66 -0.04 0.00 0.00 0.00 0.00 53.44 52.79 2q7m n ALA 49 Cb 0.24 -0.64 -0.09 0.00 0.00 0.00 0.00 19.45 18.96 2q7m n ALA 49 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2q7m h PHE 50 N 0.06 0.00 0.00 0.00 3.57 -1.85 -2.59 116.94 116.13 2q7m h PHE 50 Ca -0.43 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2q7m h PHE 50 Cb 2.02 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.76 2q7m h PHE 50 CO 0.07 0.78 -0.30 0.93 -2.23 0.00 0.00 178.31 177.55 2q7m h GLU 51 N 0.00 0.00 0.00 1.11 5.08 -1.71 -1.79 114.58 117.26 2q7m h GLU 51 Ca -0.14 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.07 2q7m h GLU 51 Cb 1.72 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.94 2q7m h GLU 51 CO 0.08 0.00 -0.92 0.00 -1.00 0.00 0.00 179.01 177.16 2q7m h ARG 52 N 0.00 0.00 0.00 2.33 3.08 -1.53 -3.12 114.38 115.15 2q7m h ARG 52 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2q7m h ARG 52 Cb 0.98 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 2q7m h ARG 52 CO 0.00 0.50 -0.50 0.28 -1.07 0.00 0.00 179.97 179.18 2q7m h VAL 53 N 0.00 1.13 -0.17 2.04 2.07 -1.46 -2.73 116.25 117.13 2q7m h VAL 53 Ca -0.07 -2.02 0.05 0.00 0.82 0.00 0.00 66.70 65.48 2q7m h VAL 53 Cb 1.53 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 33.60 2q7m h VAL 53 CO 0.07 0.38 0.15 0.22 0.02 0.00 0.00 177.57 178.41 2q7m h TYR 54 N -1.00 0.00 0.42 1.57 3.20 -1.49 0.78 116.97 120.45 2q7m h TYR 54 Ca -0.13 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.72 2q7m h TYR 54 Cb 0.96 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.23 2q7m h TYR 54 CO 0.14 0.00 -0.20 0.00 -1.64 0.00 0.00 178.16 176.46 2q7m h THR 55 N 0.00 0.00 -0.89 1.81 1.03 -1.64 -1.05 112.91 112.17 2q7m h THR 55 Ca 0.08 -0.51 0.23 0.00 -0.01 0.00 0.00 66.41 66.20 2q7m h THR 55 Cb 0.39 0.00 -0.13 0.00 -1.07 0.00 0.00 68.15 67.34 2q7m h THR 55 CO -0.00 0.00 0.37 0.00 -0.01 0.00 0.00 175.52 175.88 2q7m h ALA 56 N -1.23 1.42 0.66 0.00 0.00 -1.05 -1.42 119.26 117.64 2q7m h ALA 56 Ca -0.06 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2q7m h ALA 56 Cb 0.43 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.40 2q7m h ALA 56 CO 0.09 -0.38 -0.32 -0.97 0.00 0.00 0.00 179.25 177.68 2q7m h ASN 57 N 0.36 -0.75 0.00 0.00 -0.00 -0.93 -3.02 115.58 111.23 2q7m h ASN 57 Ca 0.56 0.03 0.00 0.00 -0.00 0.00 0.00 56.30 56.89 2q7m h ASN 57 Cb 1.09 0.19 0.00 0.00 -0.00 0.00 0.00 38.32 39.61 2q7m h ASN 57 CO -0.55 -0.41 0.00 1.67 -0.00 0.00 0.00 177.43 178.14 2q7m n GLN 58 N -5.10 0.32 0.00 6.67 -0.06 -0.40 0.24 117.38 119.05 2q7m n GLN 58 Ca -0.11 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.89 2q7m n GLN 58 Cb 0.35 -1.27 0.00 0.00 -4.06 0.00 0.00 30.24 25.26 2q7m n GLN 58 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 2q7m n ASN 59 N 0.63 4.54 -0.01 1.69 3.02 -0.96 -4.47 115.26 119.71 2q7m n ASN 59 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.51 2q7m n ASN 59 Cb 0.13 0.77 -0.12 0.00 -0.61 0.00 0.00 39.78 39.95 2q7m n ASN 59 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2q7m h VAL 61 N 0.00 0.28 0.00 0.00 2.07 -1.48 -0.95 116.25 116.18 2q7m h VAL 61 Ca -0.25 -0.92 -0.16 0.00 0.82 0.00 0.00 66.70 66.19 2q7m h VAL 61 Cb 1.82 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 2q7m h VAL 61 CO 0.06 0.12 -0.80 0.44 0.02 0.00 0.00 177.57 177.40 2q7m h ASP 62 N 0.00 0.00 0.73 0.57 3.32 -1.78 -3.33 116.42 115.93 2q7m h ASP 62 Ca -0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 2q7m h ASP 62 Cb 0.72 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.23 2q7m h ASP 62 CO 0.02 0.75 -1.38 0.00 -1.72 0.00 0.00 179.24 176.91 2q7m h ALA 63 N 1.25 0.60 -0.33 3.45 0.00 -1.46 -3.40 119.26 119.36 2q7m h ALA 63 Ca -0.02 -1.19 0.06 0.00 0.00 0.00 0.00 54.91 53.76 2q7m h ALA 63 Cb 1.59 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 19.50 2q7m h ALA 63 CO 0.10 1.40 -0.41 -0.92 0.00 0.00 0.00 179.25 179.41 2q7m h TYR 64 N 0.00 -1.19 0.56 0.00 3.20 -1.31 -1.89 116.97 116.34 2q7m h TYR 64 Ca -0.16 0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 2q7m h TYR 64 Cb 1.88 0.57 -0.01 0.00 1.54 0.00 0.00 36.73 40.70 2q7m h TYR 64 CO 0.00 -0.44 -0.46 -1.00 -1.64 0.00 0.00 178.16 174.62 2q7m h PRO 65 N -0.36 -0.95 0.00 1.82 0.13 -1.79 0.15 132.00 130.99 2q7m h PRO 65 Ca 0.12 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2q7m h PRO 65 Cb 0.59 0.22 0.00 0.00 0.13 0.00 0.00 31.00 31.93 2q7m h PRO 65 CO -0.52 -0.64 0.03 0.25 -0.23 0.00 0.00 178.00 176.89 2q7m n THR 66 N -5.24 1.27 -0.13 1.56 -2.24 -1.19 -0.96 114.28 107.35 2q7m n THR 66 Ca -0.12 0.67 -0.27 0.00 -2.27 0.00 0.00 64.05 62.06 2q7m n THR 66 Cb 0.44 -1.67 -0.11 0.00 -2.10 0.00 0.00 70.33 66.89 2q7m n THR 66 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2q7m n PHE 67 N -2.00 0.41 -0.31 4.78 7.35 -0.72 -4.06 117.46 122.91 2q7m n PHE 67 Ca -0.01 0.18 0.21 0.00 -0.76 0.00 0.00 57.45 57.07 2q7m n PHE 67 Cb 0.05 -1.04 0.50 0.00 0.35 0.00 0.00 39.48 39.34 2q7m n PHE 67 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 2q7m h LEU 68 N -0.99 0.46 0.00 -2.13 5.85 -0.03 0.26 115.31 118.72 2q7m h LEU 68 Ca -0.57 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.23 2q7m h LEU 68 Cb 1.50 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.52 2q7m h LEU 68 CO -0.34 0.12 0.00 0.00 -0.34 0.00 0.00 178.44 177.88 2q7m n ALA 69 N -2.48 -0.09 0.18 1.25 0.00 -0.14 -2.39 120.51 116.85 2q7m n ALA 69 Ca 0.24 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.79 2q7m n ALA 69 Cb 0.81 0.14 0.58 0.00 0.00 0.00 0.00 19.45 20.98 2q7m n ALA 69 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2q7m n VAL 70 N -1.22 1.03 -0.08 0.00 0.24 -0.90 -1.70 118.33 115.71 2q7m n VAL 70 Ca 0.00 0.70 -0.08 0.00 -2.04 0.00 0.00 64.34 62.92 2q7m n VAL 70 Cb 0.00 -1.69 0.08 0.00 -1.47 0.00 0.00 33.84 30.76 2q7m n VAL 70 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 2q7m h LEU 71 N 0.00 0.77 0.03 1.34 7.12 -0.59 -2.13 115.31 121.85 2q7m h LEU 71 Ca 0.00 -0.29 -0.36 0.00 0.13 0.00 0.00 57.88 57.36 2q7m h LEU 71 Cb 0.03 -0.21 -0.05 0.00 -0.53 0.00 0.00 40.66 39.90 2q7m h LEU 71 CO 0.00 1.00 -2.02 0.79 -0.13 0.00 0.00 178.44 178.08 2q7m n TRP 72 N -4.10 0.59 -0.14 1.25 7.02 -0.71 -2.95 117.44 118.40 2q7m n TRP 72 Ca -0.00 0.20 0.18 0.00 -1.02 0.00 0.00 57.50 56.85 2q7m n TRP 72 Cb 0.45 -1.07 0.57 0.00 -2.42 0.00 0.00 31.31 28.84 2q7m n TRP 72 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2q7m h SER 73 N -0.59 0.27 -0.05 -0.99 4.64 -1.45 2.75 113.55 118.14 2q7m h SER 73 Ca -0.51 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2q7m h SER 73 Cb 1.66 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 2q7m h SER 73 CO -0.19 0.13 0.00 0.00 -0.87 0.00 0.00 176.83 175.90 2q7m n ALA 74 N -2.56 2.55 -0.10 5.18 0.00 -0.80 -1.73 120.51 123.05 2q7m n ALA 74 Ca 0.15 -0.51 -0.11 0.00 0.00 0.00 0.00 53.44 52.97 2q7m n ALA 74 Cb 0.61 -1.10 -0.16 0.00 0.00 0.00 0.00 19.45 18.81 2q7m n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q7m n GLY 75 N 1.20 -0.95 0.18 0.00 0.00 0.88 -4.11 105.19 102.39 2q7m n GLY 75 Ca 0.18 -0.31 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 2q7m n GLY 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2q7m n LEU 76 N -2.81 1.85 0.00 0.99 7.99 0.15 -3.35 117.00 121.82 2q7m n LEU 76 Ca -0.33 0.32 0.00 0.00 -0.01 0.00 0.00 56.01 55.99 2q7m n LEU 76 Cb 1.14 -0.76 0.02 0.00 -0.11 0.00 0.00 43.42 43.71 2q7m n LEU 76 CO 0.42 0.40 0.19 0.18 -1.51 0.00 0.00 177.39 177.07 2q7m n LEU 77 N -4.21 0.00 0.00 2.23 4.32 -0.71 -4.62 117.00 114.01 2q7m n LEU 77 Ca -0.45 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.54 2q7m n LEU 77 Cb 0.80 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.60 2q7m n LEU 77 CO 0.06 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.23 2q7m n SER 79 N 0.00 0.00 0.00 0.00 2.88 -1.26 -3.67 113.62 111.57 2q7m n SER 79 Ca 0.00 0.28 0.12 0.00 -1.33 0.00 0.00 58.87 57.93 2q7m n SER 79 Cb 0.00 -0.41 0.58 0.00 -0.75 0.00 0.00 64.21 63.63 2q7m n SER 79 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2q7m n GLN 80 N 1.46 0.29 -0.05 -1.46 7.27 -1.21 -3.18 117.38 120.50 2q7m n GLN 80 Ca 0.00 0.07 -0.03 0.00 0.07 0.00 0.00 57.00 57.11 2q7m n GLN 80 Cb 0.00 -1.50 -0.01 0.00 2.41 0.00 0.00 30.24 31.14 2q7m n GLN 80 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2q7m h VAL 81 N 0.00 0.00 -0.76 1.69 2.07 -1.88 -3.17 116.25 114.20 2q7m h VAL 81 Ca 0.00 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2q7m h VAL 81 Cb 0.24 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.98 2q7m h VAL 81 CO 0.00 0.00 0.45 1.55 0.02 0.00 0.00 177.57 179.59 2q7m h PRO 82 N -0.79 1.03 -0.44 1.57 0.13 -1.93 0.29 132.00 131.86 2q7m h PRO 82 Ca 0.00 -0.10 0.09 0.00 -0.87 0.00 0.00 66.00 65.12 2q7m h PRO 82 Cb 0.34 -0.21 -0.09 0.00 0.13 0.00 0.00 31.00 31.17 2q7m h PRO 82 CO 0.00 0.73 -0.12 0.00 -0.23 0.00 0.00 178.00 178.38 2q7m h ALA 83 N 1.24 0.27 -0.04 -0.56 0.00 -1.76 0.38 119.26 118.80 2q7m h ALA 83 Ca 0.27 0.17 -0.11 0.00 0.00 0.00 0.00 54.91 55.24 2q7m h ALA 83 Cb -0.03 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2q7m h ALA 83 CO -0.05 -0.46 -0.49 0.00 0.00 0.00 0.00 179.25 178.25 2q7m h ALA 84 N 1.41 1.12 0.08 0.00 0.00 -1.36 -2.01 119.26 118.50 2q7m h ALA 84 Ca 0.21 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2q7m h ALA 84 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2q7m h ALA 84 CO -0.46 0.63 -0.04 0.35 0.00 0.00 0.00 179.25 179.73 2q7m h PHE 85 N 0.07 -0.09 -0.87 0.00 3.04 0.39 -2.55 116.94 116.93 2q7m h PHE 85 Ca 0.00 -0.00 0.21 0.00 3.98 0.00 0.00 57.97 62.16 2q7m h PHE 85 Cb 0.89 0.03 -0.13 0.00 2.56 0.00 0.00 35.95 39.30 2q7m h PHE 85 CO 0.01 0.47 0.32 0.00 -2.02 0.00 0.00 178.31 177.09 2q7m h ALA 86 N -0.12 1.33 0.00 2.41 0.00 -0.32 1.48 119.26 124.04 2q7m h ALA 86 Ca -0.01 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2q7m h ALA 86 Cb 0.61 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2q7m h ALA 86 CO 0.02 -0.37 -0.10 0.78 0.00 0.00 0.00 179.25 179.58 2q7m h GLY 87 N 0.33 0.00 1.06 0.00 0.00 -1.38 -1.96 103.07 101.11 2q7m h GLY 87 Ca 0.54 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.65 2q7m h GLY 87 CO -0.56 0.00 -0.79 -2.00 0.00 0.00 0.00 176.54 173.19 2q7m h LEU 88 N 0.00 0.80 -0.81 3.11 7.12 0.25 -3.05 115.31 122.73 2q7m h LEU 88 Ca -0.00 -0.70 -0.01 0.00 0.13 0.00 0.00 57.88 57.30 2q7m h LEU 88 Cb 0.31 -0.24 -0.04 0.00 -0.53 0.00 0.00 40.66 40.16 2q7m h LEU 88 CO 0.01 1.38 0.47 0.24 -0.13 0.00 0.00 178.44 180.41 2q7m h MET 89 N 0.29 1.12 -0.75 1.25 0.00 -0.58 -0.65 114.93 115.61 2q7m h MET 89 Ca -0.08 -0.11 0.16 0.00 0.00 0.00 0.00 59.70 59.67 2q7m h MET 89 Cb 1.45 -0.23 -0.05 0.00 0.00 0.00 0.00 31.60 32.77 2q7m h MET 89 CO 0.16 0.80 0.51 -0.92 0.00 0.00 0.00 176.91 177.46 2q7m h TYR 90 N 1.12 0.38 0.00 -0.22 3.20 -1.32 1.25 116.97 121.38 2q7m h TYR 90 Ca 0.29 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.17 2q7m h TYR 90 Cb -0.01 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.14 2q7m h TYR 90 CO -0.00 0.14 0.00 1.28 -1.64 0.00 0.00 178.16 177.94 2q7m n LEU 91 N -4.45 0.64 0.05 2.82 4.32 -0.27 -1.46 117.00 118.65 2q7m n LEU 91 Ca 0.15 0.58 -0.22 0.00 -0.02 0.00 0.00 56.01 56.50 2q7m n LEU 91 Cb 0.60 -0.41 -0.15 0.00 -1.62 0.00 0.00 43.42 41.84 2q7m n LEU 91 CO 0.34 -0.24 -0.63 -0.26 -1.22 0.00 0.00 177.39 175.38 2q7m h PHE 92 N 0.00 0.61 -0.52 -1.77 -1.00 0.17 -2.88 116.94 111.55 2q7m h PHE 92 Ca 0.00 -0.45 -0.05 0.00 2.81 0.00 0.00 57.97 60.28 2q7m h PHE 92 Cb 0.60 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.12 2q7m h PHE 92 CO 0.00 1.70 0.15 0.28 -1.61 0.00 0.00 178.31 178.82 2q7m h VAL 93 N 0.09 1.24 -0.94 -0.55 2.07 -0.66 -1.14 116.25 116.36 2q7m h VAL 93 Ca -0.37 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 66.38 2q7m h VAL 93 Cb 2.07 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 2q7m h VAL 93 CO 0.14 0.30 0.61 0.03 0.02 0.00 0.00 177.57 178.68 2q7m h ARG 94 N 0.73 1.10 0.29 1.57 2.47 -1.36 0.40 114.38 119.57 2q7m h ARG 94 Ca 0.17 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.81 2q7m h ARG 94 Cb 0.31 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 28.38 2q7m h ARG 94 CO -0.00 0.73 -0.14 0.37 0.56 0.00 0.00 179.97 181.49 2q7m h GLN 95 N 1.13 -0.37 0.00 0.04 5.75 -1.22 -0.71 115.11 119.73 2q7m h GLN 95 Ca 0.39 0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.91 2q7m h GLN 95 Cb 0.10 0.09 0.00 0.00 1.07 0.00 0.00 27.48 28.73 2q7m h GLN 95 CO -0.13 -0.09 0.00 0.87 -2.65 0.00 0.00 178.83 176.82 2q7m h LYS 96 N -0.64 0.00 0.08 1.69 6.56 -0.73 -0.62 116.57 122.90 2q7m h LYS 96 Ca -0.04 0.00 -0.33 0.00 -1.06 0.00 0.00 60.65 59.22 2q7m h LYS 96 Cb 0.46 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.09 2q7m h LYS 96 CO 0.07 0.00 -1.81 0.98 -2.06 0.00 0.00 179.45 176.62 2q7m n TYR 97 N -2.75 1.08 0.36 -1.35 9.36 0.13 -2.99 117.16 121.01 2q7m n TYR 97 Ca 0.01 0.30 0.11 0.00 3.32 0.00 0.00 57.90 61.64 2q7m n TYR 97 Cb 0.26 -1.13 0.49 0.00 -0.63 0.00 0.00 39.34 38.33 2q7m n TYR 97 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2q7m n PHE 98 N -3.80 0.75 -0.10 2.98 7.35 -0.28 -1.92 117.46 122.44 2q7m n PHE 98 Ca -0.34 0.31 -0.21 0.00 -0.76 0.00 0.00 57.45 56.45 2q7m n PHE 98 Cb 0.92 -0.99 -0.11 0.00 0.35 0.00 0.00 39.48 39.65 2q7m n PHE 98 CO 0.00 0.00 0.00 -0.24 -0.76 0.00 0.00 176.76 175.76 2q7m h VAL 99 N 0.00 0.87 0.00 -2.13 3.04 -1.23 -3.37 116.25 113.44 2q7m h VAL 99 Ca 0.00 -2.12 -0.00 0.00 -1.01 0.00 0.00 66.70 63.57 2q7m h VAL 99 Cb 0.30 2.11 -0.00 0.00 -2.01 0.00 0.00 31.29 31.69 2q7m h VAL 99 CO 0.00 0.30 -0.01 1.23 -1.01 0.00 0.00 177.57 178.08 2q7m h GLY 100 N -1.00 0.00 -7.65 3.17 0.00 -1.43 -3.34 103.07 92.81 2q7m h GLY 100 Ca -0.33 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.32 2q7m h GLY 100 CO -0.20 0.00 2.27 2.98 0.00 0.00 0.00 176.54 181.59 2q7m n TYR 101 N -3.13 4.56 0.00 5.60 9.36 -0.81 -3.91 117.16 128.82 2q7m n TYR 101 Ca -0.01 -2.88 0.00 0.00 3.32 0.00 0.00 57.90 58.33 2q7m n TYR 101 Cb 0.18 -2.61 0.00 0.00 -0.63 0.00 0.00 39.34 36.29 2q7m n TYR 101 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 2q7m n LEU 102 N 8.01 0.00 0.22 2.98 -0.00 -1.26 -4.64 117.00 122.31 2q7m n LEU 102 Ca 0.49 0.00 -0.15 0.00 -0.00 0.00 0.00 56.01 56.35 2q7m n LEU 102 Cb 0.45 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.80 2q7m n LEU 102 CO 0.78 0.00 0.69 1.23 -0.00 0.00 0.00 177.39 180.09 2q7m h GLY 103 N 0.00 -0.64 1.41 1.47 0.00 -1.69 -3.29 103.07 100.32 2q7m h GLY 103 Ca 0.00 0.29 -0.31 0.00 0.00 0.00 0.00 47.33 47.32 2q7m h GLY 103 CO 0.00 -0.25 -1.40 -2.09 0.00 0.00 0.00 176.54 172.80 2q7m h GLU 104 N -0.61 0.38 -5.92 4.80 4.22 -1.85 -3.47 114.58 112.13 2q7m h GLU 104 Ca -0.03 -0.66 -0.41 0.00 0.08 0.00 0.00 59.36 58.34 2q7m h GLU 104 Cb 0.53 0.24 -0.14 0.00 0.50 0.00 0.00 28.75 29.88 2q7m h GLU 104 CO -0.00 1.30 -0.61 2.89 -2.18 0.00 0.00 179.01 180.41 2q7m n ARG 105 N -3.60 -2.96 -4.13 1.92 1.85 -1.24 -4.92 116.66 103.58 2q7m n ARG 105 Ca -0.14 0.36 -0.35 0.00 -1.00 0.00 0.00 57.85 56.73 2q7m n ARG 105 Cb 1.06 -5.04 -0.13 0.00 -1.05 0.00 0.00 32.46 27.31 2q7m n ARG 105 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2q7m s THR 106 N -2.96 3.89 -0.58 8.89 2.01 -1.26 -5.03 115.64 120.59 2q7m s THR 106 Ca 0.50 -0.34 -0.29 0.00 0.31 0.00 0.00 61.69 61.87 2q7m s THR 106 Cb -0.27 -2.75 -0.12 0.00 0.01 0.00 0.00 72.50 69.37 2q7m s THR 106 CO 0.61 0.44 2.44 1.67 -0.69 0.00 0.00 174.62 179.10 2q7m n GLN 107 N 4.14 0.83 0.00 4.92 0.00 -1.26 -2.17 117.38 123.83 2q7m n GLN 107 Ca -0.17 0.07 0.00 0.00 -0.00 0.00 0.00 57.00 56.90 2q7m n GLN 107 Cb 0.52 -2.77 0.00 0.00 0.00 0.00 0.00 30.24 27.99 2q7m n GLN 107 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2q7m n SER 108 N 13.31 0.00 -0.08 1.69 3.41 -1.26 -5.03 113.62 125.67 2q7m n SER 108 Ca 0.45 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.85 2q7m n SER 108 Cb 0.36 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.18 2q7m n SER 108 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2q7m h THR 109 N 0.00 0.93 -1.77 6.66 2.02 -1.79 -3.49 112.91 115.47 2q7m h THR 109 Ca 0.00 -2.22 -0.50 0.00 0.77 0.00 0.00 66.41 64.45 2q7m h THR 109 Cb 0.00 2.35 0.19 0.00 -1.74 0.00 0.00 68.15 68.95 2q7m h THR 109 CO 0.00 0.43 -1.40 -2.65 0.37 0.00 0.00 175.52 172.27 2q7m n PRO 110 N -4.28 0.00 0.00 6.66 -0.02 -1.26 -4.87 135.00 131.22 2q7m n PRO 110 Ca -0.31 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.17 2q7m n PRO 110 Cb 0.73 -0.88 0.00 0.00 -0.02 0.00 0.00 33.50 33.33 2q7m n PRO 110 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q7m n GLY 111 N 2.74 4.24 3.34 -1.23 0.00 -1.26 -5.02 105.19 108.01 2q7m n GLY 111 Ca 0.02 -0.91 -0.47 0.00 0.00 0.00 0.00 46.02 44.66 2q7m n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q7m s TYR 112 N -0.18 3.69 0.00 1.61 1.51 -1.26 -4.73 117.35 118.00 2q7m s TYR 112 Ca 0.00 -1.92 0.00 0.00 -1.01 0.00 0.00 57.07 54.14 2q7m s TYR 112 Cb 0.00 -3.87 0.00 0.00 -0.11 0.00 0.00 41.96 37.98 2q7m s TYR 112 CO 0.00 -1.05 0.00 -0.89 -1.11 0.00 0.00 175.55 172.50 2q7m n ILE 113 N 4.15 0.00 -2.37 2.71 5.41 -1.26 -5.15 119.36 122.85 2q7m n ILE 113 Ca 0.15 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.89 2q7m n ILE 113 Cb 0.47 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.39 2q7m n ILE 113 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 2q7m n PHE 114 N 0.00 -3.24 -2.00 1.39 1.16 -1.26 -4.72 117.46 108.79 2q7m n PHE 114 Ca 0.00 1.92 -0.02 0.00 -1.87 0.00 0.00 57.45 57.48 2q7m n PHE 114 Cb 0.00 -2.95 -0.00 0.00 -1.61 0.00 0.00 39.48 34.92 2q7m n PHE 114 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2q7m n GLY 115 N 1.93 0.30 0.47 4.97 0.00 -1.26 -4.96 105.19 106.65 2q7m n GLY 115 Ca -0.07 -0.82 0.30 0.00 0.00 0.00 0.00 46.02 45.43 2q7m n GLY 115 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2q7m h LYS 116 N 0.00 0.18 -0.33 1.61 2.10 -2.00 0.18 116.57 118.30 2q7m h LYS 116 Ca -0.04 -0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 58.57 2q7m h LYS 116 Cb 1.00 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.27 2q7m h LYS 116 CO 0.05 0.12 0.12 0.07 -2.00 0.00 0.00 179.45 177.81 2q7m h ARG 117 N 0.18 0.50 0.62 0.07 0.11 -1.98 -0.44 114.38 113.45 2q7m h ARG 117 Ca 0.61 -0.10 -0.03 0.00 0.10 0.00 0.00 59.98 60.56 2q7m h ARG 117 Cb 2.00 -0.08 -0.00 0.00 1.11 0.00 0.00 29.97 33.00 2q7m h ARG 117 CO -0.18 0.52 -0.36 0.82 0.10 0.00 0.00 179.97 180.87 2q7m h ILE 118 N 0.38 0.00 -0.88 0.08 2.04 -1.03 0.79 117.51 118.89 2q7m h ILE 118 Ca 0.11 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.06 2q7m h ILE 118 Cb 0.22 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.24 2q7m h ILE 118 CO -0.01 0.00 0.57 0.16 0.00 0.00 0.00 178.15 178.87 2q7m h ILE 119 N -0.91 0.98 0.18 -0.67 3.07 -1.58 0.29 117.51 118.86 2q7m h ILE 119 Ca -0.08 -0.30 0.00 0.00 1.55 0.00 0.00 64.86 66.02 2q7m h ILE 119 Cb 0.73 0.02 -0.01 0.00 -0.27 0.00 0.00 36.82 37.28 2q7m h ILE 119 CO 0.10 0.16 -0.15 0.25 -1.05 0.00 0.00 178.15 177.45 2q7m h LEU 120 N 0.88 -0.40 0.48 0.16 7.12 -0.90 0.15 115.31 122.80 2q7m h LEU 120 Ca 0.40 0.04 -0.01 0.00 0.13 0.00 0.00 57.88 58.43 2q7m h LEU 120 Cb 0.38 0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 40.63 2q7m h LEU 120 CO -0.17 -0.24 -0.37 0.15 -0.13 0.00 0.00 178.44 177.69 2q7m h PHE 121 N -0.35 -1.00 -0.87 1.25 3.57 0.89 -1.59 116.94 118.85 2q7m h PHE 121 Ca -0.00 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.69 2q7m h PHE 121 Cb 0.32 0.37 -0.12 0.00 2.79 0.00 0.00 35.95 39.32 2q7m h PHE 121 CO -0.12 -0.54 0.38 -0.07 -2.23 0.00 0.00 178.31 175.73 2q7m h LEU 122 N -0.84 0.34 -2.35 0.59 4.07 -0.43 0.93 115.31 117.62 2q7m h LEU 122 Ca -0.05 0.14 -0.00 0.00 0.08 0.00 0.00 57.88 58.05 2q7m h LEU 122 Cb 0.72 0.11 -0.00 0.00 1.08 0.00 0.00 40.66 42.57 2q7m h LEU 122 CO 0.00 0.04 -0.00 0.15 -1.08 0.00 0.00 178.44 177.55 2q7m h PHE 123 N 0.43 0.00 0.00 1.13 3.04 -0.07 -1.28 116.94 120.19 2q7m h PHE 123 Ca 0.52 0.00 -0.10 0.00 3.98 0.00 0.00 57.97 62.38 2q7m h PHE 123 Cb 0.94 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.43 2q7m h PHE 123 CO -0.14 0.00 -0.82 -0.07 -2.02 0.00 0.00 178.31 175.26 2q7m h LEU 124 N 0.00 0.00 0.01 0.59 -0.00 0.18 -1.66 115.31 114.43 2q7m h LEU 124 Ca -0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 57.88 57.61 2q7m h LEU 124 Cb 0.22 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 40.89 2q7m h LEU 124 CO 0.00 0.39 -1.12 0.24 -0.00 0.00 0.00 178.44 177.95 2q7m h MET 125 N 0.00 0.52 -0.30 1.13 2.86 -0.55 -0.14 114.93 118.44 2q7m h MET 125 Ca -0.06 -0.65 -0.09 0.00 -2.06 0.00 0.00 59.70 56.85 2q7m h MET 125 Cb 1.35 0.20 -0.01 0.00 0.06 0.00 0.00 31.60 33.20 2q7m h MET 125 CO 0.04 1.26 -0.15 0.66 1.06 0.00 0.00 176.91 179.78 2q7m h SER 126 N 0.25 0.66 1.01 1.22 4.64 -1.43 -1.43 113.55 118.48 2q7m h SER 126 Ca -0.14 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 2q7m h SER 126 Cb 1.78 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 2q7m h SER 126 CO 0.20 0.93 0.00 1.62 -0.87 0.00 0.00 176.83 178.71 2q7m h VAL 127 N 0.40 0.00 0.00 0.95 3.04 -1.34 -1.78 116.25 117.52 2q7m h VAL 127 Ca 0.07 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 2q7m h VAL 127 Cb 0.68 1.25 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 2q7m h VAL 127 CO 0.05 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.61 2q7m n ALA 128 N -1.87 -0.12 -0.33 3.17 0.00 -0.07 -3.23 120.51 118.07 2q7m n ALA 128 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.57 2q7m n ALA 128 Cb 0.30 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.03 2q7m n ALA 128 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2q7m h GLY 129 N 0.00 1.60 0.16 0.00 0.00 -1.12 -0.42 103.07 103.28 2q7m h GLY 129 Ca 0.00 -0.31 0.19 0.00 0.00 0.00 0.00 47.33 47.21 2q7m h GLY 129 CO 0.00 -0.05 0.61 1.19 0.00 0.00 0.00 176.54 178.29 2q7m h ILE 130 N 0.70 0.72 0.00 2.60 -0.00 -1.46 0.32 117.51 120.38 2q7m h ILE 130 Ca 0.52 -0.26 -0.00 0.00 -0.00 0.00 0.00 64.86 65.12 2q7m h ILE 130 Cb 0.78 -0.11 -0.00 0.00 -0.00 0.00 0.00 36.82 37.49 2q7m h ILE 130 CO -0.38 0.14 -0.04 0.15 -0.00 0.00 0.00 178.15 178.02 2q7m h PHE 131 N 0.76 0.00 -0.83 2.19 3.04 -1.16 -3.30 116.94 117.64 2q7m h PHE 131 Ca 0.57 0.00 0.24 0.00 3.98 0.00 0.00 57.97 62.76 2q7m h PHE 131 Cb 0.89 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.37 2q7m h PHE 131 CO -0.00 0.18 0.84 -0.97 -2.02 0.00 0.00 178.31 176.34 2q7m h ASN 132 N -1.00 0.00 -0.34 0.41 -0.73 -0.81 1.50 115.58 114.61 2q7m h ASN 132 Ca -0.00 0.00 -0.15 0.00 1.87 0.00 0.00 56.30 58.01 2q7m h ASN 132 Cb 0.21 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.79 2q7m h ASN 132 CO -0.00 0.00 -0.39 0.22 -0.37 0.00 0.00 177.43 176.89 2q7m h TYR 133 N 0.00 1.04 -0.03 0.67 3.20 -0.49 -2.67 116.97 118.68 2q7m h TYR 133 Ca 0.39 -0.33 0.01 0.00 3.14 0.00 0.00 58.73 61.95 2q7m h TYR 133 Cb 2.07 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 40.12 2q7m h TYR 133 CO 0.00 1.13 0.04 1.88 -1.64 0.00 0.00 178.16 179.57 2q7m h TYR 134 N 0.65 0.00 0.08 -3.82 -1.99 0.20 -0.86 116.97 111.23 2q7m h TYR 134 Ca 0.05 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.77 2q7m h TYR 134 Cb 0.98 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.71 2q7m h TYR 134 CO 0.07 0.00 -0.04 -0.07 -0.00 0.00 0.00 178.16 178.12 2q7m h LEU 135 N 0.00 -0.09 -2.06 3.88 3.38 -1.27 -1.11 115.31 118.04 2q7m h LEU 135 Ca 0.02 -0.50 0.10 0.00 0.09 0.00 0.00 57.88 57.59 2q7m h LEU 135 Cb 0.09 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2q7m h LEU 135 CO -0.00 0.58 0.35 0.40 0.09 0.00 0.00 178.44 179.86 2q7m h ILE 136 N -0.89 0.47 0.13 1.22 2.04 -1.17 2.95 117.51 122.26 2q7m h ILE 136 Ca -0.01 0.00 -0.28 0.00 1.00 0.00 0.00 64.86 65.57 2q7m h ILE 136 Cb 0.59 0.72 0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2q7m h ILE 136 CO 0.02 0.00 -1.24 0.15 0.00 0.00 0.00 178.15 177.08 2q7m h PHE 137 N 0.00 0.59 0.00 1.37 3.57 -1.12 -3.26 116.94 118.09 2q7m h PHE 137 Ca 0.17 -0.41 -0.14 0.00 3.53 0.00 0.00 57.97 61.12 2q7m h PHE 137 Cb 0.88 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2q7m h PHE 137 CO 0.00 1.31 -1.35 1.19 -2.23 0.00 0.00 178.31 177.23 2q7m n PHE 138 N -3.59 0.21 -0.02 0.41 3.01 0.20 -4.73 117.46 112.95 2q7m n PHE 138 Ca -0.09 0.09 0.03 0.00 1.01 0.00 0.00 57.45 58.49 2q7m n PHE 138 Cb 1.01 -0.71 -0.14 0.00 -0.01 0.00 0.00 39.48 39.63 2q7m n PHE 138 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2q7m n PHE 139 N -4.43 0.21 -0.05 1.38 3.01 0.93 -4.27 117.46 114.24 2q7m n PHE 139 Ca -0.25 0.07 0.16 0.00 1.01 0.00 0.00 57.45 58.44 2q7m n PHE 139 Cb 0.59 -0.77 0.59 0.00 -0.01 0.00 0.00 39.48 39.88 2q7m n PHE 139 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2q7m h GLY 140 N 3.96 0.33 2.00 1.37 0.00 -1.22 0.06 103.07 109.57 2q7m h GLY 140 Ca -0.19 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 2q7m h GLY 140 CO 0.02 0.04 -0.08 1.48 0.00 0.00 0.00 176.54 178.00 2q7m h SER 141 N 0.21 0.00 -4.15 0.19 4.64 -1.74 -3.47 113.55 109.24 2q7m h SER 141 Ca 0.28 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 61.09 2q7m h SER 141 Cb 0.80 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.98 2q7m h SER 141 CO -0.05 0.08 0.40 -1.81 -0.87 0.00 0.00 176.83 174.58 2q7m s ASP 142 N -6.12 5.48 0.00 4.97 1.01 0.01 -5.00 116.67 117.02 2q7m s ASP 142 Ca 0.05 2.05 0.00 0.00 0.71 0.00 0.00 52.55 55.36 2q7m s ASP 142 Cb 0.07 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.43 2q7m s ASP 142 CO 0.65 -1.38 0.00 0.33 0.21 0.00 0.00 175.17 174.98 2q7m n PHE 143 N -1.84 0.00 -0.26 4.23 7.35 -1.26 -5.06 117.46 120.61 2q7m n PHE 143 Ca 0.11 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.80 2q7m n PHE 143 Cb 0.52 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.35 2q7m n PHE 143 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2q7m n GLU 144 N 0.00 0.00 0.00 -4.13 -0.58 -1.26 -3.77 120.64 110.90 2q7m n GLU 144 Ca 0.00 -0.11 0.08 0.00 -0.42 0.00 0.00 57.16 56.71 2q7m n GLU 144 Cb 0.00 -1.17 -0.08 0.00 -0.57 0.00 0.00 31.44 29.62 2q7m n GLU 144 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2q7m n ASN 145 N 2.91 0.89 0.01 1.62 3.02 -1.26 -4.00 115.26 118.45 2q7m n ASN 145 Ca 0.00 -0.95 0.08 0.00 -0.03 0.00 0.00 54.58 53.68 2q7m n ASN 145 Cb 0.00 0.94 0.34 0.00 -0.61 0.00 0.00 39.78 40.45 2q7m n ASN 145 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2q7m n TYR 146 N -1.24 0.05 -1.03 3.10 4.01 -1.25 -1.97 117.16 118.83 2q7m n TYR 146 Ca 0.04 0.02 -0.24 0.00 -0.16 0.00 0.00 57.90 57.56 2q7m n TYR 146 Cb 0.27 -0.53 0.06 0.00 -0.31 0.00 0.00 39.34 38.83 2q7m n TYR 146 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2q7m n ILE 147 N -1.55 3.10 -2.34 -0.72 5.41 -1.26 -4.59 119.36 117.41 2q7m n ILE 147 Ca 0.04 -2.13 -0.40 0.00 1.00 0.00 0.00 62.75 61.26 2q7m n ILE 147 Cb 0.18 -1.20 0.02 0.00 -0.71 0.00 0.00 39.64 37.93 2q7m n ILE 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2q7m n ALA 148 N -0.24 6.28 1.34 -1.39 0.00 -0.83 -5.18 120.51 120.49 2q7m n ALA 148 Ca 0.44 -4.37 0.13 0.00 0.00 0.00 0.00 53.44 49.65 2q7m n ALA 148 Cb 0.68 -2.19 0.39 0.00 0.00 0.00 0.00 19.45 18.32 2q7m n ALA 148 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91