#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbh n THR 2 N 0.00 1.90 -0.24 0.00 -2.24 -1.26 -4.70 114.28 107.73 2qbh n THR 2 Ca 0.00 -0.50 -0.06 0.00 -2.27 0.00 0.00 64.05 61.22 2qbh n THR 2 Cb 0.00 -0.42 -0.06 0.00 -2.10 0.00 0.00 70.33 67.75 2qbh n THR 2 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2qbh n VAL 3 N -0.10 -0.39 -0.33 2.28 0.31 -1.26 -0.36 118.33 118.47 2qbh n VAL 3 Ca 0.14 1.83 0.08 0.00 -0.01 0.00 0.00 64.34 66.38 2qbh n VAL 3 Cb 0.30 -2.30 0.18 0.00 -0.91 0.00 0.00 33.84 31.11 2qbh n VAL 3 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2qbh n ASN 4 N -4.35 -0.26 -0.10 4.52 4.13 -1.26 -0.95 115.26 116.99 2qbh n ASN 4 Ca 0.01 1.61 -0.13 0.00 1.68 0.00 0.00 54.58 57.75 2qbh n ASN 4 Cb 0.15 -0.52 -0.08 0.00 -1.54 0.00 0.00 39.78 37.79 2qbh n ASN 4 CO 0.00 0.00 0.00 1.56 0.28 0.00 0.00 177.26 179.10 2qbh h GLN 5 N 0.00 -0.42 -0.89 3.52 4.20 -1.01 -0.69 115.11 119.82 2qbh h GLN 5 Ca 0.49 0.03 0.04 0.00 0.06 0.00 0.00 58.65 59.27 2qbh h GLN 5 Cb 0.84 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.67 2qbh h GLN 5 CO -0.94 -0.28 0.59 -0.07 -0.67 0.00 0.00 178.83 177.46 2qbh h LEU 6 N -0.43 0.95 -1.45 1.46 3.38 -1.04 0.49 115.31 118.67 2qbh h LEU 6 Ca 0.08 -0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.25 2qbh h LEU 6 Cb 0.62 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 2qbh h LEU 6 CO -0.55 0.64 0.60 0.58 0.09 0.00 0.00 178.44 179.81 2qbh h VAL 7 N 1.09 0.68 0.00 1.22 2.07 -0.46 0.52 116.25 121.37 2qbh h VAL 7 Ca 0.36 -0.15 -0.23 0.00 0.82 0.00 0.00 66.70 67.50 2qbh h VAL 7 Cb 0.06 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 29.98 2qbh h VAL 7 CO -0.11 0.08 -1.62 0.54 0.02 0.00 0.00 177.57 176.47 2qbh n ARG 8 N -4.54 0.63 -3.28 1.57 1.74 -0.54 -4.67 116.66 107.57 2qbh n ARG 8 Ca 0.20 0.23 -0.22 0.00 -0.77 0.00 0.00 57.85 57.28 2qbh n ARG 8 Cb 0.69 -1.77 -0.08 0.00 -1.02 0.00 0.00 32.46 30.27 2qbh n ARG 8 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2qbh s LYS 9 N -2.77 0.88 1.03 5.56 2.47 0.07 -5.12 119.74 121.85 2qbh s LYS 9 Ca -0.04 -1.76 -0.15 0.00 -1.56 0.00 0.00 55.97 52.47 2qbh s LYS 9 Cb 0.08 -1.10 0.16 0.00 -1.46 0.00 0.00 37.83 35.51 2qbh s LYS 9 CO 0.82 -1.35 0.25 -2.30 0.16 0.00 0.00 175.35 172.94 2qbh n PRO 10 N 3.08 -2.20 -2.62 4.03 -0.02 0.16 -4.20 135.00 133.22 2qbh n PRO 10 Ca 0.25 -0.65 -0.43 0.00 -2.02 0.00 0.00 63.50 60.65 2qbh n PRO 10 Cb 0.48 -1.49 -0.02 0.00 -0.02 0.00 0.00 33.50 32.45 2qbh n PRO 10 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qbh s ARG 11 N -3.46 4.33 -0.09 -0.52 1.81 -1.26 -4.98 118.95 114.79 2qbh s ARG 11 Ca 0.39 1.44 -0.30 0.00 -1.72 0.00 0.00 55.73 55.54 2qbh s ARG 11 Cb -0.06 -3.60 -0.02 0.00 -0.45 0.00 0.00 34.95 30.82 2qbh s ARG 11 CO 0.38 -0.49 1.03 0.00 -0.68 0.00 0.00 175.30 175.53 2qbh s ALA 12 N 2.64 3.39 0.00 2.13 0.00 -1.26 -5.02 121.76 123.64 2qbh s ALA 12 Ca 0.48 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.86 2qbh s ALA 12 Cb -0.18 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2qbh s ALA 12 CO 0.13 -0.58 0.00 0.54 0.00 0.00 0.00 175.76 175.85 2qbh n ARG 13 N 4.91 0.00 -3.24 0.00 5.12 -1.26 -5.11 116.66 117.08 2qbh n ARG 13 Ca 0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.01 2qbh n ARG 13 Cb 0.49 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.79 2qbh n ARG 13 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 2qbh n LYS 14 N 0.00 -0.84 -2.70 5.56 0.00 -1.26 -5.07 118.16 113.84 2qbh n LYS 14 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 2qbh n LYS 14 Cb 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 35.03 35.13 2qbh n LYS 14 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2qbh n VAL 15 N 2.13 0.33 -1.42 0.58 0.24 -1.26 -5.11 118.33 113.82 2qbh n VAL 15 Ca 0.00 -1.83 -0.62 0.00 -2.04 0.00 0.00 64.34 59.85 2qbh n VAL 15 Cb 0.00 0.97 -0.11 0.00 -1.47 0.00 0.00 33.84 33.23 2qbh n VAL 15 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qbh n ALA 16 N -0.73 -0.40 -1.40 2.33 0.00 -1.26 -4.90 120.51 114.15 2qbh n ALA 16 Ca -0.03 0.31 -0.17 0.00 0.00 0.00 0.00 53.44 53.54 2qbh n ALA 16 Cb 0.85 -1.97 0.19 0.00 0.00 0.00 0.00 19.45 18.52 2qbh n ALA 16 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qbh n LYS 17 N 5.96 -1.95 -3.41 0.00 -0.00 -1.26 -5.03 118.16 112.47 2qbh n LYS 17 Ca 0.44 -1.57 -0.38 0.00 -0.00 0.00 0.00 58.31 56.80 2qbh n LYS 17 Cb -0.05 -1.25 -0.06 0.00 -0.00 0.00 0.00 35.03 33.67 2qbh n LYS 17 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2qbh s SER 18 N -4.47 6.78 0.09 -5.58 0.15 -1.26 -4.95 113.70 104.46 2qbh s SER 18 Ca 0.61 0.93 0.14 0.00 0.70 0.00 0.00 55.95 58.33 2qbh s SER 18 Cb -0.04 -2.27 0.62 0.00 -1.71 0.00 0.00 66.02 62.62 2qbh s SER 18 CO 0.44 0.20 1.44 0.59 1.20 0.00 0.00 173.24 177.11 2qbh n ASN 19 N 2.52 0.20 -3.41 5.45 5.03 -1.26 -4.31 115.26 119.47 2qbh n ASN 19 Ca -0.11 0.56 -0.16 0.00 0.87 0.00 0.00 54.58 55.74 2qbh n ASN 19 Cb 0.52 -0.60 -0.10 0.00 -1.02 0.00 0.00 39.78 38.58 2qbh n ASN 19 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2qbh s VAL 20 N -3.12 -0.43 -0.91 2.41 -7.23 -1.26 -4.94 120.40 104.92 2qbh s VAL 20 Ca 0.04 -0.31 -0.17 0.00 -1.81 0.00 0.00 61.98 59.73 2qbh s VAL 20 Cb 0.07 -0.87 -0.11 0.00 0.56 0.00 0.00 36.38 36.03 2qbh s VAL 20 CO 0.23 -0.33 2.03 -0.81 -0.31 0.00 0.00 175.10 175.91 2qbh n PRO 21 N 5.32 1.85 -0.04 4.82 -0.04 -1.26 -4.58 135.00 141.07 2qbh n PRO 21 Ca -0.03 -1.86 0.01 0.00 -0.04 0.00 0.00 63.50 61.57 2qbh n PRO 21 Cb 0.48 -2.86 0.02 0.00 -0.04 0.00 0.00 33.50 31.11 2qbh n PRO 21 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qbh n ALA 22 N 6.48 2.53 -0.92 0.55 0.00 -1.26 -4.99 120.51 122.90 2qbh n ALA 22 Ca 0.49 -0.10 0.08 0.00 0.00 0.00 0.00 53.44 53.91 2qbh n ALA 22 Cb 0.34 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.75 2qbh n ALA 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2qbh n LEU 23 N -0.19 -0.45 -1.26 0.00 7.94 -1.26 -4.05 117.00 117.72 2qbh n LEU 23 Ca 0.02 1.04 0.00 0.00 -1.11 0.00 0.00 56.01 55.95 2qbh n LEU 23 Cb 0.15 -2.38 0.00 0.00 0.53 0.00 0.00 43.42 41.73 2qbh n LEU 23 CO 0.02 -1.04 0.00 -0.62 -1.11 0.00 0.00 177.39 174.64 2qbh n GLU 24 N -3.47 -1.36 -3.97 1.96 1.02 -1.26 -0.17 120.64 113.39 2qbh n GLU 24 Ca -0.04 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.78 2qbh n GLU 24 Cb 0.37 -3.98 -0.01 0.00 -0.02 0.00 0.00 31.44 27.80 2qbh n GLU 24 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qbh n ALA 25 N -1.26 -1.22 -2.02 0.62 0.00 -1.26 -4.90 120.51 110.47 2qbh n ALA 25 Ca 0.00 0.07 -0.40 0.00 0.00 0.00 0.00 53.44 53.11 2qbh n ALA 25 Cb 0.10 -3.68 -0.05 0.00 0.00 0.00 0.00 19.45 15.81 2qbh n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbh h PRO 27 N 4.74 0.00 -3.03 0.00 0.13 -1.90 -3.46 132.00 128.48 2qbh h PRO 27 Ca -0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.56 2qbh h PRO 27 Cb 1.20 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.13 2qbh h PRO 27 CO 0.69 0.45 -0.28 1.14 -0.23 0.00 0.00 178.00 179.76 2qbh s GLN 28 N -3.86 0.64 -0.00 0.86 0.00 -1.26 -4.55 119.66 111.48 2qbh s GLN 28 Ca -0.02 -0.14 0.04 0.00 -0.00 0.00 0.00 55.36 55.24 2qbh s GLN 28 Cb 0.13 0.28 -0.01 0.00 0.00 0.00 0.00 33.01 33.41 2qbh s GLN 28 CO 0.72 -0.17 -0.12 0.15 0.00 0.00 0.00 175.29 175.88 2qbh s LYS 29 N -1.19 0.94 -0.12 9.60 -0.14 -1.21 -4.91 119.74 122.71 2qbh s LYS 29 Ca -0.12 -0.47 -0.21 0.00 -1.36 0.00 0.00 55.97 53.80 2qbh s LYS 29 Cb -0.05 -0.91 -0.04 0.00 -1.68 0.00 0.00 37.83 35.16 2qbh s LYS 29 CO 0.04 0.24 0.60 0.50 -0.76 0.00 0.00 175.35 175.97 2qbh s ARG 30 N -0.43 4.35 0.53 1.68 3.52 -1.26 -0.83 118.95 126.51 2qbh s ARG 30 Ca 0.04 0.66 0.01 0.00 -0.13 0.00 0.00 55.73 56.31 2qbh s ARG 30 Cb -0.05 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.87 2qbh s ARG 30 CO -0.00 0.03 0.08 0.20 -0.81 0.00 0.00 175.30 174.79 2qbh s GLY 31 N 0.83 2.97 -0.01 8.12 0.00 -0.24 -0.65 107.32 118.34 2qbh s GLY 31 Ca 0.31 -0.31 0.06 0.00 0.00 0.00 0.00 44.72 44.78 2qbh s GLY 31 CO 0.13 -2.17 0.17 -0.62 0.00 0.00 0.00 173.10 170.61 2qbh n VAL 32 N -1.39 0.00 -2.52 1.40 0.31 -0.90 -3.03 118.33 112.20 2qbh n VAL 32 Ca -0.18 -0.19 -0.03 0.00 -0.01 0.00 0.00 64.34 63.93 2qbh n VAL 32 Cb 0.67 0.48 -0.03 0.00 -0.91 0.00 0.00 33.84 34.04 2qbh n VAL 32 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbh h THR 34 N 3.35 0.00 -1.20 0.00 1.35 0.48 -3.39 112.91 113.51 2qbh h THR 34 Ca -0.33 -0.70 0.28 0.00 -0.55 0.00 0.00 66.41 65.11 2qbh h THR 34 Cb 0.75 1.68 -0.22 0.00 -1.73 0.00 0.00 68.15 68.64 2qbh h THR 34 CO 0.04 0.00 0.91 -0.60 -0.25 0.00 0.00 175.52 175.62 2qbh s ARG 35 N -3.23 0.13 -0.14 4.72 6.06 -0.76 -4.99 118.95 120.75 2qbh s ARG 35 Ca 0.07 -0.03 0.02 0.00 -2.50 0.00 0.00 55.73 53.29 2qbh s ARG 35 Cb 0.08 0.06 0.00 0.00 0.06 0.00 0.00 34.95 35.16 2qbh s ARG 35 CO 0.61 -0.06 -0.19 0.14 -2.50 0.00 0.00 175.30 173.30 2qbh s VAL 36 N -1.94 2.35 0.31 7.11 -7.23 -1.26 -0.28 120.40 119.46 2qbh s VAL 36 Ca 0.10 -0.89 0.02 0.00 -1.81 0.00 0.00 61.98 59.41 2qbh s VAL 36 Cb -0.01 -1.96 0.02 0.00 0.56 0.00 0.00 36.38 34.99 2qbh s VAL 36 CO -0.04 0.54 0.19 -1.22 -0.31 0.00 0.00 175.10 174.26 2qbh n TYR 37 N 3.94 -0.74 -2.75 2.82 4.01 -0.77 -4.91 117.16 118.77 2qbh n TYR 37 Ca -0.19 -1.33 -0.09 0.00 -0.16 0.00 0.00 57.90 56.13 2qbh n TYR 37 Cb 0.52 -0.24 0.09 0.00 -0.31 0.00 0.00 39.34 39.40 2qbh n TYR 37 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2qbh n THR 38 N -1.15 0.00 -1.51 -0.72 -2.24 -1.26 -2.39 114.28 105.02 2qbh n THR 38 Ca -0.03 -1.67 -0.31 0.00 -2.27 0.00 0.00 64.05 59.77 2qbh n THR 38 Cb 0.35 1.31 0.06 0.00 -2.10 0.00 0.00 70.33 69.96 2qbh n THR 38 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2qbh s THR 39 N 0.08 3.66 0.24 4.28 -4.23 -1.23 -4.81 115.64 113.63 2qbh s THR 39 Ca 0.23 0.58 -0.19 0.00 -1.18 0.00 0.00 61.69 61.13 2qbh s THR 39 Cb 0.31 -3.18 -0.08 0.00 1.34 0.00 0.00 72.50 70.89 2qbh s THR 39 CO -0.06 -0.66 0.74 0.42 -0.54 0.00 0.00 174.62 174.51 2qbh s THR 40 N -2.87 4.57 0.11 3.99 -4.23 -1.26 -3.72 115.64 112.23 2qbh s THR 40 Ca 0.61 1.25 -0.02 0.00 -1.18 0.00 0.00 61.69 62.35 2qbh s THR 40 Cb -0.16 -3.82 0.03 0.00 1.34 0.00 0.00 72.50 69.89 2qbh s THR 40 CO 0.52 0.14 0.09 -0.81 -0.54 0.00 0.00 174.62 174.02 2qbh n PRO 41 N 0.54 -1.60 -0.48 3.99 -0.04 -1.26 -4.92 135.00 131.22 2qbh n PRO 41 Ca -0.01 -0.14 -0.09 0.00 -0.04 0.00 0.00 63.50 63.21 2qbh n PRO 41 Cb 0.51 -0.15 0.07 0.00 -0.04 0.00 0.00 33.50 33.89 2qbh n PRO 41 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2qbh n LYS 42 N -2.00 -0.90 -0.06 0.54 4.76 -0.68 -4.91 118.16 114.91 2qbh n LYS 42 Ca 0.01 -0.60 -0.08 0.00 -2.87 0.00 0.00 58.31 54.78 2qbh n LYS 42 Cb 0.05 -0.46 -0.05 0.00 -1.84 0.00 0.00 35.03 32.73 2qbh n LYS 42 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 2qbh h LYS 43 N 0.00 -0.23 -0.17 1.97 2.10 -1.97 -3.22 116.57 115.05 2qbh h LYS 43 Ca -0.13 0.02 0.03 0.00 -2.00 0.00 0.00 60.65 58.57 2qbh h LYS 43 Cb 0.38 0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 31.72 2qbh h LYS 43 CO 0.09 -0.15 -0.04 -1.00 -2.00 0.00 0.00 179.45 176.35 2qbh h PRO 44 N -0.24 0.00 0.00 0.07 0.13 -2.02 -3.45 132.00 126.51 2qbh h PRO 44 Ca 0.03 -0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.92 2qbh h PRO 44 Cb 0.33 -0.00 0.07 0.00 0.13 0.00 0.00 31.00 31.52 2qbh h PRO 44 CO -0.30 0.00 0.13 0.09 -0.23 0.00 0.00 178.00 177.70 2qbh n ASN 45 N -5.18 0.45 -3.59 1.44 5.03 -1.22 -5.12 115.26 107.07 2qbh n ASN 45 Ca -0.03 -1.47 -0.02 0.00 0.87 0.00 0.00 54.58 53.94 2qbh n ASN 45 Cb 0.11 -0.43 -0.06 0.00 -1.02 0.00 0.00 39.78 38.38 2qbh n ASN 45 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2qbh s SER 46 N -3.38 -0.56 0.00 6.41 0.15 -1.26 -4.63 113.70 110.43 2qbh s SER 46 Ca 0.38 0.86 0.00 0.00 0.70 0.00 0.00 55.95 57.89 2qbh s SER 46 Cb -0.02 1.35 0.00 0.00 -1.71 0.00 0.00 66.02 65.65 2qbh s SER 46 CO 0.26 -0.13 0.00 0.00 1.20 0.00 0.00 173.24 174.57 2qbh n ALA 47 N 4.08 0.00 -2.46 5.45 0.00 -1.26 -4.98 120.51 121.34 2qbh n ALA 47 Ca -0.16 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.09 2qbh n ALA 47 Cb 0.56 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.03 2qbh n ALA 47 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qbh n LEU 48 N 0.00 3.65 -4.30 0.00 4.77 -1.26 -4.13 117.00 115.73 2qbh n LEU 48 Ca 0.00 -4.51 -0.57 0.00 -0.03 0.00 0.00 56.01 50.90 2qbh n LEU 48 Cb 0.00 -0.12 -0.08 0.00 -2.33 0.00 0.00 43.42 40.89 2qbh n LEU 48 CO 0.00 1.91 0.59 0.54 -1.33 0.00 0.00 177.39 179.10 2qbh n ARG 49 N -0.45 0.00 -3.17 3.23 3.00 -1.24 -4.77 116.66 113.26 2qbh n ARG 49 Ca 0.30 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.72 2qbh n ARG 49 Cb 0.78 -1.43 -0.07 0.00 0.00 0.00 0.00 32.46 31.75 2qbh n ARG 49 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2qbh s LYS 50 N 0.23 3.75 0.00 5.56 1.02 -1.26 -3.56 119.74 125.48 2qbh s LYS 50 Ca 0.88 0.07 0.00 0.00 0.02 0.00 0.00 55.97 56.93 2qbh s LYS 50 Cb -1.23 -3.77 0.00 0.00 -0.52 0.00 0.00 37.83 32.31 2qbh s LYS 50 CO 0.56 -0.62 0.00 0.28 -0.92 0.00 0.00 175.35 174.65 2qbh n VAL 51 N 5.44 0.00 -3.37 3.17 0.31 -1.00 -1.87 118.33 121.01 2qbh n VAL 51 Ca -0.03 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.34 2qbh n VAL 51 Cb 0.49 -0.23 -0.05 0.00 -0.91 0.00 0.00 33.84 33.14 2qbh n VAL 51 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbh s ARG 53 N 1.59 3.72 0.59 0.00 3.52 0.61 -3.04 118.95 125.94 2qbh s ARG 53 Ca -0.03 0.68 0.04 0.00 -0.13 0.00 0.00 55.73 56.29 2qbh s ARG 53 Cb -0.01 -3.92 0.07 0.00 -1.56 0.00 0.00 34.95 29.54 2qbh s ARG 53 CO -0.13 -1.38 0.82 0.08 -0.81 0.00 0.00 175.30 173.87 2qbh s VAL 54 N 4.59 2.41 -0.43 7.11 1.01 -0.92 0.10 120.40 134.27 2qbh s VAL 54 Ca 0.50 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.73 2qbh s VAL 54 Cb -0.09 -2.62 0.16 0.00 0.00 0.00 0.00 36.38 33.84 2qbh s VAL 54 CO 0.31 0.00 0.33 -0.60 0.00 0.00 0.00 175.10 175.14 2qbh s ARG 55 N -4.79 1.03 1.12 2.72 3.52 -1.26 -3.89 118.95 117.41 2qbh s ARG 55 Ca 0.61 -2.11 -0.18 0.00 -0.13 0.00 0.00 55.73 53.92 2qbh s ARG 55 Cb -0.07 -1.66 0.12 0.00 -1.56 0.00 0.00 34.95 31.78 2qbh s ARG 55 CO 0.40 -1.34 0.06 1.28 -0.81 0.00 0.00 175.30 174.89 2qbh n LEU 56 N 2.98 -2.14 -0.08 -0.88 4.77 -1.19 -2.12 117.00 118.35 2qbh n LEU 56 Ca 0.25 -0.20 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 2qbh n LEU 56 Cb 0.44 -0.92 -0.05 0.00 -2.33 0.00 0.00 43.42 40.56 2qbh n LEU 56 CO 0.12 -3.14 0.55 0.71 -1.33 0.00 0.00 177.39 174.30 2qbh h THR 57 N -2.23 1.31 0.00 -5.08 1.35 -1.25 -3.01 112.91 104.01 2qbh h THR 57 Ca -0.49 -1.48 0.00 0.00 -0.55 0.00 0.00 66.41 63.90 2qbh h THR 57 Cb 1.27 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 2qbh h THR 57 CO 0.34 0.46 0.00 -0.55 -0.25 0.00 0.00 175.52 175.52 2qbh h ASN 58 N 0.35 0.00 -0.45 5.36 7.08 -1.92 -3.46 115.58 122.55 2qbh h ASN 58 Ca 0.03 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.25 2qbh h ASN 58 Cb 0.87 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.11 2qbh h ASN 58 CO 0.07 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 176.03 2qbh n GLY 59 N -1.03 0.70 2.92 9.14 0.00 -1.14 -5.14 105.19 110.64 2qbh n GLY 59 Ca -0.02 -0.68 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 2qbh n GLY 59 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qbh s PHE 60 N -2.15 0.13 -0.94 1.61 0.40 -1.26 -5.00 117.98 110.77 2qbh s PHE 60 Ca 0.00 -0.19 -0.01 0.00 -0.60 0.00 0.00 56.93 56.13 2qbh s PHE 60 Cb 0.00 -0.09 0.33 0.00 0.51 0.00 0.00 43.02 43.77 2qbh s PHE 60 CO 0.00 -0.06 1.88 0.39 0.70 0.00 0.00 175.22 178.13 2qbh n GLU 61 N 2.56 4.33 -2.31 0.44 -0.58 -1.26 -3.14 120.64 120.68 2qbh n GLU 61 Ca -0.16 -4.22 -0.27 0.00 -0.42 0.00 0.00 57.16 52.09 2qbh n GLU 61 Cb 0.58 -2.38 0.16 0.00 -0.57 0.00 0.00 31.44 29.22 2qbh n GLU 61 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2qbh s VAL 62 N -4.65 2.02 0.34 2.62 -7.23 -1.25 -4.89 120.40 107.36 2qbh s VAL 62 Ca 0.44 -0.34 0.04 0.00 -1.81 0.00 0.00 61.98 60.32 2qbh s VAL 62 Cb 0.29 -2.68 -0.07 0.00 0.56 0.00 0.00 36.38 34.49 2qbh s VAL 62 CO -0.24 0.00 0.05 0.42 -0.31 0.00 0.00 175.10 175.02 2qbh s THR 63 N -3.53 1.34 -0.21 5.32 -4.23 -1.26 -2.16 115.64 110.92 2qbh s THR 63 Ca 0.72 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.96 2qbh s THR 63 Cb -0.03 -2.83 0.08 0.00 1.34 0.00 0.00 72.50 71.05 2qbh s THR 63 CO 0.49 0.00 0.74 -0.94 -0.54 0.00 0.00 174.62 174.37 2qbh s SER 64 N -3.53 -0.69 0.25 3.99 1.04 -1.17 -3.60 113.70 109.98 2qbh s SER 64 Ca 0.36 1.17 -0.21 0.00 0.48 0.00 0.00 55.95 57.76 2qbh s SER 64 Cb 0.09 1.13 -0.09 0.00 0.10 0.00 0.00 66.02 67.26 2qbh s SER 64 CO 0.16 -0.35 0.77 -0.47 0.98 0.00 0.00 173.24 174.33 2qbh s TYR 65 N -0.11 3.65 -0.74 5.02 5.04 -0.87 -2.83 117.35 126.50 2qbh s TYR 65 Ca -0.03 1.46 -0.10 0.00 -2.44 0.00 0.00 57.07 55.97 2qbh s TYR 65 Cb -0.03 -2.68 0.19 0.00 0.35 0.00 0.00 41.96 39.79 2qbh s TYR 65 CO 0.03 0.30 0.63 0.42 -1.34 0.00 0.00 175.55 175.59 2qbh s ILE 66 N -1.56 4.86 0.95 3.14 1.09 -0.78 -1.22 121.20 127.69 2qbh s ILE 66 Ca 0.45 -2.62 -0.12 0.00 -1.10 0.00 0.00 60.65 57.25 2qbh s ILE 66 Cb -0.17 -4.06 0.09 0.00 -1.06 0.00 0.00 42.46 37.26 2qbh s ILE 66 CO 0.21 -0.96 0.69 0.61 -0.10 0.00 0.00 174.94 175.39 2qbh n GLY 67 N 3.83 -1.41 0.35 6.18 0.00 -1.26 -4.79 105.19 108.09 2qbh n GLY 67 Ca 0.10 -0.75 0.04 0.00 0.00 0.00 0.00 46.02 45.42 2qbh n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbh n GLY 68 N 1.04 -2.77 3.74 -0.02 0.00 -1.26 -4.89 105.19 101.03 2qbh n GLY 68 Ca 0.08 -1.35 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 2qbh n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qbh s GLU 69 N -3.26 4.50 0.23 1.61 8.01 -1.26 -4.82 118.70 123.72 2qbh s GLU 69 Ca 0.00 1.08 0.00 0.00 0.01 0.00 0.00 54.97 56.06 2qbh s GLU 69 Cb 0.00 -3.38 0.00 0.00 -4.31 0.00 0.00 34.13 26.44 2qbh s GLU 69 CO 0.00 0.24 0.00 0.41 0.01 0.00 0.00 175.26 175.92 2qbh n GLY 70 N 2.48 -4.91 0.00 -1.39 0.00 -1.26 -4.80 105.19 95.32 2qbh n GLY 70 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2qbh n GLY 70 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2qbh n HIS 71 N 0.98 0.00 -2.03 1.61 1.44 -1.26 -4.78 115.22 111.18 2qbh n HIS 71 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2qbh n HIS 71 Cb 0.00 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.11 2qbh n HIS 71 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 2qbh n ASN 72 N -1.13 0.04 -4.68 4.39 6.94 -1.26 -5.04 115.26 114.52 2qbh n ASN 72 Ca 0.00 -1.77 -0.43 0.00 -0.02 0.00 0.00 54.58 52.37 2qbh n ASN 72 Cb 0.00 -0.15 -0.02 0.00 -2.36 0.00 0.00 39.78 37.25 2qbh n ASN 72 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2qbh s LEU 73 N 0.00 4.24 0.00 -4.53 1.43 -1.26 -4.89 118.68 113.67 2qbh s LEU 73 Ca 0.02 1.71 0.00 0.00 -1.03 0.00 0.00 54.13 54.83 2qbh s LEU 73 Cb 0.02 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.69 2qbh s LEU 73 CO -0.01 -0.61 0.00 0.00 0.23 0.00 0.00 176.35 175.96 2qbh n GLN 74 N 5.58 3.93 0.00 1.70 6.02 -1.26 -4.92 117.38 128.43 2qbh n GLN 74 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2qbh n GLN 74 Cb 0.46 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.72 2qbh n GLN 74 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2qbh n GLU 75 N 0.00 0.00 -3.46 -1.09 4.07 -1.26 -4.00 120.64 114.90 2qbh n GLU 75 Ca 0.00 0.49 -0.41 0.00 -0.06 0.00 0.00 57.16 57.18 2qbh n GLU 75 Cb 0.00 -1.39 -0.03 0.00 -0.06 0.00 0.00 31.44 29.96 2qbh n GLU 75 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 2qbh s HIS 76 N -2.57 4.13 -0.20 4.31 3.76 -1.26 -4.35 115.29 119.11 2qbh s HIS 76 Ca 0.00 -2.84 -0.01 0.00 -0.15 0.00 0.00 55.06 52.06 2qbh s HIS 76 Cb 0.00 -3.59 0.01 0.00 1.11 0.00 0.00 32.58 30.11 2qbh s HIS 76 CO 0.00 -0.86 -0.14 -1.12 -0.85 0.00 0.00 174.74 171.77 2qbh s SER 77 N 0.70 3.60 -0.25 1.40 0.01 -0.93 -5.03 113.70 113.20 2qbh s SER 77 Ca 0.29 -0.59 -0.29 0.00 1.31 0.00 0.00 55.95 56.67 2qbh s SER 77 Cb -0.09 -1.58 -0.01 0.00 0.21 0.00 0.00 66.02 64.56 2qbh s SER 77 CO -0.10 -0.02 1.31 -0.69 0.41 0.00 0.00 173.24 174.15 2qbh s VAL 78 N 1.35 4.17 0.44 3.43 1.01 -1.26 -3.77 120.40 125.76 2qbh s VAL 78 Ca 0.05 1.35 0.03 0.00 0.00 0.00 0.00 61.98 63.41 2qbh s VAL 78 Cb -0.14 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.16 2qbh s VAL 78 CO -0.09 -0.34 0.13 2.30 0.00 0.00 0.00 175.10 177.09 2qbh n ILE 79 N 5.92 0.00 -4.77 2.22 -5.35 -1.17 -1.46 119.36 114.75 2qbh n ILE 79 Ca 0.15 -2.47 -0.27 0.00 -0.27 0.00 0.00 62.75 59.89 2qbh n ILE 79 Cb 0.46 0.82 -0.14 0.00 -1.74 0.00 0.00 39.64 39.03 2qbh n ILE 79 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2qbh s LEU 80 N 0.00 2.14 -0.02 7.28 2.96 -1.26 -1.08 118.68 128.70 2qbh s LEU 80 Ca 0.18 -0.51 -0.03 0.00 -0.22 0.00 0.00 54.13 53.54 2qbh s LEU 80 Cb 0.01 -1.06 -0.04 0.00 0.50 0.00 0.00 46.19 45.60 2qbh s LEU 80 CO 0.13 0.20 0.17 -0.63 -1.32 0.00 0.00 176.35 174.90 2qbh s ILE 81 N -0.75 5.42 -0.14 6.68 -1.09 -0.01 -0.39 121.20 130.92 2qbh s ILE 81 Ca 0.08 -0.12 -0.07 0.00 -2.23 0.00 0.00 60.65 58.32 2qbh s ILE 81 Cb -0.09 -3.51 -0.06 0.00 -1.58 0.00 0.00 42.46 37.22 2qbh s ILE 81 CO 0.01 0.36 -0.18 -1.14 -1.23 0.00 0.00 174.94 172.77 2qbh n ARG 82 N 1.08 0.30 0.00 2.79 0.63 0.37 -3.30 116.66 118.53 2qbh n ARG 82 Ca -0.12 0.13 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 2qbh n ARG 82 Cb 0.53 -1.01 0.00 0.00 0.45 0.00 0.00 32.46 32.43 2qbh n ARG 82 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qbh n GLY 83 N 2.17 0.29 3.17 5.14 0.00 -1.26 -4.77 105.19 109.93 2qbh n GLY 83 Ca -0.27 -0.69 0.01 0.00 0.00 0.00 0.00 46.02 45.07 2qbh n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qbh s GLY 84 N 0.00 -1.21 0.59 -0.02 0.00 -0.88 -4.80 107.32 101.00 2qbh s GLY 84 Ca 0.00 0.42 -0.18 0.00 0.00 0.00 0.00 44.72 44.97 2qbh s GLY 84 CO 0.00 3.63 -0.23 -2.13 0.00 0.00 0.00 173.10 174.37 2qbh n ARG 85 N 4.72 0.00 -4.02 2.90 0.63 -1.12 -4.33 116.66 115.45 2qbh n ARG 85 Ca 0.09 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.70 2qbh n ARG 85 Cb 0.56 -1.01 -0.15 0.00 0.45 0.00 0.00 32.46 32.31 2qbh n ARG 85 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2qbh s VAL 86 N -2.00 2.34 0.30 5.15 1.01 -0.83 -4.95 120.40 121.42 2qbh s VAL 86 Ca 0.54 -1.99 0.06 0.00 0.00 0.00 0.00 61.98 60.59 2qbh s VAL 86 Cb -0.44 -2.56 0.30 0.00 0.00 0.00 0.00 36.38 33.67 2qbh s VAL 86 CO 0.69 -0.34 1.70 0.50 0.00 0.00 0.00 175.10 177.65 2qbh h LYS 87 N 7.72 0.43 0.00 2.72 3.64 -1.93 0.14 116.57 129.30 2qbh h LYS 87 Ca -0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2qbh h LYS 87 Cb 1.03 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 2qbh h LYS 87 CO 0.51 0.29 -0.28 -0.44 -2.27 0.00 0.00 179.45 177.25 2qbh h ASP 88 N 0.45 0.00 -4.06 4.20 3.45 -1.98 -3.41 116.42 115.07 2qbh h ASP 88 Ca 0.59 -0.03 -0.71 0.00 0.43 0.00 0.00 57.03 57.31 2qbh h ASP 88 Cb 1.13 0.00 -0.34 0.00 -0.56 0.00 0.00 39.33 39.56 2qbh h ASP 88 CO -0.52 0.01 -0.30 -0.76 -1.57 0.00 0.00 179.24 176.11 2qbh s LEU 89 N -5.45 5.47 0.59 1.55 2.01 0.49 -1.68 118.68 121.65 2qbh s LEU 89 Ca 0.06 -2.80 -0.18 0.00 0.01 0.00 0.00 54.13 51.22 2qbh s LEU 89 Cb 0.08 -1.91 -0.04 0.00 0.01 0.00 0.00 46.19 44.34 2qbh s LEU 89 CO 0.69 -0.41 1.14 -2.16 1.01 0.00 0.00 176.35 176.62 2qbh s PRO 90 N 0.02 3.11 0.00 1.29 0.04 -1.25 -2.69 135.00 135.51 2qbh s PRO 90 Ca 0.17 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2qbh s PRO 90 Cb -0.19 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2qbh s PRO 90 CO -0.04 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.36 2qbh n GLY 91 N 0.08 2.45 3.07 0.56 0.00 -1.26 -4.94 105.19 105.15 2qbh n GLY 91 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2qbh n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbh s VAL 92 N -3.20 3.31 -0.92 1.61 1.01 -1.10 -4.34 120.40 116.78 2qbh s VAL 92 Ca 0.00 -2.80 0.15 0.00 0.00 0.00 0.00 61.98 59.33 2qbh s VAL 92 Cb 0.00 -3.22 0.48 0.00 0.00 0.00 0.00 36.38 33.64 2qbh s VAL 92 CO 0.00 -0.81 1.41 0.54 0.00 0.00 0.00 175.10 176.24 2qbh n ARG 93 N 3.70 3.07 -4.36 2.72 3.00 -1.26 -1.96 116.66 121.57 2qbh n ARG 93 Ca 0.05 -2.47 -0.19 0.00 -0.01 0.00 0.00 57.85 55.23 2qbh n ARG 93 Cb 0.38 -1.56 -0.10 0.00 0.00 0.00 0.00 32.46 31.17 2qbh n ARG 93 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2qbh s TYR 94 N -1.58 1.71 0.06 -1.55 2.02 -1.24 -2.06 117.35 114.70 2qbh s TYR 94 Ca 0.36 -0.68 0.05 0.00 -0.37 0.00 0.00 57.07 56.43 2qbh s TYR 94 Cb 0.23 -0.89 -0.03 0.00 -0.40 0.00 0.00 41.96 40.88 2qbh s TYR 94 CO 0.18 0.25 -0.14 -1.01 -1.57 0.00 0.00 175.55 173.26 2qbh s HIS 95 N -3.09 1.22 0.08 2.71 3.76 -1.26 -2.05 115.29 116.66 2qbh s HIS 95 Ca 0.25 -0.41 -0.24 0.00 -0.15 0.00 0.00 55.06 54.51 2qbh s HIS 95 Cb 0.02 -0.71 -0.06 0.00 1.11 0.00 0.00 32.58 32.94 2qbh s HIS 95 CO 0.08 0.05 0.72 0.95 -0.85 0.00 0.00 174.74 175.69 2qbh s THR 96 N -1.07 4.65 -0.87 1.30 -4.23 -0.35 0.14 115.64 115.20 2qbh s THR 96 Ca -0.00 1.55 -0.23 0.00 -1.18 0.00 0.00 61.69 61.82 2qbh s THR 96 Cb -0.09 -4.07 0.06 0.00 1.34 0.00 0.00 72.50 69.74 2qbh s THR 96 CO 0.02 0.44 1.27 -0.69 -0.54 0.00 0.00 174.62 175.12 2qbh s VAL 97 N -0.53 4.06 0.18 2.29 1.01 0.48 -4.69 120.40 123.19 2qbh s VAL 97 Ca 0.35 -0.50 -0.32 0.00 0.00 0.00 0.00 61.98 61.52 2qbh s VAL 97 Cb -0.21 -4.92 -0.11 0.00 0.00 0.00 0.00 36.38 31.15 2qbh s VAL 97 CO 0.23 -1.77 1.72 -0.13 0.00 0.00 0.00 175.10 175.14 2qbh s ARG 98 N 4.68 4.15 0.00 2.72 0.52 -1.26 -2.21 118.95 127.54 2qbh s ARG 98 Ca 0.37 2.55 0.00 0.00 -0.52 0.00 0.00 55.73 58.13 2qbh s ARG 98 Cb -0.06 -3.23 0.00 0.00 0.52 0.00 0.00 34.95 32.19 2qbh s ARG 98 CO 0.00 -0.75 0.00 0.41 0.02 0.00 0.00 175.30 174.99 2qbh n GLY 99 N 4.00 1.70 3.87 -3.53 0.00 0.20 -2.44 105.19 108.98 2qbh n GLY 99 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 2qbh n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbh s ALA 100 N -2.46 3.82 0.00 4.61 0.00 -0.94 -4.87 121.76 121.92 2qbh s ALA 100 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.46 2qbh s ALA 100 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.01 2qbh s ALA 100 CO 0.00 0.58 0.00 1.28 0.00 0.00 0.00 175.76 177.62 2qbh n LEU 101 N 1.85 0.00 0.00 0.00 4.77 -1.26 -2.14 117.00 120.22 2qbh n LEU 101 Ca -0.17 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 55.91 2qbh n LEU 101 Cb 0.54 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.14 2qbh n LEU 101 CO 0.34 0.00 0.85 0.47 -1.33 0.00 0.00 177.39 177.72 2qbh n ASP 102 N 1.64 0.00 -4.66 -1.43 10.43 -0.53 -4.71 116.55 117.28 2qbh n ASP 102 Ca 0.00 0.20 -0.41 0.00 2.57 0.00 0.00 54.79 57.15 2qbh n ASP 102 Cb 0.00 -0.38 -0.05 0.00 1.84 0.00 0.00 41.12 42.54 2qbh n ASP 102 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2qbh n SER 104 N 5.34 -0.63 -4.24 0.00 3.41 -1.26 -2.48 113.62 113.76 2qbh n SER 104 Ca 0.03 -0.52 -0.14 0.00 -0.26 0.00 0.00 58.87 57.97 2qbh n SER 104 Cb 0.49 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 2qbh n SER 104 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2qbh s GLY 105 N -2.36 1.03 -0.18 5.00 0.00 -1.26 0.59 107.32 110.13 2qbh s GLY 105 Ca 0.00 -1.43 -0.29 0.00 0.00 0.00 0.00 44.72 42.99 2qbh s GLY 105 CO 0.00 -1.53 2.16 -0.62 0.00 0.00 0.00 173.10 173.11 2qbh n VAL 106 N -0.04 0.42 -1.83 1.40 0.31 -1.03 -4.95 118.33 112.61 2qbh n VAL 106 Ca -0.11 -0.37 -0.31 0.00 -0.01 0.00 0.00 64.34 63.53 2qbh n VAL 106 Cb 0.60 -2.41 0.02 0.00 -0.91 0.00 0.00 33.84 31.14 2qbh n VAL 106 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2qbh s LYS 107 N 5.90 3.43 0.00 5.55 0.00 -1.26 -3.61 119.74 129.76 2qbh s LYS 107 Ca 0.99 0.83 0.00 0.00 0.00 0.00 0.00 55.97 57.80 2qbh s LYS 107 Cb -0.42 -2.06 0.00 0.00 0.00 0.00 0.00 37.83 35.36 2qbh s LYS 107 CO 0.38 -0.70 0.00 -0.25 0.00 0.00 0.00 175.35 174.78 2qbh n ASP 108 N -2.75 0.00 -4.57 0.03 9.92 -1.26 -4.92 116.55 112.99 2qbh n ASP 108 Ca 0.07 0.00 -0.46 0.00 -0.53 0.00 0.00 54.79 53.86 2qbh n ASP 108 Cb 0.54 -0.20 -0.03 0.00 -0.64 0.00 0.00 41.12 40.79 2qbh n ASP 108 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2qbh n ARG 109 N -1.11 1.19 0.00 -1.24 3.00 -1.24 -4.88 116.66 112.38 2qbh n ARG 109 Ca 0.00 0.42 0.00 0.00 -0.00 0.00 0.00 57.85 58.27 2qbh n ARG 109 Cb 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 32.46 30.65 2qbh n ARG 109 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2qbh n LYS 110 N 1.15 0.00 -3.30 -0.14 4.76 -1.26 -4.92 118.16 114.45 2qbh n LYS 110 Ca 0.12 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.21 2qbh n LYS 110 Cb 0.29 -0.65 -0.06 0.00 -1.84 0.00 0.00 35.03 32.77 2qbh n LYS 110 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2qbh s GLN 111 N -1.73 4.03 -1.46 1.97 -0.21 -1.26 -3.92 119.66 117.09 2qbh s GLN 111 Ca 0.00 0.57 -0.11 0.00 0.02 0.00 0.00 55.36 55.84 2qbh s GLN 111 Cb 0.00 -2.90 0.05 0.00 1.00 0.00 0.00 33.01 31.15 2qbh s GLN 111 CO 0.00 0.45 1.03 0.00 -2.12 0.00 0.00 175.29 174.65 2qbh n ALA 112 N 0.74 -1.26 -0.19 6.09 0.00 -1.26 -4.87 120.51 119.76 2qbh n ALA 112 Ca -0.04 0.29 0.08 0.00 0.00 0.00 0.00 53.44 53.76 2qbh n ALA 112 Cb 0.52 -4.84 0.36 0.00 0.00 0.00 0.00 19.45 15.49 2qbh n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbh h ARG 113 N -2.26 0.71 -0.13 0.00 3.08 -1.90 -2.93 114.38 110.95 2qbh h ARG 113 Ca -0.57 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 59.46 2qbh h ARG 113 Cb 1.37 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 2qbh h ARG 113 CO 0.61 0.47 -0.19 1.03 -1.07 0.00 0.00 179.97 180.82 2qbh h SER 114 N 0.73 -0.63 -4.18 7.04 0.87 -1.89 -2.59 113.55 112.90 2qbh h SER 114 Ca 0.34 0.08 -0.53 0.00 -1.23 0.00 0.00 61.79 60.44 2qbh h SER 114 Cb 0.36 0.25 0.16 0.00 -0.44 0.00 0.00 62.40 62.73 2qbh h SER 114 CO -0.12 -0.14 0.38 -0.54 -0.53 0.00 0.00 176.83 175.89 2qbh s LYS 115 N -3.90 2.11 -1.21 2.24 1.02 -1.11 -2.26 119.74 116.64 2qbh s LYS 115 Ca -0.05 1.73 0.00 0.00 0.02 0.00 0.00 55.97 57.68 2qbh s LYS 115 Cb 0.03 -1.83 0.00 0.00 -0.52 0.00 0.00 37.83 35.51 2qbh s LYS 115 CO 0.21 -1.86 0.00 0.66 -0.92 0.00 0.00 175.35 173.44 2qbh n TYR 116 N -2.79 -0.05 -1.46 3.18 4.02 -1.26 -4.45 117.16 114.35 2qbh n TYR 116 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.02 2qbh n TYR 116 Cb 0.50 -2.19 0.00 0.00 -0.02 0.00 0.00 39.34 37.63 2qbh n TYR 116 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qbh n GLY 117 N -1.52 0.00 2.59 2.72 0.00 -0.96 -2.46 105.19 105.57 2qbh n GLY 117 Ca -0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 2qbh n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbh s VAL 118 N -0.20 -0.15 0.86 1.61 1.01 -0.97 -4.36 120.40 118.19 2qbh s VAL 118 Ca 0.00 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.15 2qbh s VAL 118 Cb 0.00 -0.97 -0.00 0.00 0.00 0.00 0.00 36.38 35.41 2qbh s VAL 118 CO 0.00 -0.66 0.42 0.29 0.00 0.00 0.00 175.10 175.15 2qbh n LYS 119 N 5.26 -0.03 -1.38 2.72 4.76 -1.26 -4.68 118.16 123.55 2qbh n LYS 119 Ca -0.05 0.04 -0.38 0.00 -2.87 0.00 0.00 58.31 55.04 2qbh n LYS 119 Cb 0.43 -1.82 0.03 0.00 -1.84 0.00 0.00 35.03 31.83 2qbh n LYS 119 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2qbh n ARG 120 N -1.16 0.32 0.00 1.97 0.63 -1.26 -4.94 116.66 112.23 2qbh n ARG 120 Ca 0.08 0.13 0.00 0.00 -0.92 0.00 0.00 57.85 57.14 2qbh n ARG 120 Cb 0.52 -1.46 0.00 0.00 0.45 0.00 0.00 32.46 31.97 2qbh n ARG 120 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2qbh n PRO 121 N 0.48 0.00 0.00 -0.14 -0.04 -1.26 -5.02 135.00 129.02 2qbh n PRO 121 Ca 0.10 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2qbh n PRO 121 Cb 0.47 -0.52 0.00 0.00 -0.04 0.00 0.00 33.50 33.42 2qbh n PRO 121 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2qbh n LYS 122 N -0.02 0.00 0.00 0.54 -0.00 -1.26 -5.23 118.16 112.19 2qbh n LYS 122 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.43 2qbh n LYS 122 Cb 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 35.03 35.21 2qbh n LYS 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40