#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hkh n GLN 3 N 0.00 0.00 -4.67 7.34 7.27 -1.26 -4.90 117.38 121.16 2hkh n GLN 3 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 56.83 2hkh n GLN 3 Cb 0.00 0.00 -0.16 0.00 2.41 0.00 0.00 30.24 32.49 2hkh n GLN 3 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2hkh s VAL 4 N -2.44 1.21 -0.22 1.69 1.01 -1.26 -1.00 120.40 119.40 2hkh s VAL 4 Ca 0.00 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2hkh s VAL 4 Cb 0.00 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.37 2hkh s VAL 4 CO 0.00 0.36 -0.12 -0.69 0.00 0.00 0.00 175.10 174.65 2hkh s VAL 5 N 0.18 1.87 0.30 2.92 1.01 -0.84 -4.31 120.40 121.54 2hkh s VAL 5 Ca -0.05 -1.20 -0.16 0.00 0.00 0.00 0.00 61.98 60.56 2hkh s VAL 5 Cb -0.11 -1.92 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 2hkh s VAL 5 CO 0.02 0.16 0.74 -1.61 0.00 0.00 0.00 175.10 174.41 2hkh s GLU 6 N 1.29 4.06 0.27 2.72 8.01 -1.26 -1.49 118.70 132.30 2hkh s GLU 6 Ca -0.03 0.73 -0.12 0.00 0.01 0.00 0.00 54.97 55.56 2hkh s GLU 6 Cb -0.17 -2.52 0.00 0.00 -4.31 0.00 0.00 34.13 27.13 2hkh s GLU 6 CO -0.08 0.20 0.51 -1.54 0.01 0.00 0.00 175.26 174.36 2hkh s SER 7 N -2.13 0.07 0.00 -0.19 1.04 0.11 -4.61 113.70 107.99 2hkh s SER 7 Ca 0.52 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.92 2hkh s SER 7 Cb -0.12 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2hkh s SER 7 CO 0.18 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.80 2hkh n GLY 8 N -0.42 0.98 0.60 7.32 0.00 -1.26 -0.81 105.19 111.59 2hkh n GLY 8 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 2hkh n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hkh n GLY 9 N -1.15 -3.19 0.00 -0.02 0.00 -1.26 -4.73 105.19 94.84 2hkh n GLY 9 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.68 2hkh n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hkh n GLY 10 N -0.02 0.99 3.68 -0.02 0.00 0.80 -4.95 105.19 105.66 2hkh n GLY 10 Ca 0.03 -1.92 -0.40 0.00 0.00 0.00 0.00 46.02 43.73 2hkh n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hkh s LEU 11 N 0.00 4.21 0.07 0.99 2.96 -1.26 -1.07 118.68 124.58 2hkh s LEU 11 Ca 0.00 1.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.93 2hkh s LEU 11 Cb 0.00 -3.01 -0.04 0.00 0.50 0.00 0.00 46.19 43.64 2hkh s LEU 11 CO 0.00 -0.23 -0.05 0.54 -1.32 0.00 0.00 176.35 175.29 2hkh s VAL 12 N 1.52 0.47 0.32 1.68 0.11 -0.34 -4.97 120.40 119.19 2hkh s VAL 12 Ca 0.33 -1.73 -0.06 0.00 -2.93 0.00 0.00 61.98 57.59 2hkh s VAL 12 Cb -0.16 -1.41 -0.05 0.00 -1.53 0.00 0.00 36.38 33.22 2hkh s VAL 12 CO 0.13 -0.84 0.60 -1.10 -3.33 0.00 0.00 175.10 170.56 2hkh s GLN 13 N -3.46 3.66 0.35 1.54 1.11 -1.25 -1.73 119.66 119.88 2hkh s GLN 13 Ca 0.06 0.11 -0.27 0.00 0.01 0.00 0.00 55.36 55.27 2hkh s GLN 13 Cb 0.04 -2.59 -0.12 0.00 -1.01 0.00 0.00 33.01 29.33 2hkh s GLN 13 CO -0.06 0.15 1.13 -2.30 0.01 0.00 0.00 175.29 174.23 2hkh n PRO 14 N -1.04 1.69 -0.39 2.91 -0.02 -1.26 -0.17 135.00 136.73 2hkh n PRO 14 Ca -0.01 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2hkh n PRO 14 Cb 0.54 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 2hkh n PRO 14 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2hkh n LYS 15 N 0.49 0.00 -0.62 -0.52 4.76 0.19 -4.96 118.16 117.50 2hkh n LYS 15 Ca 0.07 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.21 2hkh n LYS 15 Cb 0.36 -2.13 0.28 0.00 -1.84 0.00 0.00 35.03 31.69 2hkh n LYS 15 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2hkh s GLY 16 N -2.00 1.47 0.04 0.72 0.00 0.77 -4.11 107.32 104.21 2hkh s GLY 16 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 44.72 43.76 2hkh s GLY 16 CO 0.00 0.05 -0.04 -1.35 0.00 0.00 0.00 173.10 171.75 2hkh s SER 17 N -3.51 0.48 -0.10 1.64 1.04 -1.26 -1.33 113.70 110.65 2hkh s SER 17 Ca 0.70 -0.64 -0.17 0.00 0.48 0.00 0.00 55.95 56.32 2hkh s SER 17 Cb -0.10 0.11 0.04 0.00 0.10 0.00 0.00 66.02 66.16 2hkh s SER 17 CO 0.57 -0.35 0.43 -0.22 0.98 0.00 0.00 173.24 174.64 2hkh s LEU 18 N -1.88 0.37 -0.20 2.42 0.20 0.27 -4.98 118.68 114.88 2hkh s LEU 18 Ca -0.08 0.61 0.02 0.00 0.69 0.00 0.00 54.13 55.36 2hkh s LEU 18 Cb -0.05 1.56 0.04 0.00 -0.43 0.00 0.00 46.19 47.30 2hkh s LEU 18 CO -0.03 -0.30 -0.16 -0.75 -0.29 0.00 0.00 176.35 174.82 2hkh s LYS 19 N -0.44 2.58 0.03 1.98 2.20 -1.26 0.36 119.74 125.19 2hkh s LYS 19 Ca -0.06 -0.97 -0.10 0.00 -0.36 0.00 0.00 55.97 54.48 2hkh s LYS 19 Cb -0.03 -2.61 -0.05 0.00 -1.51 0.00 0.00 37.83 33.62 2hkh s LYS 19 CO 0.03 -0.35 0.36 -0.51 -0.36 0.00 0.00 175.35 174.52 2hkh s LEU 20 N 1.26 4.39 0.15 5.43 1.43 -0.02 -4.62 118.68 126.70 2hkh s LEU 20 Ca -0.00 0.77 0.08 0.00 -1.03 0.00 0.00 54.13 53.95 2hkh s LEU 20 Cb -0.16 -2.77 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 2hkh s LEU 20 CO -0.10 0.24 -0.17 -0.94 0.23 0.00 0.00 176.35 175.61 2hkh s SER 21 N -1.53 2.46 -0.18 2.29 1.04 0.01 -0.06 113.70 117.73 2hkh s SER 21 Ca 0.29 -0.84 -0.09 0.00 0.48 0.00 0.00 55.95 55.79 2hkh s SER 21 Cb -0.14 -0.13 0.07 0.00 0.10 0.00 0.00 66.02 65.92 2hkh s SER 21 CO 0.16 -0.06 0.42 0.00 0.98 0.00 0.00 173.24 174.73 2hkh s VAL 23 N 1.77 2.41 0.84 0.00 1.01 -0.55 -0.20 120.40 125.67 2hkh s VAL 23 Ca -0.07 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 2hkh s VAL 23 Cb -0.09 -1.95 0.10 0.00 0.00 0.00 0.00 36.38 34.43 2hkh s VAL 23 CO -0.13 0.55 1.13 0.54 0.00 0.00 0.00 175.10 177.19 2hkh s VAL 24 N 0.28 2.39 0.00 2.92 0.11 -1.10 -1.99 120.40 123.01 2hkh s VAL 24 Ca -0.15 0.13 0.00 0.00 -2.93 0.00 0.00 61.98 59.03 2hkh s VAL 24 Cb -0.17 -2.96 0.00 0.00 -1.53 0.00 0.00 36.38 31.72 2hkh s VAL 24 CO 0.07 -0.17 0.00 -1.20 -3.33 0.00 0.00 175.10 170.48 2hkh n SER 25 N -3.51 0.00 0.00 3.54 7.64 -0.17 -4.91 113.62 116.21 2hkh n SER 25 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2hkh n SER 25 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 2hkh n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hkh n GLY 26 N 5.00 0.97 7.00 0.23 0.00 -1.26 -4.96 105.19 112.17 2hkh n GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hkh n GLY 26 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2hkh n SER 27 N 0.00 0.00 0.00 1.61 2.88 -1.26 -4.58 113.62 112.27 2hkh n SER 27 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2hkh n SER 27 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2hkh n SER 27 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2hkh n THR 28 N 0.00 0.00 -3.72 2.46 -1.04 -1.26 -5.17 114.28 105.55 2hkh n THR 28 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 2hkh n THR 28 Cb 0.00 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.42 2hkh n THR 28 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2hkh s LEU 29 N 0.00 0.24 -0.01 -4.42 2.01 -1.26 -5.04 118.68 110.20 2hkh s LEU 29 Ca 0.00 0.91 0.02 0.00 0.01 0.00 0.00 54.13 55.07 2hkh s LEU 29 Cb 0.00 1.58 0.03 0.00 0.01 0.00 0.00 46.19 47.82 2hkh s LEU 29 CO 0.00 -0.17 0.92 -3.20 1.01 0.00 0.00 176.35 174.91 2hkh n ASN 30 N 2.79 1.57 -4.40 2.29 2.85 -1.26 -4.94 115.26 114.16 2hkh n ASN 30 Ca -0.13 -1.92 -0.45 0.00 -0.11 0.00 0.00 54.58 51.96 2hkh n ASN 30 Cb 0.57 -0.06 -0.02 0.00 1.24 0.00 0.00 39.78 41.51 2hkh n ASN 30 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2hkh s ASN 31 N -1.02 6.80 -0.12 1.20 2.47 -1.26 -4.74 114.94 118.27 2hkh s ASN 31 Ca 0.04 -2.53 -0.30 0.00 0.42 0.00 0.00 52.86 50.48 2hkh s ASN 31 Cb 0.03 -2.32 0.12 0.00 -1.45 0.00 0.00 41.25 37.64 2hkh s ASN 31 CO 0.00 -0.78 0.97 -0.72 -3.72 0.00 0.00 177.10 172.85 2hkh s TYR 32 N 1.31 -0.36 0.12 0.43 1.13 -1.26 -5.03 117.35 113.68 2hkh s TYR 32 Ca 0.29 0.52 -0.15 0.00 -1.41 0.00 0.00 57.07 56.32 2hkh s TYR 32 Cb -0.07 0.47 -0.07 0.00 -1.10 0.00 0.00 41.96 41.20 2hkh s TYR 32 CO -0.08 -0.39 0.54 0.00 -2.51 0.00 0.00 175.55 173.10 2hkh s ALA 33 N -1.65 3.60 0.11 9.51 0.00 -1.26 -3.63 121.76 128.43 2hkh s ALA 33 Ca 0.00 -0.12 0.10 0.00 0.00 0.00 0.00 51.96 51.94 2hkh s ALA 33 Cb -0.01 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.56 2hkh s ALA 33 CO -0.01 0.45 -0.25 -1.64 0.00 0.00 0.00 175.76 174.31 2hkh s MET 34 N -1.75 1.40 0.11 0.00 -1.94 -0.16 -4.65 119.30 112.29 2hkh s MET 34 Ca 0.35 -1.26 0.06 0.00 -1.71 0.00 0.00 55.69 53.13 2hkh s MET 34 Cb -0.16 -1.79 -0.03 0.00 2.01 0.00 0.00 34.83 34.86 2hkh s MET 34 CO 0.19 0.43 -0.15 -0.80 -0.01 0.00 0.00 175.02 174.67 2hkh s ASN 35 N -1.88 2.00 -0.19 3.03 0.01 -0.56 -1.12 114.94 116.22 2hkh s ASN 35 Ca 0.12 -0.74 -0.04 0.00 -0.71 0.00 0.00 52.86 51.49 2hkh s ASN 35 Cb -0.10 -0.07 -0.02 0.00 0.41 0.00 0.00 41.25 41.46 2hkh s ASN 35 CO 0.05 -0.09 -0.02 0.26 -1.51 0.00 0.00 177.10 175.79 2hkh s TRP 36 N -1.74 3.02 0.06 2.20 0.52 0.21 0.59 118.94 123.81 2hkh s TRP 36 Ca 0.05 -0.46 0.08 0.00 0.02 0.00 0.00 56.10 55.80 2hkh s TRP 36 Cb -0.07 -2.04 -0.03 0.00 -1.15 0.00 0.00 33.47 30.17 2hkh s TRP 36 CO 0.03 -0.20 -0.21 0.08 0.02 0.00 0.00 176.95 176.66 2hkh s VAL 37 N 0.83 2.56 0.22 4.03 1.01 0.18 -0.25 120.40 128.98 2hkh s VAL 37 Ca -0.00 -1.35 0.07 0.00 0.00 0.00 0.00 61.98 60.70 2hkh s VAL 37 Cb -0.14 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 2hkh s VAL 37 CO 0.02 0.29 -0.11 0.00 0.00 0.00 0.00 175.10 175.29 2hkh s ARG 38 N -1.55 1.35 -0.20 2.72 1.70 0.89 -0.07 118.95 123.78 2hkh s ARG 38 Ca 0.14 -1.62 -0.04 0.00 -0.47 0.00 0.00 55.73 53.74 2hkh s ARG 38 Cb -0.10 -1.03 0.10 0.00 -0.57 0.00 0.00 34.95 33.34 2hkh s ARG 38 CO 0.05 0.12 0.25 -1.14 -1.08 0.00 0.00 175.30 173.50 2hkh s GLN 39 N -3.69 0.21 0.64 3.89 0.74 -0.34 -1.02 119.66 120.10 2hkh s GLN 39 Ca 0.24 0.29 -0.15 0.00 0.05 0.00 0.00 55.36 55.78 2hkh s GLN 39 Cb 0.01 -1.02 -0.01 0.00 1.10 0.00 0.00 33.01 33.09 2hkh s GLN 39 CO 0.07 -0.63 1.10 0.00 -0.55 0.00 0.00 175.29 175.28 2hkh s ALA 40 N 2.37 2.53 0.06 1.58 0.00 -1.26 -0.91 121.76 126.12 2hkh s ALA 40 Ca 0.07 0.51 -0.32 0.00 0.00 0.00 0.00 51.96 52.23 2hkh s ALA 40 Cb -0.15 -3.30 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 2hkh s ALA 40 CO -0.12 -1.17 1.87 -2.30 0.00 0.00 0.00 175.76 174.04 2hkh n PRO 41 N -2.33 2.66 -1.13 0.00 -0.02 -1.26 -1.84 135.00 131.08 2hkh n PRO 41 Ca 0.10 0.97 -0.04 0.00 -2.02 0.00 0.00 63.50 62.51 2hkh n PRO 41 Cb 0.52 -2.87 -0.02 0.00 -0.02 0.00 0.00 33.50 31.11 2hkh n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hkh n GLY 42 N 4.31 0.72 1.73 -1.23 0.00 -1.26 -5.00 105.19 104.46 2hkh n GLY 42 Ca 0.19 -0.63 -0.15 0.00 0.00 0.00 0.00 46.02 45.44 2hkh n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hkh n LYS 43 N -2.64 1.18 -1.93 1.61 4.76 -0.77 -5.17 118.16 115.21 2hkh n LYS 43 Ca -0.04 -1.76 -0.15 0.00 -2.87 0.00 0.00 58.31 53.48 2hkh n LYS 43 Cb 0.18 0.64 0.07 0.00 -1.84 0.00 0.00 35.03 34.08 2hkh n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hkh n GLY 44 N 1.61 0.85 3.74 0.72 0.00 -1.26 -4.72 105.19 106.13 2hkh n GLY 44 Ca -0.08 -2.03 -0.40 0.00 0.00 0.00 0.00 46.02 43.51 2hkh n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hkh s LEU 45 N 0.00 4.51 -0.12 0.99 1.43 -1.26 -4.28 118.68 119.95 2hkh s LEU 45 Ca 0.42 1.66 -0.00 0.00 -1.03 0.00 0.00 54.13 55.18 2hkh s LEU 45 Cb -0.03 -3.42 0.02 0.00 0.03 0.00 0.00 46.19 42.80 2hkh s LEU 45 CO 0.28 0.03 -0.10 -0.70 0.23 0.00 0.00 176.35 176.09 2hkh s GLU 46 N -0.31 1.78 0.26 1.70 2.12 -0.19 -4.98 118.70 119.09 2hkh s GLU 46 Ca 0.42 -0.36 -0.30 0.00 0.36 0.00 0.00 54.97 55.10 2hkh s GLU 46 Cb -0.23 -1.76 -0.09 0.00 0.26 0.00 0.00 34.13 32.31 2hkh s GLU 46 CO 0.27 -0.26 1.28 -0.46 -0.54 0.00 0.00 175.26 175.56 2hkh s TRP 47 N 1.63 3.22 -0.14 5.30 -0.00 -1.26 -0.08 118.94 127.62 2hkh s TRP 47 Ca 0.05 1.34 -0.06 0.00 -0.00 0.00 0.00 56.10 57.43 2hkh s TRP 47 Cb -0.13 -3.59 -0.06 0.00 -0.00 0.00 0.00 33.47 29.69 2hkh s TRP 47 CO -0.09 -1.72 -0.17 0.28 -0.00 0.00 0.00 176.95 175.25 2hkh n VAL 48 N 1.82 0.75 -3.55 5.86 0.31 0.66 -4.57 118.33 119.60 2hkh n VAL 48 Ca 0.03 -0.20 -0.14 0.00 -0.01 0.00 0.00 64.34 64.02 2hkh n VAL 48 Cb 0.43 -1.59 -0.05 0.00 -0.91 0.00 0.00 33.84 31.71 2hkh n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hkh s ALA 49 N -2.25 -1.86 -0.02 3.52 0.00 -1.09 -0.59 121.76 119.47 2hkh s ALA 49 Ca -0.19 1.45 0.01 0.00 0.00 0.00 0.00 51.96 53.23 2hkh s ALA 49 Cb 0.07 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.83 2hkh s ALA 49 CO 0.25 -0.35 -0.05 0.50 0.00 0.00 0.00 175.76 176.11 2hkh s ARG 50 N -1.23 0.59 -0.07 0.00 3.52 -0.66 -0.62 118.95 120.47 2hkh s ARG 50 Ca -0.05 -0.14 0.04 0.00 -0.13 0.00 0.00 55.73 55.45 2hkh s ARG 50 Cb -0.00 -0.60 -0.01 0.00 -1.56 0.00 0.00 34.95 32.77 2hkh s ARG 50 CO 0.05 0.03 -0.20 -1.50 -0.81 0.00 0.00 175.30 172.86 2hkh s ILE 51 N 0.36 2.46 0.80 4.11 2.07 -0.28 -1.58 121.20 129.15 2hkh s ILE 51 Ca -0.04 -0.91 -0.09 0.00 -1.41 0.00 0.00 60.65 58.19 2hkh s ILE 51 Cb -0.08 -1.95 0.12 0.00 0.13 0.00 0.00 42.46 40.68 2hkh s ILE 51 CO -0.00 0.56 1.13 -0.13 -1.91 0.00 0.00 174.94 174.59 2hkh s ARG 52 N -0.13 1.62 0.95 3.50 1.81 0.68 -0.99 118.95 126.39 2hkh s ARG 52 Ca -0.03 -0.37 -0.15 0.00 -1.72 0.00 0.00 55.73 53.46 2hkh s ARG 52 Cb -0.14 -2.06 0.20 0.00 -0.45 0.00 0.00 34.95 32.50 2hkh s ARG 52 CO 0.04 -1.68 1.31 -1.54 -0.68 0.00 0.00 175.30 172.75 2hkh s SER 53 N -4.67 3.13 0.20 0.23 1.04 -1.24 -4.21 113.70 108.19 2hkh s SER 53 Ca 0.65 0.18 -0.10 0.00 0.48 0.00 0.00 55.95 57.16 2hkh s SER 53 Cb -0.08 -0.22 0.20 0.00 0.10 0.00 0.00 66.02 66.02 2hkh s SER 53 CO 0.48 -2.71 1.81 0.50 0.98 0.00 0.00 173.24 174.30 2hkh h LYS 54 N -1.59 0.67 0.00 4.02 3.64 -1.90 -0.51 116.57 120.90 2hkh h LYS 54 Ca -0.44 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2hkh h LYS 54 Cb 1.23 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2hkh h LYS 54 CO 0.36 0.44 -0.11 0.77 -2.27 0.00 0.00 179.45 178.65 2hkh h SER 55 N 0.69 0.00 -0.86 4.20 0.02 -1.96 -0.19 113.55 115.44 2hkh h SER 55 Ca 0.27 0.00 -0.42 0.00 -0.84 0.00 0.00 61.79 60.80 2hkh h SER 55 Cb 0.13 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 62.42 2hkh h SER 55 CO -0.15 0.11 0.49 0.59 -1.14 0.00 0.00 176.83 176.73 2hkh n ASN 56 N -3.86 3.75 -1.29 3.07 3.02 -0.94 -4.93 115.26 114.08 2hkh n ASN 56 Ca -0.02 -3.57 -0.16 0.00 -0.03 0.00 0.00 54.58 50.80 2hkh n ASN 56 Cb 0.21 -0.79 -0.06 0.00 -0.61 0.00 0.00 39.78 38.52 2hkh n ASN 56 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2hkh n ASN 57 N -0.98 -4.86 -3.17 6.41 4.05 -0.08 -2.69 115.26 113.93 2hkh n ASN 57 Ca 0.53 0.33 -0.20 0.00 0.45 0.00 0.00 54.58 55.68 2hkh n ASN 57 Cb 1.54 -3.78 -0.00 0.00 1.23 0.00 0.00 39.78 38.76 2hkh n ASN 57 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 2hkh n TYR 58 N -2.77 -1.73 -1.61 1.20 4.02 -0.24 -4.90 117.16 111.14 2hkh n TYR 58 Ca -0.16 0.37 -0.43 0.00 -0.01 0.00 0.00 57.90 57.67 2hkh n TYR 58 Cb 0.53 -2.84 0.00 0.00 -0.02 0.00 0.00 39.34 37.01 2hkh n TYR 58 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2hkh n ALA 59 N -3.25 0.11 -2.55 -0.72 0.00 -1.10 -4.35 120.51 108.66 2hkh n ALA 59 Ca -0.04 0.30 -0.23 0.00 0.00 0.00 0.00 53.44 53.47 2hkh n ALA 59 Cb 0.55 -2.07 -0.15 0.00 0.00 0.00 0.00 19.45 17.79 2hkh n ALA 59 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2hkh s THR 60 N -1.19 1.26 0.06 0.00 -4.23 -1.26 -0.23 115.64 110.05 2hkh s THR 60 Ca 0.61 -0.79 0.02 0.00 -1.18 0.00 0.00 61.69 60.35 2hkh s THR 60 Cb -0.61 -1.07 -0.03 0.00 1.34 0.00 0.00 72.50 72.13 2hkh s THR 60 CO 0.59 0.27 -0.08 -0.31 -0.54 0.00 0.00 174.62 174.54 2hkh s TYR 61 N -0.50 0.78 0.01 3.99 1.51 -0.61 -5.02 117.35 117.51 2hkh s TYR 61 Ca 0.05 -0.59 0.00 0.00 -1.01 0.00 0.00 57.07 55.53 2hkh s TYR 61 Cb -0.07 -0.46 -0.01 0.00 -0.11 0.00 0.00 41.96 41.31 2hkh s TYR 61 CO 0.00 -0.08 -0.02 0.71 -1.11 0.00 0.00 175.55 175.05 2hkh s TYR 62 N -1.88 0.18 0.37 2.71 2.02 -1.26 -1.65 117.35 117.84 2hkh s TYR 62 Ca -0.04 -0.23 -0.28 0.00 -0.37 0.00 0.00 57.07 56.16 2hkh s TYR 62 Cb -0.07 -0.12 -0.10 0.00 -0.40 0.00 0.00 41.96 41.27 2hkh s TYR 62 CO -0.00 -0.07 1.37 0.00 -1.57 0.00 0.00 175.55 175.27 2hkh s ALA 63 N -0.62 3.44 0.27 3.71 0.00 0.25 -4.92 121.76 123.89 2hkh s ALA 63 Ca -0.06 1.36 0.37 0.00 0.00 0.00 0.00 51.96 53.63 2hkh s ALA 63 Cb -0.04 -3.53 1.71 0.00 0.00 0.00 0.00 23.12 21.26 2hkh s ALA 63 CO -0.00 -0.85 2.10 -0.44 0.00 0.00 0.00 175.76 176.57 2hkh h ASP 64 N 3.02 0.00 0.16 0.00 3.32 -1.92 -0.14 116.42 120.85 2hkh h ASP 64 Ca -0.50 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.55 2hkh h ASP 64 Cb 1.24 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.79 2hkh h ASP 64 CO 0.64 0.00 -0.02 0.77 -1.72 0.00 0.00 179.24 178.91 2hkh h SER 65 N 0.00 0.00 0.00 6.45 4.64 -1.95 -3.29 113.55 119.40 2hkh h SER 65 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2hkh h SER 65 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2hkh h SER 65 CO 0.00 0.02 0.00 1.33 -0.87 0.00 0.00 176.83 177.31 2hkh n VAL 66 N -3.42 0.00 -1.79 0.95 0.24 -0.08 -5.01 118.33 109.22 2hkh n VAL 66 Ca -0.02 -0.45 -0.41 0.00 -2.04 0.00 0.00 64.34 61.41 2hkh n VAL 66 Cb 0.13 1.09 -0.00 0.00 -1.47 0.00 0.00 33.84 33.58 2hkh n VAL 66 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2hkh s LYS 67 N -0.03 4.10 -1.41 7.34 1.02 -1.11 -0.19 119.74 129.47 2hkh s LYS 67 Ca 0.00 2.59 0.00 0.00 0.02 0.00 0.00 55.97 58.58 2hkh s LYS 67 Cb 0.00 -2.98 0.00 0.00 -0.52 0.00 0.00 37.83 34.33 2hkh s LYS 67 CO 0.00 -0.57 0.00 -0.25 -0.92 0.00 0.00 175.35 173.61 2hkh n ASP 68 N 0.89 -4.12 0.00 2.83 8.00 -1.26 -4.64 116.55 118.25 2hkh n ASP 68 Ca 0.03 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.79 2hkh n ASP 68 Cb 0.39 -3.64 0.00 0.00 -0.02 0.00 0.00 41.12 37.85 2hkh n ASP 68 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2hkh n ARG 69 N -2.38 0.13 -4.72 -1.24 1.74 -0.92 -5.05 116.66 104.21 2hkh n ARG 69 Ca -0.16 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.60 2hkh n ARG 69 Cb 0.55 -0.65 -0.12 0.00 -1.02 0.00 0.00 32.46 31.22 2hkh n ARG 69 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2hkh s PHE 70 N -1.30 2.77 -0.18 -1.55 0.40 0.73 -1.84 117.98 117.01 2hkh s PHE 70 Ca 0.00 -0.11 0.01 0.00 -0.60 0.00 0.00 56.93 56.23 2hkh s PHE 70 Cb 0.00 -1.62 0.03 0.00 0.51 0.00 0.00 43.02 41.94 2hkh s PHE 70 CO 0.00 0.26 -0.15 0.99 0.70 0.00 0.00 175.22 177.02 2hkh s THR 71 N -0.83 1.82 0.08 0.64 2.01 0.78 -4.82 115.64 115.33 2hkh s THR 71 Ca 0.13 -0.92 -0.23 0.00 0.31 0.00 0.00 61.69 60.98 2hkh s THR 71 Cb -0.11 -1.74 -0.06 0.00 0.01 0.00 0.00 72.50 70.59 2hkh s THR 71 CO 0.03 0.38 0.70 -0.51 -0.69 0.00 0.00 174.62 174.53 2hkh s ILE 72 N 1.36 4.65 0.35 1.82 2.07 -1.26 0.39 121.20 130.58 2hkh s ILE 72 Ca 0.02 1.51 -0.02 0.00 -1.41 0.00 0.00 60.65 60.75 2hkh s ILE 72 Cb -0.14 -4.05 0.01 0.00 0.13 0.00 0.00 42.46 38.40 2hkh s ILE 72 CO -0.11 0.46 0.49 -0.55 -1.91 0.00 0.00 174.94 173.33 2hkh s SER 73 N -0.62 0.96 0.18 4.50 0.15 -0.75 -4.94 113.70 113.17 2hkh s SER 73 Ca 0.35 -1.50 -0.24 0.00 0.70 0.00 0.00 55.95 55.25 2hkh s SER 73 Cb -0.21 0.68 0.06 0.00 -1.71 0.00 0.00 66.02 64.84 2hkh s SER 73 CO 0.22 -1.33 0.80 0.00 1.20 0.00 0.00 173.24 174.13 2hkh s ARG 74 N -2.95 1.36 -0.16 5.44 1.70 -1.26 -0.55 118.95 122.53 2hkh s ARG 74 Ca 0.30 -0.69 -0.04 0.00 -0.47 0.00 0.00 55.73 54.83 2hkh s ARG 74 Cb -0.01 0.51 0.07 0.00 -0.57 0.00 0.00 34.95 34.95 2hkh s ARG 74 CO 0.21 -0.62 0.17 0.34 -1.08 0.00 0.00 175.30 174.32 2hkh s ASP 75 N -2.83 1.53 0.29 -2.89 3.68 0.12 -4.98 116.67 111.58 2hkh s ASP 75 Ca 0.09 -0.21 0.11 0.00 2.13 0.00 0.00 52.55 54.66 2hkh s ASP 75 Cb -0.03 0.16 0.41 0.00 -1.45 0.00 0.00 42.92 42.02 2hkh s ASP 75 CO -0.00 -0.31 1.65 0.44 0.13 0.00 0.00 175.17 177.07 2hkh h ASP 76 N 8.36 0.00 0.71 -0.34 3.45 -1.96 -0.77 116.42 125.88 2hkh h ASP 76 Ca -0.15 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.22 2hkh h ASP 76 Cb 1.14 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.90 2hkh h ASP 76 CO 0.25 0.58 -0.42 0.77 -1.57 0.00 0.00 179.24 178.85 2hkh h SER 77 N 0.00 0.00 0.65 6.45 4.64 -1.96 -2.54 113.55 120.78 2hkh h SER 77 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2hkh h SER 77 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2hkh h SER 77 CO 0.08 0.42 -0.44 0.00 -0.87 0.00 0.00 176.83 176.01 2hkh n GLN 78 N -3.66 0.06 -3.74 4.77 1.13 -1.03 -4.96 117.38 109.94 2hkh n GLN 78 Ca -0.01 0.02 -0.22 0.00 -1.94 0.00 0.00 57.00 54.85 2hkh n GLN 78 Cb 0.51 -1.54 0.03 0.00 0.11 0.00 0.00 30.24 29.35 2hkh n GLN 78 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2hkh n SER 79 N -1.62 -1.30 -3.95 1.08 3.41 -0.76 -4.94 113.62 105.54 2hkh n SER 79 Ca 0.05 -0.84 -0.16 0.00 -0.26 0.00 0.00 58.87 57.66 2hkh n SER 79 Cb 0.36 -3.93 -0.15 0.00 -0.26 0.00 0.00 64.21 60.23 2hkh n SER 79 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2hkh s MET 80 N -6.08 0.45 -0.01 4.33 1.00 -0.37 -2.73 119.30 115.89 2hkh s MET 80 Ca 0.05 -0.17 0.08 0.00 0.00 0.00 0.00 55.69 55.64 2hkh s MET 80 Cb -0.02 -0.44 -0.02 0.00 0.00 0.00 0.00 34.83 34.34 2hkh s MET 80 CO 0.82 0.09 -0.25 0.42 0.00 0.00 0.00 175.02 176.11 2hkh s ILE 81 N -0.02 1.95 0.25 2.53 1.09 0.71 -0.70 121.20 127.02 2hkh s ILE 81 Ca 0.01 -1.09 0.10 0.00 -1.10 0.00 0.00 60.65 58.57 2hkh s ILE 81 Cb -0.03 -1.62 -0.05 0.00 -1.06 0.00 0.00 42.46 39.69 2hkh s ILE 81 CO -0.00 0.52 -0.18 -0.31 -0.10 0.00 0.00 174.94 174.87 2hkh s TYR 82 N -0.61 2.07 -0.24 3.97 2.02 0.29 -0.15 117.35 124.71 2hkh s TYR 82 Ca 0.10 -0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 56.34 2hkh s TYR 82 Cb -0.09 -0.92 0.08 0.00 -0.40 0.00 0.00 41.96 40.62 2hkh s TYR 82 CO -0.01 0.58 0.08 -1.17 -1.57 0.00 0.00 175.55 173.47 2hkh s LEU 83 N -3.44 1.14 -0.53 -1.29 2.96 0.92 -1.82 118.68 116.62 2hkh s LEU 83 Ca 0.27 -1.08 -0.27 0.00 -0.22 0.00 0.00 54.13 52.83 2hkh s LEU 83 Cb -0.03 -0.54 0.03 0.00 0.50 0.00 0.00 46.19 46.14 2hkh s LEU 83 CO 0.12 -0.37 1.07 -1.10 -1.32 0.00 0.00 176.35 174.75 2hkh s GLN 84 N 1.90 3.51 -0.19 1.98 -0.21 0.16 -0.84 119.66 125.97 2hkh s GLN 84 Ca 0.04 0.15 -0.04 0.00 0.02 0.00 0.00 55.36 55.53 2hkh s GLN 84 Cb -0.17 -3.99 -0.02 0.00 1.00 0.00 0.00 33.01 29.83 2hkh s GLN 84 CO -0.19 -1.50 -0.02 -1.64 -2.12 0.00 0.00 175.29 169.83 2hkh s MET 85 N 4.39 3.58 0.07 2.91 -1.94 0.16 -0.15 119.30 128.31 2hkh s MET 85 Ca 0.39 -0.54 0.01 0.00 -1.71 0.00 0.00 55.69 53.84 2hkh s MET 85 Cb -0.09 -3.02 -0.04 0.00 2.01 0.00 0.00 34.83 33.68 2hkh s MET 85 CO 0.25 0.02 -0.05 -0.80 -0.01 0.00 0.00 175.02 174.43 2hkh s ASN 86 N 0.95 0.82 -1.43 3.03 0.01 -0.77 0.97 114.94 118.53 2hkh s ASN 86 Ca 0.01 -0.95 -0.10 0.00 -0.71 0.00 0.00 52.86 51.10 2hkh s ASN 86 Cb -0.14 0.13 0.04 0.00 0.41 0.00 0.00 41.25 41.69 2hkh s ASN 86 CO 0.01 -0.50 1.06 -3.20 -1.51 0.00 0.00 177.10 172.97 2hkh n ASN 87 N 0.18 -5.23 -4.73 -1.22 2.85 -1.05 -4.64 115.26 101.42 2hkh n ASN 87 Ca -0.14 -0.67 -0.42 0.00 -0.11 0.00 0.00 54.58 53.24 2hkh n ASN 87 Cb 0.60 -4.47 -0.01 0.00 1.24 0.00 0.00 39.78 37.15 2hkh n ASN 87 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2hkh n LEU 88 N -4.79 4.08 -4.43 1.20 4.32 -0.44 -4.67 117.00 112.27 2hkh n LEU 88 Ca -0.00 1.19 -0.22 0.00 -0.02 0.00 0.00 56.01 56.95 2hkh n LEU 88 Cb 0.55 -1.55 -0.10 0.00 -1.62 0.00 0.00 43.42 40.71 2hkh n LEU 88 CO 0.70 -0.12 -0.47 -0.54 -1.22 0.00 0.00 177.39 175.73 2hkh s LYS 89 N -1.42 1.55 0.32 3.23 1.02 -1.26 0.56 119.74 123.75 2hkh s LYS 89 Ca 0.59 -1.69 0.06 0.00 0.02 0.00 0.00 55.97 54.95 2hkh s LYS 89 Cb -0.53 -1.56 0.74 0.00 -0.52 0.00 0.00 37.83 35.96 2hkh s LYS 89 CO 0.58 0.29 1.82 1.79 -0.92 0.00 0.00 175.35 178.91 2hkh h THR 90 N 2.42 0.80 0.00 2.17 1.35 -1.96 -0.31 112.91 117.38 2hkh h THR 90 Ca -0.40 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2hkh h THR 90 Cb 1.24 -0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 2hkh h THR 90 CO 0.60 0.14 0.00 -0.62 -0.25 0.00 0.00 175.52 175.39 2hkh n GLU 91 N -4.65 0.49 0.00 4.72 4.71 -1.26 -1.59 120.64 123.07 2hkh n GLU 91 Ca 0.20 0.04 0.15 0.00 -0.01 0.00 0.00 57.16 57.54 2hkh n GLU 91 Cb 0.50 -1.50 0.71 0.00 -1.01 0.00 0.00 31.44 30.14 2hkh n GLU 91 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2hkh n ASP 92 N -1.14 0.58 -4.65 1.62 8.00 -0.13 -4.85 116.55 115.98 2hkh n ASP 92 Ca 0.13 -0.98 -0.42 0.00 0.71 0.00 0.00 54.79 54.23 2hkh n ASP 92 Cb 0.12 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 2hkh n ASP 92 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2hkh s THR 93 N -2.17 3.21 -0.08 -3.53 2.01 -0.62 -4.87 115.64 109.58 2hkh s THR 93 Ca 0.38 0.25 -0.32 0.00 0.31 0.00 0.00 61.69 62.31 2hkh s THR 93 Cb 0.21 -3.17 0.12 0.00 0.01 0.00 0.00 72.50 69.66 2hkh s THR 93 CO 0.40 -0.04 1.07 0.00 -0.69 0.00 0.00 174.62 175.36 2hkh s ALA 94 N 4.78 -1.96 0.07 7.40 0.00 -0.89 -4.32 121.76 126.84 2hkh s ALA 94 Ca 0.85 1.21 -0.30 0.00 0.00 0.00 0.00 51.96 53.72 2hkh s ALA 94 Cb -0.38 0.18 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 2hkh s ALA 94 CO 0.37 -0.69 1.01 1.41 0.00 0.00 0.00 175.76 177.86 2hkh s MET 95 N -2.75 4.60 -0.22 0.00 -2.45 -0.09 -1.66 119.30 116.73 2hkh s MET 95 Ca 0.08 1.50 -0.08 0.00 -1.25 0.00 0.00 55.69 55.94 2hkh s MET 95 Cb -0.01 -3.40 -0.04 0.00 1.25 0.00 0.00 34.83 32.64 2hkh s MET 95 CO -0.06 0.04 0.10 0.71 1.05 0.00 0.00 175.02 176.86 2hkh s TYR 96 N 0.51 3.22 -0.08 4.11 1.51 0.12 -1.20 117.35 125.52 2hkh s TYR 96 Ca 0.51 -0.02 0.03 0.00 -1.01 0.00 0.00 57.07 56.58 2hkh s TYR 96 Cb -0.24 -2.20 -0.02 0.00 -0.11 0.00 0.00 41.96 39.40 2hkh s TYR 96 CO 0.30 -0.04 -0.17 0.71 -1.11 0.00 0.00 175.55 175.23 2hkh s TYR 97 N 1.02 2.66 -0.15 2.71 1.51 0.90 -1.74 117.35 124.27 2hkh s TYR 97 Ca 0.05 -0.55 -0.09 0.00 -1.01 0.00 0.00 57.07 55.47 2hkh s TYR 97 Cb -0.14 -1.71 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 2hkh s TYR 97 CO 0.03 -0.11 0.15 0.00 -1.11 0.00 0.00 175.55 174.51 2hkh s VAL 99 N -0.40 0.67 0.00 0.00 1.01 0.20 -4.16 120.40 117.72 2hkh s VAL 99 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.91 2hkh s VAL 99 Cb -0.12 -0.68 0.00 0.00 0.00 0.00 0.00 36.38 35.58 2hkh s VAL 99 CO 0.02 0.26 0.00 0.41 0.00 0.00 0.00 175.10 175.79 2hkh n THR 100 N 4.11 0.00 -3.65 3.92 -1.04 -1.10 -1.50 114.28 115.01 2hkh n THR 100 Ca -0.23 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.67 2hkh n THR 100 Cb 0.51 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.94 2hkh n THR 100 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 2hkh s TYR 101 N -3.12 -0.84 0.01 -1.42 1.13 -1.26 0.61 117.35 112.46 2hkh s TYR 101 Ca 0.00 1.88 -0.26 0.00 -1.41 0.00 0.00 57.07 57.27 2hkh s TYR 101 Cb 0.00 0.39 -0.14 0.00 -1.10 0.00 0.00 41.96 41.10 2hkh s TYR 101 CO 0.00 -0.41 1.11 0.78 -2.51 0.00 0.00 175.55 174.51 2hkh h GLY 102 N 5.90 -0.98 -1.85 5.49 0.00 -1.98 -3.43 103.07 106.22 2hkh h GLY 102 Ca -0.30 0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 2hkh h GLY 102 CO 0.13 -0.36 -0.40 0.70 0.00 0.00 0.00 176.54 176.61 2hkh n ASN 103 N -5.29 -0.23 -3.55 0.19 3.02 -1.26 -5.04 115.26 103.10 2hkh n ASN 103 Ca -0.12 -1.76 -0.29 0.00 -0.03 0.00 0.00 54.58 52.38 2hkh n ASN 103 Cb 0.37 0.05 -0.14 0.00 -0.61 0.00 0.00 39.78 39.45 2hkh n ASN 103 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2hkh s HIS 104 N 0.00 0.81 0.28 3.10 3.76 -1.26 -5.12 115.29 116.86 2hkh s HIS 104 Ca 0.07 -1.43 -0.27 0.00 -0.15 0.00 0.00 55.06 53.28 2hkh s HIS 104 Cb 0.08 -1.10 -0.15 0.00 1.11 0.00 0.00 32.58 32.52 2hkh s HIS 104 CO -0.04 -0.83 0.73 -2.30 -0.85 0.00 0.00 174.74 171.45 2hkh n PRO 105 N 4.56 0.69 -2.46 8.40 -0.02 -1.26 -2.06 135.00 142.85 2hkh n PRO 105 Ca 0.03 0.24 -0.06 0.00 -2.02 0.00 0.00 63.50 61.70 2hkh n PRO 105 Cb 0.39 -1.46 -0.00 0.00 -0.02 0.00 0.00 33.50 32.41 2hkh n PRO 105 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2hkh n PHE 106 N -0.08 -1.71 0.27 6.00 3.72 -1.25 -4.91 117.46 119.50 2hkh n PHE 106 Ca 0.13 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.38 2hkh n PHE 106 Cb 0.31 -1.85 -0.08 0.00 -0.94 0.00 0.00 39.48 36.92 2hkh n PHE 106 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2hkh h ALA 107 N 1.00 -0.69 -2.45 4.37 0.00 0.76 -3.43 119.26 118.82 2hkh h ALA 107 Ca -0.14 -0.19 -0.70 0.00 0.00 0.00 0.00 54.91 53.87 2hkh h ALA 107 Cb 1.10 0.27 -0.20 0.00 0.00 0.00 0.00 17.79 18.96 2hkh h ALA 107 CO 0.17 -0.76 -0.32 0.71 0.00 0.00 0.00 179.25 179.05 2hkh s TYR 108 N -4.96 3.20 -0.12 0.00 2.02 0.41 -4.96 117.35 112.94 2hkh s TYR 108 Ca -0.15 -0.44 -0.01 0.00 -0.37 0.00 0.00 57.07 56.10 2hkh s TYR 108 Cb 0.02 -2.74 -0.03 0.00 -0.40 0.00 0.00 41.96 38.82 2hkh s TYR 108 CO 0.52 -0.63 -0.07 -1.58 -1.57 0.00 0.00 175.55 172.22 2hkh s TRP 109 N 1.92 2.94 0.15 2.71 0.52 -1.26 -2.72 118.94 123.19 2hkh s TRP 109 Ca 0.09 -0.27 -0.02 0.00 0.02 0.00 0.00 56.10 55.92 2hkh s TRP 109 Cb -0.18 -1.85 0.03 0.00 -1.15 0.00 0.00 33.47 30.33 2hkh s TRP 109 CO 0.12 0.05 0.20 0.41 0.02 0.00 0.00 176.95 177.75 2hkh n GLY 110 N 3.08 -0.68 0.17 0.98 0.00 -1.26 -4.91 105.19 102.58 2hkh n GLY 110 Ca -0.18 -1.75 0.04 0.00 0.00 0.00 0.00 46.02 44.13 2hkh n GLY 110 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2hkh h GLN 111 N 0.00 0.00 0.00 1.61 1.08 -1.96 -3.49 115.11 112.35 2hkh h GLN 111 Ca -0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2hkh h GLN 111 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2hkh h GLN 111 CO 0.05 0.44 0.00 0.41 -0.95 0.00 0.00 178.83 178.78 2hkh n GLY 112 N 0.29 1.11 3.06 3.46 0.00 -1.26 -5.01 105.19 106.84 2hkh n GLY 112 Ca -0.00 -2.01 -0.25 0.00 0.00 0.00 0.00 46.02 43.76 2hkh n GLY 112 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2hkh s THR 113 N -1.85 1.20 -0.09 2.61 -1.32 -0.71 -4.73 115.64 110.75 2hkh s THR 113 Ca 0.00 -0.55 -0.17 0.00 -1.21 0.00 0.00 61.69 59.76 2hkh s THR 113 Cb 0.00 -1.07 -0.05 0.00 -1.51 0.00 0.00 72.50 69.88 2hkh s THR 113 CO 0.00 0.36 0.46 -0.22 -2.21 0.00 0.00 174.62 173.01 2hkh s LEU 114 N 0.41 4.32 -0.18 9.08 0.20 -1.26 -0.70 118.68 130.55 2hkh s LEU 114 Ca -0.10 0.85 -0.01 0.00 0.69 0.00 0.00 54.13 55.55 2hkh s LEU 114 Cb -0.14 -2.67 -0.00 0.00 -0.43 0.00 0.00 46.19 42.95 2hkh s LEU 114 CO 0.03 0.08 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.37 2hkh s VAL 115 N 0.23 2.92 -0.30 1.68 1.01 -0.66 -0.14 120.40 125.15 2hkh s VAL 115 Ca 0.25 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 2hkh s VAL 115 Cb -0.16 -2.28 0.05 0.00 0.00 0.00 0.00 36.38 33.99 2hkh s VAL 115 CO 0.11 0.48 -0.01 -0.89 0.00 0.00 0.00 175.10 174.79 2hkh s THR 116 N 1.12 2.94 -0.54 3.92 2.01 -0.23 -2.09 115.64 122.77 2hkh s THR 116 Ca 0.01 -1.38 -0.17 0.00 0.31 0.00 0.00 61.69 60.46 2hkh s THR 116 Cb -0.14 -2.69 0.10 0.00 0.01 0.00 0.00 72.50 69.79 2hkh s THR 116 CO -0.03 -0.09 0.56 -0.69 -0.69 0.00 0.00 174.62 173.68 2hkh s VAL 117 N 1.25 5.06 0.04 3.82 1.01 -1.26 -1.19 120.40 129.12 2hkh s VAL 117 Ca -0.05 -1.17 -0.00 0.00 0.00 0.00 0.00 61.98 60.76 2hkh s VAL 117 Cb -0.20 -4.35 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 2hkh s VAL 117 CO -0.01 -0.89 -0.04 -0.55 0.00 0.00 0.00 175.10 173.61 2hkh s SER 118 N 3.35 0.42 0.00 3.32 0.15 -0.70 -4.33 113.70 115.91 2hkh s SER 118 Ca 0.07 -0.70 0.16 0.00 0.70 0.00 0.00 55.95 56.19 2hkh s SER 118 Cb -0.26 0.13 0.44 0.00 -1.71 0.00 0.00 66.02 64.62 2hkh s SER 118 CO 0.05 -0.40 1.36 0.00 1.20 0.00 0.00 173.24 175.46 2hkh n ALA 119 N 1.00 2.29 -1.76 5.45 0.00 -1.26 -3.75 120.51 122.47 2hkh n ALA 119 Ca -0.20 -1.17 -0.34 0.00 0.00 0.00 0.00 53.44 51.73 2hkh n ALA 119 Cb 0.57 -0.66 -0.02 0.00 0.00 0.00 0.00 19.45 19.34 2hkh n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hkh s ALA 120 N -1.03 2.84 0.07 0.00 0.00 -1.26 -5.07 121.76 117.30 2hkh s ALA 120 Ca 0.34 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.87 2hkh s ALA 120 Cb 0.18 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.02 2hkh s ALA 120 CO 0.24 -0.45 0.09 0.21 0.00 0.00 0.00 175.76 175.85 2hkh s LYS 121 N -3.49 2.96 0.26 0.00 2.20 -1.26 -5.07 119.74 115.34 2hkh s LYS 121 Ca 0.66 -0.64 -0.30 0.00 -0.36 0.00 0.00 55.97 55.33 2hkh s LYS 121 Cb -0.16 -2.78 -0.14 0.00 -1.51 0.00 0.00 37.83 33.24 2hkh s LYS 121 CO 0.25 0.58 1.23 -2.37 -0.36 0.00 0.00 175.35 174.68 2hkh n THR 122 N 0.51 1.42 -3.71 3.43 5.66 -1.26 -4.67 114.28 115.65 2hkh n THR 122 Ca -0.09 -0.35 -0.15 0.00 -3.05 0.00 0.00 64.05 60.41 2hkh n THR 122 Cb 0.52 -1.24 -0.15 0.00 -1.55 0.00 0.00 70.33 67.91 2hkh n THR 122 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2hkh s THR 123 N -0.55 -0.14 0.59 1.09 2.01 0.15 -4.90 115.64 113.89 2hkh s THR 123 Ca 0.64 0.25 -0.18 0.00 0.31 0.00 0.00 61.69 62.71 2hkh s THR 123 Cb -0.69 -0.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 2hkh s THR 123 CO 0.55 0.10 1.17 -2.16 -0.69 0.00 0.00 174.62 173.60 2hkh s PRO 124 N 1.64 3.03 0.46 4.92 0.04 -1.26 -2.27 135.00 141.55 2hkh s PRO 124 Ca -0.04 1.71 -0.22 0.00 0.04 0.00 0.00 61.00 62.50 2hkh s PRO 124 Cb -0.12 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 2hkh s PRO 124 CO -0.06 -1.13 1.06 -1.25 0.04 0.00 0.00 177.00 175.65 2hkh s PRO 125 N -3.42 3.89 -0.04 0.56 0.04 -1.26 -4.43 135.00 130.34 2hkh s PRO 125 Ca 0.75 1.46 -0.20 0.00 0.04 0.00 0.00 61.00 63.05 2hkh s PRO 125 Cb -0.27 -2.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.96 2hkh s PRO 125 CO 0.33 -0.37 0.55 -1.12 0.04 0.00 0.00 177.00 176.43 2hkh s SER 126 N -1.78 6.88 -0.23 6.66 0.01 0.22 -4.88 113.70 120.58 2hkh s SER 126 Ca 0.64 1.04 0.02 0.00 1.31 0.00 0.00 55.95 58.97 2hkh s SER 126 Cb -0.20 -2.34 0.04 0.00 0.21 0.00 0.00 66.02 63.74 2hkh s SER 126 CO 0.24 0.08 -0.14 -0.69 0.41 0.00 0.00 173.24 173.14 2hkh s VAL 127 N 0.04 2.19 -0.07 3.43 1.01 -1.26 -0.54 120.40 125.20 2hkh s VAL 127 Ca 0.29 -1.36 0.03 0.00 0.00 0.00 0.00 61.98 60.94 2hkh s VAL 127 Cb -0.17 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.03 2hkh s VAL 127 CO 0.15 0.18 -0.15 -0.31 0.00 0.00 0.00 175.10 174.97 2hkh s TYR 128 N 1.18 2.70 0.31 5.22 2.02 -0.51 -4.97 117.35 123.30 2hkh s TYR 128 Ca -0.04 -0.31 -0.28 0.00 -0.37 0.00 0.00 57.07 56.07 2hkh s TYR 128 Cb -0.17 -1.67 -0.09 0.00 -0.40 0.00 0.00 41.96 39.62 2hkh s TYR 128 CO -0.08 0.06 1.02 -1.25 -1.57 0.00 0.00 175.55 173.73 2hkh s PRO 129 N -0.44 4.58 -0.42 -1.71 0.04 -1.26 -0.79 135.00 134.99 2hkh s PRO 129 Ca 0.05 1.56 -0.00 0.00 0.04 0.00 0.00 61.00 62.65 2hkh s PRO 129 Cb -0.12 -2.98 0.11 0.00 0.04 0.00 0.00 34.50 31.55 2hkh s PRO 129 CO 0.02 0.22 0.19 -0.51 0.04 0.00 0.00 177.00 176.96 2hkh s LEU 130 N -1.78 5.04 0.05 -3.56 1.43 0.22 -4.86 118.68 115.23 2hkh s LEU 130 Ca 0.48 -2.23 0.09 0.00 -1.03 0.00 0.00 54.13 51.43 2hkh s LEU 130 Cb -0.25 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 2hkh s LEU 130 CO 0.32 -0.45 -0.24 0.00 0.23 0.00 0.00 176.35 176.21 2hkh s ALA 131 N 0.83 2.05 0.75 4.21 0.00 -1.26 -1.54 121.76 126.81 2hkh s ALA 131 Ca 0.11 -1.20 -0.10 0.00 0.00 0.00 0.00 51.96 50.77 2hkh s ALA 131 Cb -0.22 -0.41 0.06 0.00 0.00 0.00 0.00 23.12 22.56 2hkh s ALA 131 CO -0.05 0.47 1.11 -1.25 0.00 0.00 0.00 175.76 176.04 2hkh s PRO 132 N -1.28 2.18 0.00 0.00 0.04 -1.26 -5.01 135.00 129.67 2hkh s PRO 132 Ca 0.10 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.17 2hkh s PRO 132 Cb -0.10 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2hkh s PRO 132 CO 0.02 -1.38 0.00 0.41 0.04 0.00 0.00 177.00 176.09 2hkh n GLY 133 N -3.12 4.52 0.18 0.56 0.00 -1.26 -4.79 105.19 101.28 2hkh n GLY 133 Ca 0.08 -0.83 0.01 0.00 0.00 0.00 0.00 46.02 45.28 2hkh n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hkh n THR 138 N -0.17 0.00 -2.30 0.00 -1.04 -1.26 -5.38 114.28 104.13 2hkh n THR 138 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 2hkh n THR 138 Cb 0.56 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 2hkh n THR 138 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2hkh n GLY 139 N 0.00 4.73 0.12 3.41 0.00 -1.26 -5.08 105.19 107.11 2hkh n GLY 139 Ca 0.00 -1.99 -0.20 0.00 0.00 0.00 0.00 46.02 43.82 2hkh n GLY 139 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2hkh h SER 140 N 0.00 0.42 -3.11 1.61 0.02 -2.00 -3.43 113.55 107.06 2hkh h SER 140 Ca 0.00 -0.92 -0.64 0.00 -0.84 0.00 0.00 61.79 59.40 2hkh h SER 140 Cb 0.00 -0.14 -0.08 0.00 0.14 0.00 0.00 62.40 62.33 2hkh h SER 140 CO 0.00 1.45 -0.57 -0.44 -1.14 0.00 0.00 176.83 176.13 2hkh s SER 141 N -6.97 5.74 -0.09 3.07 0.01 -1.26 -1.00 113.70 113.21 2hkh s SER 141 Ca -0.16 0.07 0.03 0.00 1.31 0.00 0.00 55.95 57.20 2hkh s SER 141 Cb 0.02 -1.61 0.01 0.00 0.21 0.00 0.00 66.02 64.64 2hkh s SER 141 CO 0.80 0.18 -0.20 0.54 0.41 0.00 0.00 173.24 174.97 2hkh s VAL 142 N -1.41 1.77 -0.21 3.43 0.11 0.27 -4.73 120.40 119.63 2hkh s VAL 142 Ca 0.30 -0.84 -0.10 0.00 -2.93 0.00 0.00 61.98 58.41 2hkh s VAL 142 Cb -0.12 -1.55 -0.05 0.00 -1.53 0.00 0.00 36.38 33.13 2hkh s VAL 142 CO 0.23 0.50 0.13 -0.89 -3.33 0.00 0.00 175.10 171.73 2hkh s THR 143 N 0.50 5.21 0.38 5.04 2.01 -1.26 -1.55 115.64 125.96 2hkh s THR 143 Ca -0.16 0.12 0.06 0.00 0.31 0.00 0.00 61.69 62.02 2hkh s THR 143 Cb -0.17 -3.40 -0.07 0.00 0.01 0.00 0.00 72.50 68.87 2hkh s THR 143 CO 0.06 0.40 0.02 -0.76 -0.69 0.00 0.00 174.62 173.65 2hkh s LEU 144 N 0.70 2.67 0.15 4.42 1.43 0.72 -4.65 118.68 124.12 2hkh s LEU 144 Ca 0.07 -1.36 -0.24 0.00 -1.03 0.00 0.00 54.13 51.56 2hkh s LEU 144 Cb -0.12 -0.75 0.06 0.00 0.03 0.00 0.00 46.19 45.41 2hkh s LEU 144 CO 0.01 -0.48 0.78 -0.83 0.23 0.00 0.00 176.35 176.07 2hkh s GLY 145 N -3.64 -0.37 -0.02 -3.19 0.00 -0.59 -0.91 107.32 98.61 2hkh s GLY 145 Ca 0.35 0.34 0.06 0.00 0.00 0.00 0.00 44.72 45.47 2hkh s GLY 145 CO 0.17 0.11 -0.19 0.00 0.00 0.00 0.00 173.10 173.19 2hkh s LEU 147 N -0.35 3.87 -0.30 0.00 2.96 0.03 -1.53 118.68 123.35 2hkh s LEU 147 Ca 0.05 -0.26 -0.01 0.00 -0.22 0.00 0.00 54.13 53.69 2hkh s LEU 147 Cb -0.08 -2.02 0.05 0.00 0.50 0.00 0.00 46.19 44.64 2hkh s LEU 147 CO -0.00 -0.10 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.23 2hkh s VAL 148 N 1.66 2.90 -0.06 1.68 1.01 0.12 -1.42 120.40 126.29 2hkh s VAL 148 Ca 0.06 -1.44 0.01 0.00 0.00 0.00 0.00 61.98 60.62 2hkh s VAL 148 Cb -0.16 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.56 2hkh s VAL 148 CO 0.07 -0.12 -0.07 -0.75 0.00 0.00 0.00 175.10 174.23 2hkh s LYS 149 N 1.23 1.19 -0.46 2.72 2.20 0.30 -0.37 119.74 126.55 2hkh s LYS 149 Ca -0.05 -0.22 -0.02 0.00 -0.36 0.00 0.00 55.97 55.32 2hkh s LYS 149 Cb -0.20 -1.11 -0.02 0.00 -1.51 0.00 0.00 37.83 34.99 2hkh s LYS 149 CO -0.02 -0.07 0.40 0.41 -0.36 0.00 0.00 175.35 175.71 2hkh n GLY 150 N 4.09 0.07 3.43 5.54 0.00 0.26 -0.61 105.19 117.97 2hkh n GLY 150 Ca -0.22 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 2hkh n GLY 150 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2hkh s TYR 151 N -3.16 2.28 -0.23 1.61 -0.85 -0.60 -4.27 117.35 112.13 2hkh s TYR 151 Ca 0.13 -0.36 -0.19 0.00 -0.52 0.00 0.00 57.07 56.12 2hkh s TYR 151 Cb -0.02 -1.12 0.06 0.00 0.38 0.00 0.00 41.96 41.27 2hkh s TYR 151 CO 0.31 0.52 0.59 0.12 -1.52 0.00 0.00 175.55 175.57 2hkh s PHE 152 N -1.77 -0.70 0.96 -3.49 2.19 -0.96 -1.02 117.98 113.18 2hkh s PHE 152 Ca 0.22 1.64 -0.15 0.00 0.33 0.00 0.00 56.93 58.97 2hkh s PHE 152 Cb -0.08 0.28 0.22 0.00 -1.31 0.00 0.00 43.02 42.13 2hkh s PHE 152 CO 0.10 -0.34 1.31 -0.35 1.83 0.00 0.00 175.22 177.77 2hkh n PRO 153 N 3.06 -1.16 -0.52 10.12 -0.04 -1.26 0.34 135.00 145.54 2hkh n PRO 153 Ca -0.15 -2.19 -0.29 0.00 -0.04 0.00 0.00 63.50 60.83 2hkh n PRO 153 Cb 0.56 -1.29 0.24 0.00 -0.04 0.00 0.00 33.50 32.97 2hkh n PRO 153 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2hkh n GLU 154 N -3.73 -2.30 -0.33 0.54 0.00 -1.26 -4.79 120.64 108.77 2hkh n GLU 154 Ca 0.17 -0.64 0.00 0.00 0.00 0.00 0.00 57.16 56.69 2hkh n GLU 154 Cb 0.59 -2.07 0.00 0.00 0.00 0.00 0.00 31.44 29.96 2hkh n GLU 154 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 2hkh n SER 155 N -4.28 -0.44 -4.45 4.31 7.64 -1.26 -4.95 113.62 110.19 2hkh n SER 155 Ca 0.03 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.65 2hkh n SER 155 Cb 0.56 -0.22 -0.11 0.00 -1.01 0.00 0.00 64.21 63.43 2hkh n SER 155 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2hkh s VAL 156 N -0.15 2.45 -0.07 0.44 -7.23 -1.26 -4.29 120.40 110.29 2hkh s VAL 156 Ca 0.00 -2.19 -0.02 0.00 -1.81 0.00 0.00 61.98 57.96 2hkh s VAL 156 Cb 0.00 -2.23 0.03 0.00 0.56 0.00 0.00 36.38 34.74 2hkh s VAL 156 CO 0.00 -0.25 0.02 -0.89 -0.31 0.00 0.00 175.10 173.67 2hkh s THR 157 N -2.07 0.24 -0.38 5.32 2.01 -0.64 -4.97 115.64 115.15 2hkh s THR 157 Ca 0.25 0.19 -0.16 0.00 0.31 0.00 0.00 61.69 62.28 2hkh s THR 157 Cb -0.07 -0.44 0.01 0.00 0.01 0.00 0.00 72.50 72.01 2hkh s THR 157 CO 0.13 0.22 0.37 -0.69 -0.69 0.00 0.00 174.62 173.95 2hkh s VAL 158 N 2.03 5.17 -0.23 3.82 1.01 -1.26 -0.90 120.40 130.04 2hkh s VAL 158 Ca 0.05 -0.25 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 2hkh s VAL 158 Cb -0.12 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2hkh s VAL 158 CO -0.05 -0.25 0.09 -0.89 0.00 0.00 0.00 175.10 174.01 2hkh s THR 159 N 1.97 4.68 -0.11 3.92 2.01 0.11 -4.92 115.64 123.30 2hkh s THR 159 Ca 0.10 -0.05 -0.18 0.00 0.31 0.00 0.00 61.69 61.87 2hkh s THR 159 Cb -0.17 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 2hkh s THR 159 CO 0.12 0.37 0.46 0.26 -0.69 0.00 0.00 174.62 175.14 2hkh s TRP 160 N 1.16 3.52 -0.78 4.92 0.52 -1.26 0.54 118.94 127.56 2hkh s TRP 160 Ca 0.05 0.87 0.03 0.00 0.02 0.00 0.00 56.10 57.07 2hkh s TRP 160 Cb -0.14 -2.52 0.26 0.00 -1.15 0.00 0.00 33.47 29.92 2hkh s TRP 160 CO 0.04 0.21 0.91 0.09 0.02 0.00 0.00 176.95 178.22 2hkh n ASN 161 N 3.54 4.42 -3.50 2.95 3.02 0.14 -4.99 115.26 120.83 2hkh n ASN 161 Ca -0.08 -3.40 0.01 0.00 -0.03 0.00 0.00 54.58 51.08 2hkh n ASN 161 Cb 0.52 -0.86 -0.05 0.00 -0.61 0.00 0.00 39.78 38.77 2hkh n ASN 161 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2hkh s SER 167 N -2.03 -0.37 -1.28 6.41 1.04 -1.26 -3.08 113.70 113.13 2hkh s SER 167 Ca 0.36 0.56 -0.06 0.00 0.48 0.00 0.00 55.95 57.29 2hkh s SER 167 Cb 0.09 1.29 0.15 0.00 0.10 0.00 0.00 66.02 67.65 2hkh s SER 167 CO -0.00 -0.08 2.22 -1.20 0.98 0.00 0.00 173.24 175.15 2hkh n SER 168 N 4.09 7.40 -4.38 7.02 7.64 -1.26 -4.91 113.62 129.22 2hkh n SER 168 Ca -0.14 -3.19 -0.32 0.00 1.01 0.00 0.00 58.87 56.23 2hkh n SER 168 Cb 0.55 -1.36 -0.14 0.00 -1.01 0.00 0.00 64.21 62.25 2hkh n SER 168 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2hkh s VAL 169 N -1.18 2.80 -0.13 0.44 1.01 -1.26 -2.77 120.40 119.31 2hkh s VAL 169 Ca 0.49 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 2hkh s VAL 169 Cb 0.16 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2hkh s VAL 169 CO -0.07 0.56 -0.10 -1.00 0.00 0.00 0.00 175.10 174.49 2hkh s HIS 170 N -0.18 2.88 -0.33 5.22 3.76 -0.56 -4.99 115.29 121.10 2hkh s HIS 170 Ca -0.01 -0.49 -0.02 0.00 -0.15 0.00 0.00 55.06 54.39 2hkh s HIS 170 Cb -0.13 -1.87 0.06 0.00 1.11 0.00 0.00 32.58 31.75 2hkh s HIS 170 CO 0.03 -0.12 0.05 0.99 -0.85 0.00 0.00 174.74 174.85 2hkh s THR 171 N 0.28 3.12 -0.16 1.30 2.01 -1.26 -1.19 115.64 119.74 2hkh s THR 171 Ca -0.07 -1.50 -0.28 0.00 0.31 0.00 0.00 61.69 60.15 2hkh s THR 171 Cb -0.15 -2.87 -0.01 0.00 0.01 0.00 0.00 72.50 69.48 2hkh s THR 171 CO 0.05 -0.24 0.96 -0.36 -0.69 0.00 0.00 174.62 174.34 2hkh s PHE 172 N 1.24 3.44 0.59 4.92 0.40 -0.63 -5.01 117.98 122.93 2hkh s PHE 172 Ca -0.02 1.45 -0.20 0.00 -0.60 0.00 0.00 56.93 57.56 2hkh s PHE 172 Cb -0.20 -3.15 -0.03 0.00 0.51 0.00 0.00 43.02 40.14 2hkh s PHE 172 CO -0.01 -0.29 1.33 -2.30 0.70 0.00 0.00 175.22 174.65 2hkh n PRO 173 N 5.41 1.47 -2.49 0.24 -0.02 -1.26 -4.08 135.00 134.26 2hkh n PRO 173 Ca 0.08 0.55 -0.33 0.00 -2.02 0.00 0.00 63.50 61.78 2hkh n PRO 173 Cb 0.48 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.37 2hkh n PRO 173 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hkh s ALA 174 N -1.32 2.90 0.02 3.55 0.00 -1.26 -4.87 121.76 120.78 2hkh s ALA 174 Ca 0.76 0.48 0.08 0.00 0.00 0.00 0.00 51.96 53.28 2hkh s ALA 174 Cb -0.40 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 2hkh s ALA 174 CO 0.46 -0.30 -0.25 -0.51 0.00 0.00 0.00 175.76 175.16 2hkh s LEU 175 N -3.68 2.12 -0.20 0.00 2.01 -0.97 -4.95 118.68 113.01 2hkh s LEU 175 Ca 0.65 -0.52 -0.28 0.00 0.01 0.00 0.00 54.13 53.98 2hkh s LEU 175 Cb -0.14 -1.22 0.00 0.00 0.01 0.00 0.00 46.19 44.85 2hkh s LEU 175 CO 0.23 0.26 0.99 -0.22 1.01 0.00 0.00 176.35 178.61 2hkh s LEU 176 N -0.98 4.13 -0.30 1.79 1.98 -1.26 -2.32 118.68 121.72 2hkh s LEU 176 Ca 0.10 1.34 0.01 0.00 -2.89 0.00 0.00 54.13 52.69 2hkh s LEU 176 Cb -0.10 -3.47 0.07 0.00 0.66 0.00 0.00 46.19 43.35 2hkh s LEU 176 CO 0.01 -0.59 -0.01 -1.58 -1.89 0.00 0.00 176.35 172.29 2hkh s GLN 177 N 2.85 2.15 -0.43 1.98 2.00 0.28 -4.85 119.66 123.65 2hkh s GLN 177 Ca 0.43 -1.46 -0.03 0.00 -2.00 0.00 0.00 55.36 52.30 2hkh s GLN 177 Cb -0.16 -3.11 0.00 0.00 0.80 0.00 0.00 33.01 30.54 2hkh s GLN 177 CO 0.09 -0.70 0.29 0.45 -0.50 0.00 0.00 175.29 174.92 2hkh n SER 178 N 4.48 -2.25 0.00 6.67 2.88 -1.26 0.18 113.62 124.32 2hkh n SER 178 Ca -0.09 -0.50 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 2hkh n SER 178 Cb 0.42 -0.76 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 2hkh n SER 178 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2hkh n GLY 179 N -1.12 2.96 3.46 0.46 0.00 -1.26 -5.01 105.19 104.68 2hkh n GLY 179 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 2hkh n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hkh s LEU 180 N 0.00 2.56 0.12 0.99 1.43 0.13 -4.83 118.68 119.08 2hkh s LEU 180 Ca 0.00 -0.82 -0.12 0.00 -1.03 0.00 0.00 54.13 52.16 2hkh s LEU 180 Cb 0.00 -1.27 -0.06 0.00 0.03 0.00 0.00 46.19 44.89 2hkh s LEU 180 CO 0.00 0.11 0.48 -0.31 0.23 0.00 0.00 176.35 176.86 2hkh s TYR 181 N -1.75 3.58 -0.03 0.29 2.02 -0.19 0.10 117.35 121.36 2hkh s TYR 181 Ca 0.22 0.91 0.01 0.00 -0.37 0.00 0.00 57.07 57.84 2hkh s TYR 181 Cb -0.08 -2.26 0.02 0.00 -0.40 0.00 0.00 41.96 39.24 2hkh s TYR 181 CO 0.11 0.45 -0.04 0.99 -1.57 0.00 0.00 175.55 175.50 2hkh s THR 182 N -1.47 0.47 0.26 -0.71 2.01 -0.98 -0.57 115.64 114.64 2hkh s THR 182 Ca 0.37 -0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.26 2hkh s THR 182 Cb -0.14 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 2hkh s THR 182 CO 0.19 0.19 0.13 0.00 -0.69 0.00 0.00 174.62 174.45 2hkh s MET 183 N 0.71 1.41 0.05 4.92 0.23 0.50 -2.29 119.30 124.83 2hkh s MET 183 Ca -0.09 -1.78 -0.07 0.00 -1.03 0.00 0.00 55.69 52.73 2hkh s MET 183 Cb -0.12 -0.04 -0.01 0.00 -1.53 0.00 0.00 34.83 33.13 2hkh s MET 183 CO -0.00 -0.38 0.13 -1.54 -2.03 0.00 0.00 175.02 171.20 2hkh s SER 184 N -3.29 0.16 -0.02 -1.18 1.04 -1.26 0.11 113.70 109.25 2hkh s SER 184 Ca 0.38 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 56.27 2hkh s SER 184 Cb 0.07 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.45 2hkh s SER 184 CO 0.15 -0.57 -0.06 -0.55 0.98 0.00 0.00 173.24 173.18 2hkh s SER 185 N -2.33 0.93 0.00 7.02 0.15 -0.58 -1.61 113.70 117.28 2hkh s SER 185 Ca -0.02 -0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.51 2hkh s SER 185 Cb 0.01 -0.26 -0.04 0.00 -1.71 0.00 0.00 66.02 64.02 2hkh s SER 185 CO -0.06 0.03 0.00 -0.94 1.20 0.00 0.00 173.24 173.48 2hkh s SER 186 N 0.28 5.14 0.11 5.45 1.04 -0.33 -1.39 113.70 123.99 2hkh s SER 186 Ca -0.04 -0.01 0.09 0.00 0.48 0.00 0.00 55.95 56.47 2hkh s SER 186 Cb -0.08 -1.34 -0.04 0.00 0.10 0.00 0.00 66.02 64.66 2hkh s SER 186 CO 0.00 0.28 -0.22 0.54 0.98 0.00 0.00 173.24 174.82 2hkh s VAL 187 N -1.10 1.80 -0.09 5.02 0.11 -0.09 -1.50 120.40 124.56 2hkh s VAL 187 Ca 0.20 -1.58 0.00 0.00 -2.93 0.00 0.00 61.98 57.67 2hkh s VAL 187 Cb -0.12 -1.63 0.02 0.00 -1.53 0.00 0.00 36.38 33.13 2hkh s VAL 187 CO 0.11 -0.04 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.87 2hkh s THR 188 N -1.15 0.98 0.28 5.04 2.01 -1.11 -0.20 115.64 121.48 2hkh s THR 188 Ca 0.08 -0.30 0.07 0.00 0.31 0.00 0.00 61.69 61.85 2hkh s THR 188 Cb -0.10 -0.98 -0.06 0.00 0.01 0.00 0.00 72.50 71.38 2hkh s THR 188 CO 0.05 0.35 -0.09 0.68 -0.69 0.00 0.00 174.62 174.92 2hkh s VAL 189 N 1.40 1.79 0.73 3.82 -7.23 -0.60 -4.74 120.40 115.57 2hkh s VAL 189 Ca -0.01 -2.17 -0.16 0.00 -1.81 0.00 0.00 61.98 57.83 2hkh s VAL 189 Cb -0.13 -2.40 0.04 0.00 0.56 0.00 0.00 36.38 34.44 2hkh s VAL 189 CO -0.04 -0.34 1.25 -2.84 -0.31 0.00 0.00 175.10 172.82 2hkh s PRO 190 N -3.69 2.05 0.35 4.82 0.02 -1.26 -0.56 135.00 136.73 2hkh s PRO 190 Ca 0.29 1.92 0.10 0.00 0.02 0.00 0.00 61.00 63.34 2hkh s PRO 190 Cb 0.02 -1.80 0.66 0.00 0.02 0.00 0.00 34.50 33.40 2hkh s PRO 190 CO 0.12 -1.94 1.81 0.77 -0.33 0.00 0.00 177.00 177.42 2hkh h SER 191 N -0.21 0.10 0.00 2.53 0.02 -1.33 -2.50 113.55 112.15 2hkh h SER 191 Ca -0.49 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 2hkh h SER 191 Cb 1.32 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2hkh h SER 191 CO 0.49 0.45 0.03 -1.54 -1.14 0.00 0.00 176.83 175.12 2hkh n SER 192 N -4.11 0.00 -0.00 3.07 3.41 -1.26 -2.46 113.62 112.27 2hkh n SER 192 Ca -0.02 0.38 0.03 0.00 -0.26 0.00 0.00 58.87 59.01 2hkh n SER 192 Cb 0.40 -0.38 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 2hkh n SER 192 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2hkh n THR 193 N -1.38 0.00 -3.74 6.66 -2.24 -0.94 -4.82 114.28 107.82 2hkh n THR 193 Ca 0.00 -0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.30 2hkh n THR 193 Cb 0.03 0.99 -0.12 0.00 -2.10 0.00 0.00 70.33 69.13 2hkh n THR 193 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2hkh s TRP 194 N -1.58 -0.35 -2.10 4.78 -0.00 -1.03 -2.42 118.94 116.25 2hkh s TRP 194 Ca 0.02 0.81 0.15 0.00 -0.00 0.00 0.00 56.10 57.09 2hkh s TRP 194 Cb 0.05 0.09 0.68 0.00 -0.00 0.00 0.00 33.47 34.28 2hkh s TRP 194 CO 0.25 -0.22 1.47 -0.35 -0.00 0.00 0.00 176.95 178.10 2hkh n PRO 195 N 3.83 1.40 0.10 5.86 -0.04 -1.26 -4.72 135.00 140.16 2hkh n PRO 195 Ca -0.21 -0.60 0.19 0.00 -0.04 0.00 0.00 63.50 62.83 2hkh n PRO 195 Cb 0.55 -1.28 0.74 0.00 -0.04 0.00 0.00 33.50 33.47 2hkh n PRO 195 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2hkh h SER 196 N 1.13 0.00 -5.44 3.54 4.64 -1.86 -3.43 113.55 112.14 2hkh h SER 196 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2hkh h SER 196 Cb 0.25 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.21 2hkh h SER 196 CO 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 176.83 175.50 2hkh s GLN 197 N -4.81 1.26 -0.04 4.77 0.00 -1.01 -5.09 119.66 114.73 2hkh s GLN 197 Ca -0.05 -1.46 -0.30 0.00 -0.00 0.00 0.00 55.36 53.56 2hkh s GLN 197 Cb 0.17 0.33 -0.06 0.00 0.00 0.00 0.00 33.01 33.46 2hkh s GLN 197 CO 0.63 -0.45 1.61 0.99 0.00 0.00 0.00 175.29 178.07 2hkh s THR 198 N -4.09 3.58 -0.13 3.63 2.01 -1.26 -4.54 115.64 114.84 2hkh s THR 198 Ca 0.30 0.77 0.02 0.00 0.31 0.00 0.00 61.69 63.09 2hkh s THR 198 Cb 0.05 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 69.06 2hkh s THR 198 CO 0.09 -0.06 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.08 2hkh s VAL 199 N 3.71 2.36 -0.01 3.82 1.01 -1.26 -5.01 120.40 125.02 2hkh s VAL 199 Ca 0.71 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2hkh s VAL 199 Cb -0.33 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.10 2hkh s VAL 199 CO 0.29 0.54 -0.04 0.42 0.00 0.00 0.00 175.10 176.31 2hkh s THR 200 N 0.59 0.33 -0.22 3.92 -4.23 -1.18 -0.23 115.64 114.62 2hkh s THR 200 Ca -0.11 -0.15 -0.09 0.00 -1.18 0.00 0.00 61.69 60.16 2hkh s THR 200 Cb -0.16 -0.30 -0.04 0.00 1.34 0.00 0.00 72.50 73.34 2hkh s THR 200 CO 0.03 0.11 0.12 0.00 -0.54 0.00 0.00 174.62 174.33 2hkh s SER 202 N 0.94 5.97 -0.23 0.00 0.01 0.19 -0.70 113.70 119.87 2hkh s SER 202 Ca 0.06 0.05 -0.03 0.00 1.31 0.00 0.00 55.95 57.34 2hkh s SER 202 Cb -0.13 -2.09 0.01 0.00 0.21 0.00 0.00 66.02 64.02 2hkh s SER 202 CO 0.03 0.03 -0.06 -0.69 0.41 0.00 0.00 173.24 172.96 2hkh s VAL 203 N 1.28 3.07 -0.19 3.43 1.01 0.19 0.07 120.40 129.25 2hkh s VAL 203 Ca 0.07 -0.79 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 2hkh s VAL 203 Cb -0.14 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 2hkh s VAL 203 CO 0.06 0.31 0.09 0.00 0.00 0.00 0.00 175.10 175.56 2hkh s ALA 204 N 1.39 3.50 -0.55 5.51 0.00 -0.07 -0.74 121.76 130.79 2hkh s ALA 204 Ca 0.03 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.28 2hkh s ALA 204 Cb -0.15 -2.02 0.15 0.00 0.00 0.00 0.00 23.12 21.09 2hkh s ALA 204 CO -0.04 0.13 0.34 -1.58 0.00 0.00 0.00 175.76 174.61 2hkh s HIS 205 N 0.44 2.82 0.41 0.00 2.46 0.47 -1.63 115.29 120.26 2hkh s HIS 205 Ca 0.05 -2.96 0.15 0.00 0.47 0.00 0.00 55.06 52.77 2hkh s HIS 205 Cb -0.12 -2.37 1.02 0.00 -0.13 0.00 0.00 32.58 30.98 2hkh s HIS 205 CO -0.00 -0.69 1.88 -1.35 -2.47 0.00 0.00 174.74 172.10 2hkh h PRO 206 N 6.11 0.45 0.00 2.88 0.11 -1.78 -2.30 132.00 137.47 2hkh h PRO 206 Ca 0.05 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.07 2hkh h PRO 206 Cb 0.86 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 2hkh h PRO 206 CO 0.62 0.30 -0.29 0.00 -0.21 0.00 0.00 178.00 178.42 2hkh h ALA 207 N 1.62 1.31 -0.47 -0.75 0.00 -1.92 -2.07 119.26 116.98 2hkh h ALA 207 Ca 0.43 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2hkh h ALA 207 Cb 0.97 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2hkh h ALA 207 CO -0.16 0.36 0.00 -1.13 0.00 0.00 0.00 179.25 178.32 2hkh n SER 208 N -3.89 3.88 -2.13 0.00 3.41 -0.93 -4.99 113.62 108.97 2hkh n SER 208 Ca -0.02 -2.37 -0.19 0.00 -0.26 0.00 0.00 58.87 56.03 2hkh n SER 208 Cb 0.37 -0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 63.86 2hkh n SER 208 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2hkh n SER 209 N 0.62 -5.54 -4.81 4.04 7.64 -0.78 -4.94 113.62 109.85 2hkh n SER 209 Ca 0.20 0.04 -0.36 0.00 1.01 0.00 0.00 58.87 59.75 2hkh n SER 209 Cb 0.71 -4.60 -0.07 0.00 -1.01 0.00 0.00 64.21 59.24 2hkh n SER 209 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2hkh s THR 210 N -2.94 5.40 -0.21 0.44 -4.23 -0.93 -4.98 115.64 108.18 2hkh s THR 210 Ca 0.00 0.17 -0.04 0.00 -1.18 0.00 0.00 61.69 60.64 2hkh s THR 210 Cb 0.00 -3.39 0.09 0.00 1.34 0.00 0.00 72.50 70.54 2hkh s THR 210 CO 0.00 0.56 0.17 -0.89 -0.54 0.00 0.00 174.62 173.91 2hkh s THR 211 N -0.53 -0.20 -0.20 3.99 2.01 -1.25 -0.39 115.64 119.06 2hkh s THR 211 Ca 0.12 -0.28 -0.09 0.00 0.31 0.00 0.00 61.69 61.75 2hkh s THR 211 Cb -0.12 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.62 2hkh s THR 211 CO 0.02 -0.35 0.10 -0.69 -0.69 0.00 0.00 174.62 173.01 2hkh s VAL 212 N 2.22 5.11 -0.29 3.82 1.01 0.08 -4.93 120.40 127.43 2hkh s VAL 212 Ca 0.06 0.09 -0.10 0.00 0.00 0.00 0.00 61.98 62.02 2hkh s VAL 212 Cb -0.16 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 2hkh s VAL 212 CO -0.17 0.43 0.16 -1.81 0.00 0.00 0.00 175.10 173.70 2hkh s ASP 213 N 0.49 5.67 -0.27 3.32 -0.00 -1.26 0.55 116.67 125.17 2hkh s ASP 213 Ca 0.06 -0.25 -0.01 0.00 -0.00 0.00 0.00 52.55 52.35 2hkh s ASP 213 Cb -0.12 -2.04 0.04 0.00 -0.00 0.00 0.00 42.92 40.80 2hkh s ASP 213 CO -0.00 -0.11 -0.04 -0.75 -0.00 0.00 0.00 175.17 174.27 2hkh s LYS 214 N 1.68 2.59 0.16 8.23 2.47 0.12 -4.97 119.74 130.02 2hkh s LYS 214 Ca 0.06 -1.15 -0.30 0.00 -1.56 0.00 0.00 55.97 53.02 2hkh s LYS 214 Cb -0.16 -3.06 -0.07 0.00 -1.46 0.00 0.00 37.83 33.07 2hkh s LYS 214 CO 0.08 -0.52 0.96 0.21 0.16 0.00 0.00 175.35 176.24 2hkh s LYS 215 N 1.27 4.76 -0.21 4.03 2.20 -1.26 -1.01 119.74 129.51 2hkh s LYS 215 Ca -0.03 1.48 -0.19 0.00 -0.36 0.00 0.00 55.97 56.86 2hkh s LYS 215 Cb -0.18 -3.34 -0.03 0.00 -1.51 0.00 0.00 37.83 32.77 2hkh s LYS 215 CO -0.03 0.33 0.55 -0.51 -0.36 0.00 0.00 175.35 175.32 2hkh s LEU 216 N -0.47 4.13 -0.10 5.43 1.02 0.68 -4.97 118.68 124.40 2hkh s LEU 216 Ca 0.45 0.68 -0.02 0.00 0.02 0.00 0.00 54.13 55.26 2hkh s LEU 216 Cb -0.25 -2.74 -0.03 0.00 0.02 0.00 0.00 46.19 43.19 2hkh s LEU 216 CO 0.31 -0.23 0.00 -1.61 0.02 0.00 0.00 176.35 174.84 2hkh s GLU 217 N 1.85 3.08 0.00 1.70 8.01 -1.26 -4.65 118.70 127.44 2hkh s GLU 217 Ca 0.25 -0.41 0.00 0.00 0.01 0.00 0.00 54.97 54.81 2hkh s GLU 217 Cb -0.16 -2.82 0.00 0.00 -4.31 0.00 0.00 34.13 26.84 2hkh s GLU 217 CO 0.10 0.65 0.32 -0.35 0.01 0.00 0.00 175.26 175.98