#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 2.26 -0.41 6.12 5.75 -1.26 -4.83 116.55 124.18 2q7m n ASP 2 Ca 0.00 0.12 0.36 0.00 -0.01 0.00 0.00 54.79 55.26 2q7m n ASP 2 Cb 0.00 -1.38 0.64 0.00 -1.03 0.00 0.00 41.12 39.35 2q7m n ASP 2 CO 0.00 0.00 0.00 -0.61 -0.11 0.00 0.00 177.20 176.48 2q7m h GLN 3 N 14.71 0.02 0.68 0.11 5.75 -2.05 0.99 115.11 135.32 2q7m h GLN 3 Ca -0.27 -0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.19 2q7m h GLN 3 Cb 1.29 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.83 2q7m h GLN 3 CO 1.07 0.02 -0.40 1.49 -2.65 0.00 0.00 178.83 178.36 2q7m h GLU 4 N 0.03 -0.97 -0.34 1.69 4.22 -2.00 -2.52 114.58 114.68 2q7m h GLU 4 Ca 0.86 0.07 0.06 0.00 0.08 0.00 0.00 59.36 60.43 2q7m h GLU 4 Cb 2.56 0.22 -0.06 0.00 0.50 0.00 0.00 28.75 31.97 2q7m h GLU 4 CO -0.58 -0.64 -0.01 1.79 -2.18 0.00 0.00 179.01 177.39 2q7m h THR 5 N -1.00 0.73 -1.07 0.32 1.35 -1.23 0.74 112.91 112.74 2q7m h THR 5 Ca -0.09 -0.03 0.29 0.00 -0.55 0.00 0.00 66.41 66.03 2q7m h THR 5 Cb 0.80 0.64 -0.10 0.00 -1.73 0.00 0.00 68.15 67.76 2q7m h THR 5 CO 0.10 0.02 0.69 0.58 -0.25 0.00 0.00 175.52 176.66 2q7m h VAL 6 N 0.08 0.47 -0.10 6.82 2.07 -1.28 0.16 116.25 124.47 2q7m h VAL 6 Ca 0.17 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.58 2q7m h VAL 6 Cb 0.23 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2q7m h VAL 6 CO -0.29 0.06 0.02 1.23 0.02 0.00 0.00 177.57 178.62 2q7m h GLY 7 N 0.35 0.11 -3.31 2.17 0.00 -0.38 -1.43 103.07 100.57 2q7m h GLY 7 Ca 0.62 -0.01 -0.23 0.00 0.00 0.00 0.00 47.33 47.71 2q7m h GLY 7 CO -0.31 0.00 0.30 1.16 0.00 0.00 0.00 176.54 177.69 2q7m n ASN 8 N -5.08 6.03 0.00 0.19 0.23 0.55 -3.49 115.26 113.68 2q7m n ASN 8 Ca -0.05 -2.87 0.00 0.00 -0.53 0.00 0.00 54.58 51.13 2q7m n ASN 8 Cb 0.06 -1.06 0.00 0.00 -2.08 0.00 0.00 39.78 36.70 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 0.64 0.00 -0.63 3.53 3.14 -1.16 -4.90 118.33 118.94 2q7m n VAL 9 Ca 0.22 0.00 0.50 0.00 -2.96 0.00 0.00 64.34 62.09 2q7m n VAL 9 Cb 0.57 0.00 0.81 0.00 -1.06 0.00 0.00 33.84 34.16 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 0.08 0.08 1.55 2.07 -1.29 0.47 116.25 119.21 2q7m h VAL 10 Ca 0.00 -0.00 -0.27 0.00 0.82 0.00 0.00 66.70 67.25 2q7m h VAL 10 Cb 0.00 0.08 0.03 0.00 -1.52 0.00 0.00 31.29 29.88 2q7m h VAL 10 CO 0.00 0.00 -1.11 -0.07 0.02 0.00 0.00 177.57 176.41 2q7m h LEU 11 N 0.00 0.84 -0.71 2.57 -0.00 -1.87 -0.97 115.31 115.17 2q7m h LEU 11 Ca 0.87 -0.80 -0.09 0.00 -0.00 0.00 0.00 57.88 57.86 2q7m h LEU 11 Cb 3.46 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 43.83 2q7m h LEU 11 CO -0.03 1.55 0.02 -0.07 -0.00 0.00 0.00 178.44 179.91 2q7m h LEU 12 N 0.23 0.99 -0.16 1.67 3.38 -0.41 -0.23 115.31 120.79 2q7m h LEU 12 Ca -0.16 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.50 2q7m h LEU 12 Cb 1.79 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 42.27 2q7m h LEU 12 CO 0.21 1.03 -0.06 0.00 0.09 0.00 0.00 178.44 179.71 2q7m h ALA 13 N 1.07 0.22 0.13 1.53 0.00 -1.15 0.43 119.26 121.51 2q7m h ALA 13 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2q7m h ALA 13 Cb 0.51 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2q7m h ALA 13 CO 0.02 0.02 -0.33 0.82 0.00 0.00 0.00 179.25 179.78 2q7m h ILE 14 N 0.01 0.00 -0.79 0.00 5.03 -0.95 0.98 117.51 121.79 2q7m h ILE 14 Ca 0.04 0.00 0.17 0.00 -0.12 0.00 0.00 64.86 64.95 2q7m h ILE 14 Cb 0.52 0.00 -0.11 0.00 -3.03 0.00 0.00 36.82 34.21 2q7m h ILE 14 CO 0.02 0.00 0.29 1.62 -0.68 0.00 0.00 178.15 179.40 2q7m h VAL 15 N -0.52 0.56 -0.26 1.67 3.04 -1.08 0.14 116.25 119.80 2q7m h VAL 15 Ca -0.01 -0.13 -0.03 0.00 -1.01 0.00 0.00 66.70 65.52 2q7m h VAL 15 Cb 0.50 0.15 -0.01 0.00 -2.01 0.00 0.00 31.29 29.91 2q7m h VAL 15 CO -0.15 0.07 0.05 0.74 -1.01 0.00 0.00 177.57 177.27 2q7m h THR 16 N 0.38 1.22 0.00 3.17 2.02 0.10 -0.12 112.91 119.68 2q7m h THR 16 Ca 0.45 -0.75 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 2q7m h THR 16 Cb 0.77 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2q7m h THR 16 CO -0.47 0.24 -0.08 -0.07 0.37 0.00 0.00 175.52 175.51 2q7m h LEU 17 N 0.25 0.00 0.35 2.58 -0.00 0.22 0.27 115.31 118.99 2q7m h LEU 17 Ca 0.08 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.94 2q7m h LEU 17 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 2q7m h LEU 17 CO 0.00 0.08 -0.17 0.40 -0.00 0.00 0.00 178.44 178.75 2q7m h ILE 18 N 0.00 0.00 -0.36 1.22 5.03 -0.19 -2.15 117.51 121.06 2q7m h ILE 18 Ca -0.00 -0.16 0.11 0.00 -0.12 0.00 0.00 64.86 64.68 2q7m h ILE 18 Cb 0.18 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 33.95 2q7m h ILE 18 CO 0.01 0.00 0.31 0.77 -0.68 0.00 0.00 178.15 178.56 2q7m h SER 19 N -0.64 0.00 0.03 1.72 4.64 -0.64 0.31 113.55 118.97 2q7m h SER 19 Ca -0.05 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.12 2q7m h SER 19 Cb 0.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2q7m h SER 19 CO 0.08 0.00 -0.50 1.62 -0.87 0.00 0.00 176.83 177.16 2q7m h VAL 20 N 0.00 1.32 -0.04 0.95 3.04 -0.40 -0.64 116.25 120.47 2q7m h VAL 20 Ca 0.17 -1.72 -0.03 0.00 -1.01 0.00 0.00 66.70 64.11 2q7m h VAL 20 Cb 0.80 1.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 2q7m h VAL 20 CO -0.00 0.53 -0.11 0.58 -1.01 0.00 0.00 177.57 177.56 2q7m h VAL 21 N 0.42 1.45 0.00 1.51 2.07 0.21 -2.67 116.25 119.23 2q7m h VAL 21 Ca 0.02 -1.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.03 2q7m h VAL 21 Cb 1.02 2.33 -0.00 0.00 -1.52 0.00 0.00 31.29 33.11 2q7m h VAL 21 CO 0.09 0.41 -0.12 0.06 0.02 0.00 0.00 177.57 178.03 2q7m h GLN 22 N -0.39 0.00 -0.19 1.57 3.07 -1.07 -2.42 115.11 115.67 2q7m h GLN 22 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.71 2q7m h GLN 22 Cb 0.72 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.27 2q7m h GLN 22 CO 0.02 0.12 0.02 -0.91 0.09 0.00 0.00 178.83 178.18 2q7m h ASN 23 N 0.00 0.32 0.10 0.06 4.21 -1.01 -2.40 115.58 116.86 2q7m h ASN 23 Ca -0.00 -0.28 -0.00 0.00 1.21 0.00 0.00 56.30 57.23 2q7m h ASN 23 Cb 0.24 -0.08 -0.00 0.00 -1.12 0.00 0.00 38.32 37.35 2q7m h ASN 23 CO 0.02 0.51 -0.02 1.23 -1.29 0.00 0.00 177.43 177.88 2q7m h GLY 24 N 0.11 0.00 0.18 2.83 0.00 -1.09 -1.86 103.07 103.25 2q7m h GLY 24 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 2q7m h GLY 24 CO 0.01 0.00 -0.05 -2.75 0.00 0.00 0.00 176.54 173.75 2q7m h PHE 25 N 0.00 0.04 -0.70 5.60 3.57 -1.24 -1.88 116.94 122.33 2q7m h PHE 25 Ca -0.00 -0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.62 2q7m h PHE 25 Cb 0.07 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.76 2q7m h PHE 25 CO 0.00 0.88 0.47 0.74 -2.23 0.00 0.00 178.31 178.18 2q7m h PHE 26 N -0.81 0.40 0.00 0.41 0.04 -1.06 1.29 116.94 117.21 2q7m h PHE 26 Ca -0.01 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2q7m h PHE 26 Cb 0.90 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.92 2q7m h PHE 26 CO 0.22 0.16 0.00 0.00 -0.60 0.00 0.00 178.31 178.09 2q7m n ALA 27 N -2.54 2.38 -0.07 2.45 0.00 -0.73 -3.05 120.51 118.94 2q7m n ALA 27 Ca 0.13 -0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.23 2q7m n ALA 27 Cb 0.52 -1.47 -0.12 0.00 0.00 0.00 0.00 19.45 18.38 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 -1.37 0.67 0.48 0.00 -0.00 0.42 -3.76 115.22 111.66 2q7m n HIS 28 Ca 0.11 0.18 0.05 0.00 -0.00 0.00 0.00 57.72 58.06 2q7m n HIS 28 Cb 0.27 -1.08 0.25 0.00 -0.00 0.00 0.00 29.99 29.42 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 -3.70 0.17 -0.04 1.57 4.76 0.17 -0.34 118.16 120.75 2q7m n LYS 29 Ca -0.39 0.16 -0.06 0.00 -2.87 0.00 0.00 58.31 55.14 2q7m n LYS 29 Cb 0.94 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 32.50 2q7m n LYS 29 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2q7m n VAL 30 N -1.23 1.32 0.06 -0.18 0.31 -1.17 -3.96 118.33 113.48 2q7m n VAL 30 Ca 0.05 -0.78 -0.19 0.00 -0.01 0.00 0.00 64.34 63.41 2q7m n VAL 30 Cb 0.07 -0.68 -0.10 0.00 -0.91 0.00 0.00 33.84 32.21 2q7m n VAL 30 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2q7m h GLU 31 N 0.00 0.62 -0.67 5.55 4.57 -0.78 -2.86 114.58 121.01 2q7m h GLU 31 Ca -0.34 -0.71 0.04 0.00 -1.18 0.00 0.00 59.36 57.17 2q7m h GLU 31 Cb 1.94 0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 30.70 2q7m h GLU 31 CO 0.05 1.29 0.44 0.45 -1.18 0.00 0.00 179.01 180.06 2q7m h HIS 32 N 0.33 0.76 0.00 0.92 3.86 -1.61 -0.02 115.15 119.40 2q7m h HIS 32 Ca -0.13 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 2q7m h HIS 32 Cb 1.73 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 29.94 2q7m h HIS 32 CO 0.10 0.44 -0.21 0.93 0.86 0.00 0.00 177.93 180.05 2q7m h GLU 33 N 0.79 0.00 0.00 2.45 3.07 -1.68 -2.33 114.58 116.88 2q7m h GLU 33 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 2q7m h GLU 33 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 2q7m h GLU 33 CO -0.08 0.02 -0.54 0.45 -1.40 0.00 0.00 179.01 177.46 2q7m n SER 34 N -3.03 0.53 -0.09 1.42 2.88 -0.71 -3.52 113.62 111.09 2q7m n SER 34 Ca 0.03 -0.16 -0.23 0.00 -1.33 0.00 0.00 58.87 57.19 2q7m n SER 34 Cb 0.54 0.24 -0.12 0.00 -0.75 0.00 0.00 64.21 64.13 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 -1.64 0.60 0.25 -1.46 5.12 -0.10 -2.80 116.66 116.62 2q7m n ARG 35 Ca 0.05 0.47 0.10 0.00 -1.93 0.00 0.00 57.85 56.54 2q7m n ARG 35 Cb 0.36 -1.69 0.65 0.00 -1.16 0.00 0.00 32.46 30.61 2q7m n ARG 35 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 2q7m h THR 36 N -0.81 0.75 -1.79 0.55 1.35 -1.58 -3.11 112.91 108.28 2q7m h THR 36 Ca -0.43 -0.60 -0.50 0.00 -0.55 0.00 0.00 66.41 64.33 2q7m h THR 36 Cb 1.49 1.36 -0.41 0.00 -1.73 0.00 0.00 68.15 68.86 2q7m h THR 36 CO -0.20 0.15 -0.97 0.00 -0.25 0.00 0.00 175.52 174.25 2q7m n GLN 37 N -3.84 2.03 -1.58 4.72 1.13 -1.23 -5.11 117.38 113.50 2q7m n GLN 37 Ca -0.02 -3.94 -0.54 0.00 -1.94 0.00 0.00 57.00 50.56 2q7m n GLN 37 Cb 0.25 -1.84 -0.06 0.00 0.11 0.00 0.00 30.24 28.69 2q7m n GLN 37 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2q7m n ASN 38 N -0.06 1.40 0.00 1.08 3.02 -1.12 -4.78 115.26 114.79 2q7m n ASN 38 Ca 0.26 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.93 2q7m n ASN 38 Cb 0.62 -1.14 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 2q7m n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q7m n GLY 39 N 2.44 3.36 0.29 7.41 0.00 -1.26 -4.96 105.19 112.48 2q7m n GLY 39 Ca 0.19 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2q7m n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2q7m n ARG 40 N 0.00 0.00 -0.93 1.61 3.00 -1.26 -4.68 116.66 114.40 2q7m n ARG 40 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.74 2q7m n ARG 40 Cb 0.00 -0.95 -0.04 0.00 0.00 0.00 0.00 32.46 31.47 2q7m n ARG 40 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2q7m n SER 41 N 0.07 -0.53 -4.83 6.15 7.64 -1.26 -4.81 113.62 116.05 2q7m n SER 41 Ca 0.00 -1.29 -0.38 0.00 1.01 0.00 0.00 58.87 58.22 2q7m n SER 41 Cb 0.00 -0.37 -0.06 0.00 -1.01 0.00 0.00 64.21 62.77 2q7m n SER 41 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2q7m s PHE 42 N 4.57 3.74 0.00 1.43 -0.12 -1.26 -4.03 117.98 122.31 2q7m s PHE 42 Ca 0.23 1.11 0.00 0.00 -0.05 0.00 0.00 56.93 58.22 2q7m s PHE 42 Cb 0.03 -2.38 0.00 0.00 -0.63 0.00 0.00 43.02 40.04 2q7m s PHE 42 CO 0.10 0.58 0.00 0.94 -0.05 0.00 0.00 175.22 176.79 2q7m n GLN 43 N 1.57 0.00 -0.41 1.99 0.00 -1.26 -4.74 117.38 114.54 2q7m n GLN 43 Ca -0.11 0.11 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 2q7m n GLN 43 Cb 0.52 -0.06 0.00 0.00 0.00 0.00 0.00 30.24 30.70 2q7m n GLN 43 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2q7m n ARG 44 N 2.33 -1.21 -4.06 3.69 0.00 -1.26 -4.76 116.66 111.38 2q7m n ARG 44 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.76 2q7m n ARG 44 Cb 0.00 -2.64 -0.09 0.00 0.00 0.00 0.00 32.46 29.73 2q7m n ARG 44 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2q7m s THR 45 N -0.41 0.09 0.00 5.15 -4.23 -1.26 -5.11 115.64 109.87 2q7m s THR 45 Ca 0.00 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 58.83 2q7m s THR 45 Cb 0.00 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.91 2q7m s THR 45 CO 0.00 -0.42 0.00 0.61 -0.54 0.00 0.00 174.62 174.27 2q7m n GLY 46 N -0.13 1.70 2.18 3.99 0.00 -1.26 -4.56 105.19 107.10 2q7m n GLY 46 Ca -0.07 -1.97 -0.03 0.00 0.00 0.00 0.00 46.02 43.95 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 1.83 0.00 0.91 2.61 -1.04 -1.26 -4.65 114.28 112.68 2q7m n THR 47 Ca 0.00 0.00 0.10 0.00 -2.04 0.00 0.00 64.05 62.11 2q7m n THR 47 Cb 0.00 -0.09 -0.12 0.00 -1.82 0.00 0.00 70.33 68.30 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 0.91 -0.05 -4.42 7.99 -1.26 -2.84 117.00 117.32 2q7m n LEU 48 Ca 0.01 -0.47 -0.17 0.00 -0.01 0.00 0.00 56.01 55.37 2q7m n LEU 48 Cb 0.05 0.00 -0.14 0.00 -0.11 0.00 0.00 43.42 43.23 2q7m n LEU 48 CO 0.04 0.23 -0.97 0.00 -1.51 0.00 0.00 177.39 175.18 2q7m n ALA 49 N -1.52 1.21 0.04 -1.18 0.00 -1.26 -2.67 120.51 115.14 2q7m n ALA 49 Ca 0.03 -0.86 -0.06 0.00 0.00 0.00 0.00 53.44 52.56 2q7m n ALA 49 Cb 0.33 -0.48 -0.11 0.00 0.00 0.00 0.00 19.45 19.19 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 0.03 0.00 0.00 0.00 3.57 -1.84 -2.64 116.94 116.07 2q7m h PHE 50 Ca -0.46 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 60.95 2q7m h PHE 50 Cb 2.02 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.74 2q7m h PHE 50 CO 0.04 0.93 -0.49 1.49 -2.23 0.00 0.00 178.31 178.06 2q7m h GLU 51 N 0.00 0.00 0.00 1.11 4.81 -1.70 -1.76 114.58 117.05 2q7m h GLU 51 Ca -0.09 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 58.92 2q7m h GLU 51 Cb 1.79 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.14 2q7m h GLU 51 CO 0.11 0.36 -1.07 -0.09 -0.73 0.00 0.00 179.01 177.58 2q7m h ARG 52 N 0.00 0.01 0.04 1.92 2.43 -1.53 -3.20 114.38 114.05 2q7m h ARG 52 Ca -0.02 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.98 2q7m h ARG 52 Cb 1.30 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.85 2q7m h ARG 52 CO 0.05 0.96 -0.82 0.28 -1.51 0.00 0.00 179.97 178.94 2q7m h VAL 53 N 0.00 1.31 -0.07 0.20 2.07 -1.47 -2.71 116.25 115.59 2q7m h VAL 53 Ca -0.04 -2.33 0.02 0.00 0.82 0.00 0.00 66.70 65.17 2q7m h VAL 53 Cb 1.80 2.86 -0.00 0.00 -1.52 0.00 0.00 31.29 34.42 2q7m h VAL 53 CO 0.13 0.56 0.09 0.22 0.02 0.00 0.00 177.57 178.58 2q7m h TYR 54 N -0.76 0.00 0.05 1.57 3.20 -1.48 0.11 116.97 119.65 2q7m h TYR 54 Ca -0.19 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.67 2q7m h TYR 54 Cb 1.35 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.62 2q7m h TYR 54 CO 0.18 0.00 -0.02 1.15 -1.64 0.00 0.00 178.16 177.83 2q7m h THR 55 N 0.00 1.16 -0.76 1.81 2.02 -1.63 -1.40 112.91 114.10 2q7m h THR 55 Ca 0.03 -1.64 0.12 0.00 0.77 0.00 0.00 66.41 65.69 2q7m h THR 55 Cb 0.21 2.10 -0.08 0.00 -1.74 0.00 0.00 68.15 68.63 2q7m h THR 55 CO -0.00 0.36 0.37 0.00 0.37 0.00 0.00 175.52 176.61 2q7m h ALA 56 N -0.22 1.08 0.43 6.16 0.00 -1.07 -2.31 119.26 123.33 2q7m h ALA 56 Ca -0.01 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2q7m h ALA 56 Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2q7m h ALA 56 CO 0.01 -0.09 -0.21 -0.97 0.00 0.00 0.00 179.25 178.00 2q7m h ASN 57 N 0.58 -0.49 0.00 0.00 -0.00 -0.90 -2.83 115.58 111.93 2q7m h ASN 57 Ca 0.39 0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.71 2q7m h ASN 57 Cb 0.49 0.13 0.00 0.00 -0.00 0.00 0.00 38.32 38.94 2q7m h ASN 57 CO -0.32 -0.33 0.00 1.67 -0.00 0.00 0.00 177.43 178.45 2q7m n GLN 58 N -3.67 0.27 0.00 6.67 -0.06 -0.53 0.69 117.38 120.75 2q7m n GLN 58 Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.93 2q7m n GLN 58 Cb 0.23 -1.26 0.00 0.00 -4.06 0.00 0.00 30.24 25.15 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 0.64 4.43 -0.04 1.69 3.02 -0.89 -4.53 115.26 119.58 2q7m n ASN 59 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.47 2q7m n ASN 59 Cb 0.10 0.77 -0.14 0.00 -0.61 0.00 0.00 39.78 39.90 2q7m n ASN 59 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2q7m n VAL 61 N -2.96 0.00 0.08 0.00 0.31 -0.64 -1.73 118.33 113.39 2q7m n VAL 61 Ca -0.20 -0.01 0.10 0.00 -0.01 0.00 0.00 64.34 64.22 2q7m n VAL 61 Cb 1.06 -0.40 -0.03 0.00 -0.91 0.00 0.00 33.84 33.56 2q7m n VAL 61 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2q7m n ASP 62 N -1.27 0.75 -0.00 4.52 9.92 -1.26 -4.09 116.55 125.12 2q7m n ASP 62 Ca 0.13 0.29 -0.06 0.00 -0.53 0.00 0.00 54.79 54.63 2q7m n ASP 62 Cb 0.27 0.59 -0.12 0.00 -0.64 0.00 0.00 41.12 41.22 2q7m n ASP 62 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2q7m h ALA 63 N 1.92 0.73 -0.21 2.24 0.00 -1.59 -3.41 119.26 118.93 2q7m h ALA 63 Ca -0.03 -1.25 0.03 0.00 0.00 0.00 0.00 54.91 53.67 2q7m h ALA 63 Cb 1.09 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 19.21 2q7m h ALA 63 CO 0.01 1.36 -0.51 -0.92 0.00 0.00 0.00 179.25 179.18 2q7m h TYR 64 N 0.00 -1.54 0.09 0.00 3.20 -1.48 -1.89 116.97 115.36 2q7m h TYR 64 Ca -0.24 0.06 0.01 0.00 3.14 0.00 0.00 58.73 61.70 2q7m h TYR 64 Cb 1.86 0.70 -0.03 0.00 1.54 0.00 0.00 36.73 40.81 2q7m h TYR 64 CO 0.00 -0.49 -0.31 -1.00 -1.64 0.00 0.00 178.16 174.72 2q7m h PRO 65 N -0.48 -0.44 0.00 1.82 0.13 -1.80 0.28 132.00 131.51 2q7m h PRO 65 Ca 0.04 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2q7m h PRO 65 Cb 0.60 0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2q7m h PRO 65 CO -0.46 -0.29 0.00 2.41 -0.23 0.00 0.00 178.00 179.43 2q7m n THR 66 N -4.22 1.13 -0.13 1.56 -1.04 -1.20 -0.83 114.28 109.55 2q7m n THR 66 Ca -0.05 0.28 -0.28 0.00 -2.04 0.00 0.00 64.05 61.96 2q7m n THR 66 Cb 0.25 -1.26 -0.10 0.00 -1.82 0.00 0.00 70.33 67.39 2q7m n THR 66 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2q7m n PHE 67 N -1.29 0.14 -0.21 -1.42 7.35 -0.69 -4.09 117.46 117.24 2q7m n PHE 67 Ca 0.01 0.05 0.14 0.00 -0.76 0.00 0.00 57.45 56.89 2q7m n PHE 67 Cb 0.01 -1.01 0.45 0.00 0.35 0.00 0.00 39.48 39.28 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 -0.88 0.51 0.00 -2.13 5.85 0.70 0.39 115.31 119.74 2q7m h LEU 68 Ca -0.65 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.10 2q7m h LEU 68 Cb 1.62 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.58 2q7m h LEU 68 CO -0.36 0.26 0.00 0.00 -0.34 0.00 0.00 178.44 178.00 2q7m n ALA 69 N -2.48 -0.16 0.08 1.25 0.00 -0.01 -2.13 120.51 117.07 2q7m n ALA 69 Ca 0.16 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.80 2q7m n ALA 69 Cb 0.50 0.14 0.74 0.00 0.00 0.00 0.00 19.45 20.84 2q7m n ALA 69 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2q7m h VAL 70 N 0.00 0.40 -0.84 0.00 -1.51 -1.61 -0.82 116.25 111.88 2q7m h VAL 70 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.45 2q7m h VAL 70 Cb 0.00 0.65 -0.04 0.00 -2.13 0.00 0.00 31.29 29.77 2q7m h VAL 70 CO 0.00 0.00 0.47 0.25 -1.23 0.00 0.00 177.57 177.06 2q7m h LEU 71 N 0.00 1.05 0.04 4.19 6.46 -0.39 -1.22 115.31 125.44 2q7m h LEU 71 Ca 0.20 -0.10 -0.32 0.00 -0.12 0.00 0.00 57.88 57.55 2q7m h LEU 71 Cb 1.08 -0.27 -0.04 0.00 -0.73 0.00 0.00 40.66 40.71 2q7m h LEU 71 CO -0.00 0.84 -1.78 0.79 -0.62 0.00 0.00 178.44 177.67 2q7m n TRP 72 N -4.39 0.88 -0.28 1.25 7.02 -0.43 -2.83 117.44 118.67 2q7m n TRP 72 Ca 0.08 0.29 0.20 0.00 -1.02 0.00 0.00 57.50 57.05 2q7m n TRP 72 Cb 0.09 -1.10 0.49 0.00 -2.42 0.00 0.00 31.31 28.37 2q7m n TRP 72 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 2q7m h SER 73 N -0.56 0.46 -0.03 -0.99 0.02 -1.31 3.19 113.55 114.33 2q7m h SER 73 Ca -0.44 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2q7m h SER 73 Cb 1.64 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 64.16 2q7m h SER 73 CO -0.13 0.15 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 2q7m n ALA 74 N -2.49 2.57 -0.10 3.77 0.00 -0.46 -1.85 120.51 121.95 2q7m n ALA 74 Ca 0.22 -0.45 -0.11 0.00 0.00 0.00 0.00 53.44 53.10 2q7m n ALA 74 Cb 0.74 -1.16 -0.15 0.00 0.00 0.00 0.00 19.45 18.88 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 1.17 -0.92 0.19 0.00 0.00 1.02 -4.13 105.19 102.52 2q7m n GLY 75 Ca 0.19 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.83 1.84 0.00 0.99 7.99 0.16 -3.28 117.00 121.86 2q7m n LEU 76 Ca -0.34 0.31 0.00 0.00 -0.01 0.00 0.00 56.01 55.98 2q7m n LEU 76 Cb 1.13 -0.74 0.02 0.00 -0.11 0.00 0.00 43.42 43.72 2q7m n LEU 76 CO 0.41 0.23 0.16 0.18 -1.51 0.00 0.00 177.39 176.86 2q7m n LEU 77 N -4.24 0.00 0.00 2.23 4.32 -0.77 -4.59 117.00 113.95 2q7m n LEU 77 Ca -0.37 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.62 2q7m n LEU 77 Cb 0.72 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.52 2q7m n LEU 77 CO 0.09 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.26 2q7m n SER 79 N 0.00 0.00 0.00 0.00 3.41 -1.26 -3.55 113.62 112.22 2q7m n SER 79 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.72 2q7m n SER 79 Cb 0.00 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 64.52 2q7m n SER 79 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2q7m n GLN 80 N 0.71 0.30 -0.04 4.33 7.27 -1.21 -3.06 117.38 125.69 2q7m n GLN 80 Ca 0.00 0.07 -0.02 0.00 0.07 0.00 0.00 57.00 57.12 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 -0.24 0.07 0.00 0.00 177.06 176.89 2q7m h VAL 81 N 0.00 0.00 -0.45 1.69 3.04 -1.89 -3.10 116.25 115.54 2q7m h VAL 81 Ca 0.00 -0.68 0.02 0.00 -1.01 0.00 0.00 66.70 65.03 2q7m h VAL 81 Cb 0.23 0.00 -0.03 0.00 -2.01 0.00 0.00 31.29 29.48 2q7m h VAL 81 CO 0.00 0.00 0.28 -0.65 -1.01 0.00 0.00 177.57 176.19 2q7m h PRO 82 N -0.68 0.54 -0.66 4.17 0.11 -1.92 0.61 132.00 134.17 2q7m h PRO 82 Ca 0.00 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 66.19 2q7m h PRO 82 Cb 0.23 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 31.14 2q7m h PRO 82 CO 0.00 0.36 0.24 0.00 -0.21 0.00 0.00 178.00 178.39 2q7m h ALA 83 N 1.19 0.88 -0.05 -0.75 0.00 -1.74 0.32 119.26 119.10 2q7m h ALA 83 Ca 0.18 0.10 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2q7m h ALA 83 Cb -0.01 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2q7m h ALA 83 CO -0.07 -0.21 -0.55 0.00 0.00 0.00 0.00 179.25 178.42 2q7m h ALA 84 N 1.47 0.98 0.27 0.00 0.00 -1.27 -2.12 119.26 118.60 2q7m h ALA 84 Ca 0.35 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2q7m h ALA 84 Cb 0.48 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2q7m h ALA 84 CO -0.35 0.69 -0.13 0.35 0.00 0.00 0.00 179.25 179.80 2q7m h PHE 85 N 0.12 -0.34 -0.95 0.00 3.04 0.51 -2.31 116.94 117.01 2q7m h PHE 85 Ca -0.00 -0.01 0.25 0.00 3.98 0.00 0.00 57.97 62.19 2q7m h PHE 85 Cb 1.01 0.11 -0.13 0.00 2.56 0.00 0.00 35.95 39.50 2q7m h PHE 85 CO 0.01 -0.04 0.48 0.00 -2.02 0.00 0.00 178.31 176.74 2q7m h ALA 86 N -0.74 1.65 0.00 2.41 0.00 -0.49 1.72 119.26 123.81 2q7m h ALA 86 Ca -0.04 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2q7m h ALA 86 Cb 0.45 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2q7m h ALA 86 CO 0.06 -0.38 -0.09 0.78 0.00 0.00 0.00 179.25 179.62 2q7m h GLY 87 N 0.43 0.00 0.56 0.00 0.00 -1.38 -2.18 103.07 100.49 2q7m h GLY 87 Ca 0.62 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.89 2q7m h GLY 87 CO -0.54 0.00 -0.23 -2.00 0.00 0.00 0.00 176.54 173.77 2q7m h LEU 88 N 0.00 0.27 -1.21 3.11 7.12 0.32 -3.14 115.31 121.77 2q7m h LEU 88 Ca -0.00 -0.67 -0.07 0.00 0.13 0.00 0.00 57.88 57.27 2q7m h LEU 88 Cb 0.35 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.39 2q7m h LEU 88 CO 0.01 0.90 -0.17 0.24 -0.13 0.00 0.00 178.44 179.28 2q7m h MET 89 N -0.34 0.33 -0.42 1.25 2.86 -0.94 -1.07 114.93 116.61 2q7m h MET 89 Ca -0.02 -0.09 0.07 0.00 -2.06 0.00 0.00 59.70 57.60 2q7m h MET 89 Cb 0.89 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.50 2q7m h MET 89 CO 0.05 0.50 0.29 -0.92 1.06 0.00 0.00 176.91 177.88 2q7m h TYR 90 N 0.31 0.25 0.00 -0.22 5.03 -1.44 1.00 116.97 121.90 2q7m h TYR 90 Ca 0.06 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.37 2q7m h TYR 90 Cb 0.49 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.69 2q7m h TYR 90 CO 0.01 0.13 0.00 -0.07 -1.32 0.00 0.00 178.16 176.91 2q7m h LEU 91 N 0.25 0.00 0.13 2.82 -0.00 -1.14 -0.97 115.31 116.40 2q7m h LEU 91 Ca 0.19 0.00 -0.33 0.00 -0.00 0.00 0.00 57.88 57.74 2q7m h LEU 91 Cb 0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.09 2q7m h LEU 91 CO -0.04 0.00 -1.73 -0.26 -0.00 0.00 0.00 178.44 176.42 2q7m h PHE 92 N 0.00 0.51 -0.41 1.13 0.04 0.11 -3.03 116.94 115.29 2q7m h PHE 92 Ca 0.00 -0.37 -0.02 0.00 2.80 0.00 0.00 57.97 60.38 2q7m h PHE 92 Cb 0.60 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.71 2q7m h PHE 92 CO 0.00 1.68 0.19 0.28 -0.60 0.00 0.00 178.31 179.86 2q7m h VAL 93 N -0.10 1.18 -0.83 -0.55 2.07 -0.73 -0.38 116.25 116.92 2q7m h VAL 93 Ca -0.37 -0.52 0.12 0.00 0.82 0.00 0.00 66.70 66.76 2q7m h VAL 93 Cb 1.93 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 32.39 2q7m h VAL 93 CO 0.08 0.20 0.44 0.03 0.02 0.00 0.00 177.57 178.34 2q7m h ARG 94 N 0.51 0.66 0.10 1.57 2.47 -1.29 0.52 114.38 118.92 2q7m h ARG 94 Ca 0.14 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.81 2q7m h ARG 94 Cb 0.14 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 2q7m h ARG 94 CO -0.02 0.43 -0.05 0.37 0.56 0.00 0.00 179.97 181.27 2q7m h GLN 95 N 0.67 -0.13 0.00 0.04 5.75 -1.29 0.47 115.11 120.63 2q7m h GLN 95 Ca 0.43 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.94 2q7m h GLN 95 Cb 0.53 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.11 2q7m h GLN 95 CO -0.32 0.15 0.00 1.63 -2.65 0.00 0.00 178.83 177.64 2q7m n LYS 96 N -5.02 0.13 -0.09 1.69 4.01 -0.20 -1.19 118.16 117.48 2q7m n LYS 96 Ca -0.08 0.28 -0.23 0.00 -0.51 0.00 0.00 58.31 57.77 2q7m n LYS 96 Cb 0.18 -1.71 -0.12 0.00 -0.51 0.00 0.00 35.03 32.88 2q7m n LYS 96 CO 0.00 0.00 0.00 0.98 -1.11 0.00 0.00 177.40 177.27 2q7m n TYR 97 N -1.93 0.81 0.39 2.13 9.36 0.18 -3.13 117.16 124.96 2q7m n TYR 97 Ca 0.04 0.30 0.08 0.00 3.32 0.00 0.00 57.90 61.63 2q7m n TYR 97 Cb 0.26 -1.09 0.35 0.00 -0.63 0.00 0.00 39.34 38.23 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 -4.14 0.30 -0.10 2.98 7.35 0.15 -1.90 117.46 122.10 2q7m n PHE 98 Ca -0.37 0.12 -0.17 0.00 -0.76 0.00 0.00 57.45 56.27 2q7m n PHE 98 Cb 0.81 -0.70 -0.08 0.00 0.35 0.00 0.00 39.48 39.86 2q7m n PHE 98 CO 0.00 0.00 0.00 1.55 -0.76 0.00 0.00 176.76 177.55 2q7m n VAL 99 N -1.78 1.50 0.30 -2.13 3.14 -0.33 -4.23 118.33 114.80 2q7m n VAL 99 Ca 0.02 0.02 0.18 0.00 -2.96 0.00 0.00 64.34 61.60 2q7m n VAL 99 Cb 0.16 -2.14 0.93 0.00 -1.06 0.00 0.00 33.84 31.74 2q7m n VAL 99 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2q7m h GLY 100 N -1.00 0.00 -3.54 7.55 0.00 -1.49 -2.72 103.07 101.87 2q7m h GLY 100 Ca -0.27 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.86 2q7m h GLY 100 CO -0.16 0.00 0.10 2.98 0.00 0.00 0.00 176.54 179.45 2q7m n TYR 101 N -3.31 0.66 -2.71 5.60 9.36 -0.80 -3.67 117.16 122.29 2q7m n TYR 101 Ca -0.02 -1.51 -0.07 0.00 3.32 0.00 0.00 57.90 59.62 2q7m n TYR 101 Cb 0.17 -0.97 0.10 0.00 -0.63 0.00 0.00 39.34 38.01 2q7m n TYR 101 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2q7m n LEU 102 N 1.28 -2.02 0.00 2.98 4.77 -1.02 -4.62 117.00 118.37 2q7m n LEU 102 Ca 0.24 -3.32 0.00 0.00 -0.03 0.00 0.00 56.01 52.90 2q7m n LEU 102 Cb 0.61 0.65 0.00 0.00 -2.33 0.00 0.00 43.42 42.36 2q7m n LEU 102 CO 0.18 1.91 0.00 0.61 -1.33 0.00 0.00 177.39 178.76 2q7m n GLY 103 N 0.02 4.39 1.80 -0.72 0.00 -1.24 -5.05 105.19 104.39 2q7m n GLY 103 Ca -0.00 -0.44 -0.20 0.00 0.00 0.00 0.00 46.02 45.38 2q7m n GLY 103 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2q7m n GLU 104 N 0.00 2.65 -4.18 1.61 4.07 -1.26 -4.94 120.64 118.59 2q7m n GLU 104 Ca 0.00 -3.53 -0.37 0.00 -0.06 0.00 0.00 57.16 53.20 2q7m n GLU 104 Cb 0.00 -2.11 -0.07 0.00 -0.06 0.00 0.00 31.44 29.20 2q7m n GLU 104 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 2q7m n ARG 105 N -0.94 -0.76 -2.03 5.31 0.00 -1.26 -4.88 116.66 112.10 2q7m n ARG 105 Ca 0.46 0.12 -0.32 0.00 -0.00 0.00 0.00 57.85 58.11 2q7m n ARG 105 Cb 0.96 -4.08 0.00 0.00 -0.00 0.00 0.00 32.46 29.34 2q7m n ARG 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2q7m s THR 106 N -3.08 4.23 -1.21 8.89 2.01 -1.26 -3.92 115.64 121.30 2q7m s THR 106 Ca 0.68 0.93 -0.01 0.00 0.31 0.00 0.00 61.69 63.60 2q7m s THR 106 Cb -0.40 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.53 2q7m s THR 106 CO 0.91 -0.74 0.91 0.00 -0.69 0.00 0.00 174.62 175.00 2q7m n GLN 107 N -2.24 -5.59 0.00 4.92 3.00 -1.26 -4.51 117.38 111.70 2q7m n GLN 107 Ca 0.07 0.78 0.00 0.00 -0.01 0.00 0.00 57.00 57.84 2q7m n GLN 107 Cb 0.54 -5.64 0.00 0.00 0.00 0.00 0.00 30.24 25.13 2q7m n GLN 107 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2q7m n SER 108 N -3.11 0.00 -3.61 1.08 7.64 -1.25 -5.01 113.62 109.35 2q7m n SER 108 Ca -0.27 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.54 2q7m n SER 108 Cb 0.67 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.81 2q7m n SER 108 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2q7m s THR 109 N 0.00 0.00 0.30 0.44 -1.32 -1.26 -4.86 115.64 108.94 2q7m s THR 109 Ca 0.00 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.20 2q7m s THR 109 Cb 0.00 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.90 2q7m s THR 109 CO 0.00 0.00 1.05 -2.16 -2.21 0.00 0.00 174.62 171.30 2q7m s PRO 110 N -0.73 4.59 0.08 7.08 0.04 -1.26 -5.04 135.00 139.76 2q7m s PRO 110 Ca 0.03 1.66 0.05 0.00 0.04 0.00 0.00 61.00 62.78 2q7m s PRO 110 Cb -0.02 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.42 2q7m s PRO 110 CO -0.04 0.21 -0.00 0.20 0.04 0.00 0.00 177.00 177.40 2q7m s GLY 111 N -1.10 1.91 0.55 0.56 0.00 -1.26 -4.99 107.32 102.98 2q7m s GLY 111 Ca 0.47 -1.10 0.29 0.00 0.00 0.00 0.00 44.72 44.37 2q7m s GLY 111 CO 0.36 -1.07 1.93 -1.82 0.00 0.00 0.00 173.10 172.50 2q7m h TYR 112 N 3.54 0.00 -0.13 1.90 3.20 -1.99 -3.42 116.97 120.07 2q7m h TYR 112 Ca -0.48 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.39 2q7m h TYR 112 Cb 1.17 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.44 2q7m h TYR 112 CO 0.61 0.00 0.00 -0.89 -1.64 0.00 0.00 178.16 176.24 2q7m n ILE 113 N -4.15 0.00 0.00 1.81 5.41 -1.26 -5.02 119.36 116.16 2q7m n ILE 113 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.88 2q7m n ILE 113 Cb 0.76 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.69 2q7m n ILE 113 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 2q7m n PHE 114 N -1.10 0.00 -3.87 1.39 -0.00 -1.26 -5.02 117.46 107.60 2q7m n PHE 114 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 57.45 57.19 2q7m n PHE 114 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 39.48 39.41 2q7m n PHE 114 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2q7m n GLY 115 N 0.00 -0.14 0.48 7.13 0.00 -1.26 -4.76 105.19 106.65 2q7m n GLY 115 Ca 0.00 0.12 0.32 0.00 0.00 0.00 0.00 46.02 46.46 2q7m n GLY 115 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q7m h LYS 116 N -1.03 0.16 0.02 1.61 1.57 -2.00 0.38 116.57 117.29 2q7m h LYS 116 Ca -0.49 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.29 2q7m h LYS 116 Cb 1.06 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 2q7m h LYS 116 CO 0.57 0.11 -0.11 -0.09 -0.57 0.00 0.00 179.45 179.36 2q7m h ARG 117 N 0.17 -0.19 0.31 3.15 2.43 -1.98 0.52 114.38 118.79 2q7m h ARG 117 Ca 0.66 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.83 2q7m h ARG 117 Cb 2.17 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.75 2q7m h ARG 117 CO -0.21 -0.13 -0.24 0.82 -1.51 0.00 0.00 179.97 178.70 2q7m h ILE 118 N -0.20 0.00 -0.66 1.20 2.04 -0.58 0.20 117.51 119.51 2q7m h ILE 118 Ca 0.03 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.01 2q7m h ILE 118 Cb 0.24 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.27 2q7m h ILE 118 CO -0.10 0.00 0.44 0.16 0.00 0.00 0.00 178.15 178.66 2q7m h ILE 119 N -0.53 0.88 0.20 -0.67 -2.65 -1.59 0.32 117.51 113.47 2q7m h ILE 119 Ca -0.04 -0.15 0.01 0.00 1.03 0.00 0.00 64.86 65.70 2q7m h ILE 119 Cb 0.44 0.39 -0.02 0.00 -2.05 0.00 0.00 36.82 35.58 2q7m h ILE 119 CO 0.01 0.08 -0.22 0.25 0.03 0.00 0.00 178.15 178.30 2q7m h LEU 120 N 0.45 -0.60 0.22 0.16 7.12 -0.49 0.24 115.31 122.41 2q7m h LEU 120 Ca 0.31 0.06 -0.01 0.00 0.13 0.00 0.00 57.88 58.37 2q7m h LEU 120 Cb 0.61 0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 40.95 2q7m h LEU 120 CO -0.09 -0.33 -0.12 0.15 -0.13 0.00 0.00 178.44 177.92 2q7m h PHE 121 N -0.47 -0.32 -0.98 1.25 3.57 0.21 -2.05 116.94 118.16 2q7m h PHE 121 Ca 0.00 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.61 2q7m h PHE 121 Cb 0.45 0.11 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 2q7m h PHE 121 CO -0.17 -0.20 0.62 -0.07 -2.23 0.00 0.00 178.31 176.27 2q7m h LEU 122 N -0.32 0.90 -2.19 0.59 4.07 -0.37 0.44 115.31 118.43 2q7m h LEU 122 Ca -0.03 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 2q7m h LEU 122 Cb 0.26 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 41.86 2q7m h LEU 122 CO 0.03 0.50 -0.03 0.15 -1.08 0.00 0.00 178.44 178.01 2q7m h PHE 123 N 0.98 0.00 0.00 1.13 3.04 -0.05 -1.62 116.94 120.42 2q7m h PHE 123 Ca 0.47 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.40 2q7m h PHE 123 Cb 0.45 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.96 2q7m h PHE 123 CO -0.00 0.03 -0.55 -0.07 -2.02 0.00 0.00 178.31 175.70 2q7m h LEU 124 N 0.00 0.00 0.10 0.59 4.07 0.57 -1.49 115.31 119.15 2q7m h LEU 124 Ca -0.00 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.68 2q7m h LEU 124 Cb 0.26 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.02 2q7m h LEU 124 CO 0.00 0.09 -1.24 0.24 -1.08 0.00 0.00 178.44 176.45 2q7m h MET 125 N 0.00 0.41 -0.14 1.13 2.86 -0.79 -0.88 114.93 117.52 2q7m h MET 125 Ca -0.01 -0.62 -0.01 0.00 -2.06 0.00 0.00 59.70 56.99 2q7m h MET 125 Cb 1.08 0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.96 2q7m h MET 125 CO 0.01 1.28 0.05 0.77 1.06 0.00 0.00 176.91 180.07 2q7m h SER 126 N 0.15 0.20 1.00 1.22 0.02 -1.40 -1.89 113.55 112.85 2q7m h SER 126 Ca -0.16 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2q7m h SER 126 Cb 1.94 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.43 2q7m h SER 126 CO 0.22 0.35 0.00 0.55 -1.14 0.00 0.00 176.83 176.81 2q7m n VAL 127 N -4.86 0.72 0.00 2.27 3.14 -0.56 -1.93 118.33 117.11 2q7m n VAL 127 Ca -0.05 0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 2q7m n VAL 127 Cb 0.14 -0.92 0.00 0.00 -1.06 0.00 0.00 33.84 31.99 2q7m n VAL 127 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2q7m n ALA 128 N -1.76 -0.11 -0.32 1.55 0.00 -0.34 -3.16 120.51 116.38 2q7m n ALA 128 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.61 2q7m n ALA 128 Cb 0.30 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.11 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 1.45 0.38 0.00 0.00 -1.24 0.45 103.07 104.11 2q7m h GLY 129 Ca 0.00 -0.32 0.15 0.00 0.00 0.00 0.00 47.33 47.15 2q7m h GLY 129 CO 0.00 0.02 0.62 1.19 0.00 0.00 0.00 176.54 178.37 2q7m h ILE 130 N 0.72 0.83 0.00 2.60 -0.00 -1.52 0.22 117.51 120.36 2q7m h ILE 130 Ca 0.51 -0.29 -0.02 0.00 -0.00 0.00 0.00 64.86 65.06 2q7m h ILE 130 Cb 0.84 -0.09 -0.00 0.00 -0.00 0.00 0.00 36.82 37.57 2q7m h ILE 130 CO -0.28 0.16 -0.20 0.15 -0.00 0.00 0.00 178.15 177.97 2q7m h PHE 131 N 0.85 0.00 -0.86 2.19 3.04 -1.01 -3.32 116.94 117.84 2q7m h PHE 131 Ca 0.51 0.00 0.25 0.00 3.98 0.00 0.00 57.97 62.71 2q7m h PHE 131 Cb 0.68 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.15 2q7m h PHE 131 CO -0.00 0.40 0.83 -2.95 -2.02 0.00 0.00 178.31 174.56 2q7m h ASN 132 N -1.00 0.00 -0.25 0.41 -1.07 -0.75 0.68 115.58 113.60 2q7m h ASN 132 Ca -0.03 0.00 -0.09 0.00 0.07 0.00 0.00 56.30 56.25 2q7m h ASN 132 Cb 0.46 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.71 2q7m h ASN 132 CO -0.02 0.00 -0.19 0.22 0.07 0.00 0.00 177.43 177.51 2q7m h TYR 133 N 0.00 0.68 -0.28 4.14 3.20 -0.69 -2.58 116.97 121.43 2q7m h TYR 133 Ca 0.41 -0.19 0.08 0.00 3.14 0.00 0.00 58.73 62.17 2q7m h TYR 133 Cb 2.06 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 40.17 2q7m h TYR 133 CO 0.00 0.87 0.28 1.88 -1.64 0.00 0.00 178.16 179.56 2q7m h TYR 134 N 0.29 0.00 0.10 -3.82 -1.99 0.28 -0.18 116.97 111.65 2q7m h TYR 134 Ca 0.05 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 2q7m h TYR 134 Cb 0.73 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.46 2q7m h TYR 134 CO 0.07 0.00 -0.05 -0.07 -0.00 0.00 0.00 178.16 178.11 2q7m h LEU 135 N 0.00 -0.12 -1.90 3.88 3.38 -1.30 0.28 115.31 119.53 2q7m h LEU 135 Ca 0.13 -0.39 0.27 0.00 0.09 0.00 0.00 57.88 57.98 2q7m h LEU 135 Cb 0.70 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 2q7m h LEU 135 CO -0.00 0.51 0.67 0.40 0.09 0.00 0.00 178.44 180.11 2q7m h ILE 136 N -0.94 0.54 0.02 1.22 2.04 -0.96 0.38 117.51 119.81 2q7m h ILE 136 Ca -0.01 -0.02 -0.19 0.00 1.00 0.00 0.00 64.86 65.63 2q7m h ILE 136 Cb 0.50 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2q7m h ILE 136 CO 0.02 0.01 -1.03 0.15 0.00 0.00 0.00 178.15 177.31 2q7m h PHE 137 N 0.07 0.06 0.00 1.37 3.57 -1.06 -3.35 116.94 117.61 2q7m h PHE 137 Ca 0.46 -0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.82 2q7m h PHE 137 Cb 1.73 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.45 2q7m h PHE 137 CO -0.00 1.40 -0.47 0.74 -2.23 0.00 0.00 178.31 177.75 2q7m h PHE 138 N -0.90 0.00 -1.80 0.41 -1.00 0.39 -3.20 116.94 110.84 2q7m h PHE 138 Ca -0.27 0.00 -0.65 0.00 2.81 0.00 0.00 57.97 59.86 2q7m h PHE 138 Cb 1.31 0.00 -0.37 0.00 3.61 0.00 0.00 35.95 40.50 2q7m h PHE 138 CO 0.14 0.47 -0.12 1.19 -1.61 0.00 0.00 178.31 178.37 2q7m n PHE 139 N -3.79 3.35 0.25 -0.55 3.72 0.13 -4.40 117.46 116.17 2q7m n PHE 139 Ca -0.01 -2.99 0.09 0.00 -0.05 0.00 0.00 57.45 54.49 2q7m n PHE 139 Cb 0.52 -0.50 0.15 0.00 -0.94 0.00 0.00 39.48 38.71 2q7m n PHE 139 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2q7m n GLY 140 N -0.44 1.42 0.10 1.37 0.00 -1.21 -4.48 105.19 101.96 2q7m n GLY 140 Ca 0.42 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2q7m n GLY 140 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2q7m n SER 141 N 1.04 0.06 -1.82 1.61 3.41 -1.26 -4.15 113.62 112.51 2q7m n SER 141 Ca 0.14 -0.62 -0.01 0.00 -0.26 0.00 0.00 58.87 58.11 2q7m n SER 141 Cb 0.48 -0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.38 2q7m n SER 141 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2q7m n ASP 142 N -0.34 2.99 0.30 4.04 5.75 -1.26 -4.30 116.55 123.74 2q7m n ASP 142 Ca 0.00 -1.84 0.17 0.00 -0.01 0.00 0.00 54.79 53.11 2q7m n ASP 142 Cb 0.02 -0.67 0.97 0.00 -1.03 0.00 0.00 41.12 40.41 2q7m n ASP 142 CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 2q7m h PHE 143 N 2.72 0.00 -4.65 2.11 -5.15 -1.99 -3.48 116.94 106.50 2q7m h PHE 143 Ca 0.02 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 2q7m h PHE 143 Cb 0.62 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.79 2q7m h PHE 143 CO 0.57 0.02 -0.10 -0.85 -2.00 0.00 0.00 178.31 175.95 2q7m n GLU 144 N -3.60 -0.76 -1.68 6.09 0.28 -1.26 -4.69 120.64 115.01 2q7m n GLU 144 Ca -0.03 0.64 -0.50 0.00 -0.16 0.00 0.00 57.16 57.10 2q7m n GLU 144 Cb 0.10 -0.94 -0.05 0.00 1.43 0.00 0.00 31.44 31.98 2q7m n GLU 144 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2q7m n ASN 145 N 2.13 3.19 -4.75 -1.84 5.15 -1.26 -4.94 115.26 112.94 2q7m n ASN 145 Ca -0.01 0.97 -0.40 0.00 -0.60 0.00 0.00 54.58 54.55 2q7m n ASN 145 Cb 0.02 -1.32 -0.05 0.00 -0.53 0.00 0.00 39.78 37.90 2q7m n ASN 145 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 2q7m s TYR 146 N 4.11 3.73 -0.71 1.20 -0.85 -1.26 -4.91 117.35 118.66 2q7m s TYR 146 Ca 0.95 1.42 0.07 0.00 -0.52 0.00 0.00 57.07 58.99 2q7m s TYR 146 Cb -0.78 -2.78 0.12 0.00 0.38 0.00 0.00 41.96 38.90 2q7m s TYR 146 CO 0.55 0.29 0.94 1.51 -1.52 0.00 0.00 175.55 177.32 2q7m n ILE 147 N 2.79 0.51 -0.63 -3.49 0.13 -1.26 -5.08 119.36 112.33 2q7m n ILE 147 Ca -0.03 -0.75 0.00 0.00 -1.10 0.00 0.00 62.75 60.86 2q7m n ILE 147 Cb 0.50 0.82 0.00 0.00 -0.84 0.00 0.00 39.64 40.12 2q7m n ILE 147 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2q7m n ALA 148 N 0.25 0.00 -1.91 1.51 0.00 -1.26 -5.38 120.51 113.72 2q7m n ALA 148 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2q7m n ALA 148 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2q7m n ALA 148 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91