#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jhk s ILE 2 N 0.00 5.30 0.29 0.53 1.01 -1.26 -4.97 121.20 122.10 1jhk s ILE 2 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 60.65 60.63 1jhk s ILE 2 Cb 0.00 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1jhk s ILE 2 CO 0.00 0.13 0.51 -1.10 0.00 0.00 0.00 174.94 174.48 1jhk s GLN 3 N 1.75 3.54 -0.13 2.79 -1.52 -1.26 -4.53 119.66 120.28 1jhk s GLN 3 Ca 0.07 -0.24 0.01 0.00 -1.95 0.00 0.00 55.36 53.25 1jhk s GLN 3 Cb -0.17 -2.70 -0.00 0.00 -0.22 0.00 0.00 33.01 29.92 1jhk s GLN 3 CO 0.11 0.23 -0.18 -1.64 -0.25 0.00 0.00 175.29 173.56 1jhk s MET 4 N -3.85 3.19 -0.33 2.91 -1.94 -1.26 -1.08 119.30 116.94 1jhk s MET 4 Ca 0.41 -0.78 -0.07 0.00 -1.71 0.00 0.00 55.69 53.53 1jhk s MET 4 Cb -0.10 -2.51 0.02 0.00 2.01 0.00 0.00 34.83 34.25 1jhk s MET 4 CO 0.32 0.10 0.11 0.99 -0.01 0.00 0.00 175.02 176.54 1jhk s THR 5 N 0.58 4.01 -0.13 2.05 2.01 0.02 -4.29 115.64 119.89 1jhk s THR 5 Ca -0.10 -0.89 -0.04 0.00 0.31 0.00 0.00 61.69 60.97 1jhk s THR 5 Cb -0.16 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 1jhk s THR 5 CO 0.03 -0.08 0.00 -1.58 -0.69 0.00 0.00 174.62 172.31 1jhk s GLN 6 N 1.47 3.46 0.02 4.92 0.74 -1.26 -1.14 119.66 127.88 1jhk s GLN 6 Ca 0.01 -0.43 -0.07 0.00 0.05 0.00 0.00 55.36 54.92 1jhk s GLN 6 Cb -0.18 -2.94 -0.00 0.00 1.10 0.00 0.00 33.01 30.98 1jhk s GLN 6 CO 0.03 0.45 0.14 -1.54 -0.55 0.00 0.00 175.29 173.82 1jhk s SER 7 N -0.17 0.08 0.78 6.67 1.04 -0.34 -4.55 113.70 117.21 1jhk s SER 7 Ca 0.05 -0.36 -0.10 0.00 0.48 0.00 0.00 55.95 56.02 1jhk s SER 7 Cb -0.13 0.23 0.09 0.00 0.10 0.00 0.00 66.02 66.31 1jhk s SER 7 CO 0.02 -0.47 1.12 -2.16 0.98 0.00 0.00 173.24 172.73 1jhk s PRO 8 N -2.11 1.91 0.12 4.02 0.04 -1.26 -1.34 135.00 136.38 1jhk s PRO 8 Ca -0.09 -0.16 0.01 0.00 0.04 0.00 0.00 61.00 60.81 1jhk s PRO 8 Cb -0.04 -2.05 -0.15 0.00 0.04 0.00 0.00 34.50 32.30 1jhk s PRO 8 CO -0.02 -1.52 1.27 0.00 0.04 0.00 0.00 177.00 176.77 1jhk h ALA 9 N -0.90 0.33 -3.52 8.56 0.00 -1.80 -3.40 119.26 118.53 1jhk h ALA 9 Ca -0.45 -0.83 -0.44 0.00 0.00 0.00 0.00 54.91 53.19 1jhk h ALA 9 Cb 1.31 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 18.81 1jhk h ALA 9 CO 0.59 1.03 -0.79 -1.12 0.00 0.00 0.00 179.25 178.96 1jhk s SER 10 N -6.94 1.80 -0.16 0.00 0.01 -1.26 -0.43 113.70 106.72 1jhk s SER 10 Ca -0.02 -0.59 -0.12 0.00 1.31 0.00 0.00 55.95 56.52 1jhk s SER 10 Cb 0.09 -0.07 0.05 0.00 0.21 0.00 0.00 66.02 66.29 1jhk s SER 10 CO 0.84 -0.03 0.41 -0.22 0.41 0.00 0.00 173.24 174.65 1jhk s LEU 11 N -1.64 0.22 -0.11 2.44 2.96 -0.31 -4.91 118.68 117.32 1jhk s LEU 11 Ca -0.00 0.85 0.03 0.00 -0.22 0.00 0.00 54.13 54.79 1jhk s LEU 11 Cb -0.10 1.37 0.01 0.00 0.50 0.00 0.00 46.19 47.97 1jhk s LEU 11 CO 0.02 -0.16 -0.21 -0.44 -1.32 0.00 0.00 176.35 174.24 1jhk s SER 12 N 0.73 2.88 0.26 3.68 0.01 -1.26 -0.10 113.70 119.89 1jhk s SER 12 Ca -0.04 -0.53 -0.08 0.00 1.31 0.00 0.00 55.95 56.61 1jhk s SER 12 Cb -0.05 -1.32 -0.01 0.00 0.21 0.00 0.00 66.02 64.85 1jhk s SER 12 CO -0.05 0.10 0.40 0.00 0.41 0.00 0.00 173.24 174.10 1jhk s ALA 13 N 0.65 0.33 0.28 1.44 0.00 -0.93 -4.88 121.76 118.65 1jhk s ALA 13 Ca -0.12 -1.22 0.12 0.00 0.00 0.00 0.00 51.96 50.73 1jhk s ALA 13 Cb -0.16 1.16 -0.05 0.00 0.00 0.00 0.00 23.12 24.07 1jhk s ALA 13 CO 0.03 -0.78 -0.19 -1.12 0.00 0.00 0.00 175.76 173.70 1jhk s SER 14 N -3.11 3.57 0.11 0.00 0.01 -1.26 -0.90 113.70 112.13 1jhk s SER 14 Ca 0.28 -1.05 -0.34 0.00 1.31 0.00 0.00 55.95 56.15 1jhk s SER 14 Cb 0.01 -0.30 -0.14 0.00 0.21 0.00 0.00 66.02 65.80 1jhk s SER 14 CO 0.13 0.01 1.60 0.52 0.41 0.00 0.00 173.24 175.91 1jhk n VAL 15 N -0.63 0.09 0.00 3.43 0.31 -1.26 -1.72 118.33 118.55 1jhk n VAL 15 Ca -0.05 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1jhk n VAL 15 Cb 0.60 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 1jhk n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jhk n GLY 16 N 3.50 2.98 3.97 2.92 0.00 -0.31 -4.88 105.19 113.37 1jhk n GLY 16 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1jhk n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jhk s GLU 17 N -0.59 1.79 -0.05 1.61 2.02 -0.70 -3.89 118.70 118.88 1jhk s GLU 17 Ca 0.00 -0.79 0.06 0.00 0.02 0.00 0.00 54.97 54.26 1jhk s GLU 17 Cb 0.00 -2.26 -0.01 0.00 0.10 0.00 0.00 34.13 31.96 1jhk s GLU 17 CO 0.00 -1.41 -0.25 0.99 0.02 0.00 0.00 175.26 174.61 1jhk s THR 18 N -3.20 2.03 0.15 3.63 2.01 -1.26 -1.31 115.64 117.70 1jhk s THR 18 Ca 0.65 -1.06 0.07 0.00 0.31 0.00 0.00 61.69 61.66 1jhk s THR 18 Cb -0.07 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1jhk s THR 18 CO 0.44 0.57 -0.16 0.68 -0.69 0.00 0.00 174.62 175.46 1jhk s VAL 19 N -0.21 1.59 -0.04 3.82 -7.23 -0.13 -5.00 120.40 113.20 1jhk s VAL 19 Ca -0.02 -1.87 0.03 0.00 -1.81 0.00 0.00 61.98 58.31 1jhk s VAL 19 Cb -0.13 -1.73 0.01 0.00 0.56 0.00 0.00 36.38 35.08 1jhk s VAL 19 CO 0.03 -0.39 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.42 1jhk s THR 20 N -2.21 1.05 -0.10 5.32 2.01 -1.26 -1.22 115.64 119.23 1jhk s THR 20 Ca 0.14 -0.48 0.02 0.00 0.31 0.00 0.00 61.69 61.68 1jhk s THR 20 Cb -0.05 -0.94 -0.01 0.00 0.01 0.00 0.00 72.50 71.52 1jhk s THR 20 CO 0.05 0.32 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.49 1jhk s ILE 21 N 0.35 2.55 0.10 1.82 1.01 0.58 -4.77 121.20 122.85 1jhk s ILE 21 Ca -0.08 -0.85 0.09 0.00 0.00 0.00 0.00 60.65 59.81 1jhk s ILE 21 Cb -0.12 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 1jhk s ILE 21 CO 0.02 0.55 -0.19 0.42 0.00 0.00 0.00 174.94 175.74 1jhk s THR 22 N 0.20 2.76 -0.02 2.92 -4.23 -0.45 0.50 115.64 117.32 1jhk s THR 22 Ca -0.11 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 58.95 1jhk s THR 22 Cb -0.16 -2.24 0.01 0.00 1.34 0.00 0.00 72.50 71.46 1jhk s THR 22 CO 0.06 0.16 -0.04 0.00 -0.54 0.00 0.00 174.62 174.26 1jhk s ARG 24 N 0.52 2.20 0.04 0.00 3.52 -0.29 -1.39 118.95 123.55 1jhk s ARG 24 Ca -0.06 -0.71 -0.15 0.00 -0.13 0.00 0.00 55.73 54.69 1jhk s ARG 24 Cb -0.09 -1.82 -0.06 0.00 -1.56 0.00 0.00 34.95 31.42 1jhk s ARG 24 CO -0.00 0.24 0.45 0.00 -0.81 0.00 0.00 175.30 175.17 1jhk s ALA 25 N 0.13 3.67 -1.81 6.12 0.00 0.12 -0.80 121.76 129.19 1jhk s ALA 25 Ca -0.08 -0.20 0.19 0.00 0.00 0.00 0.00 51.96 51.87 1jhk s ALA 25 Cb -0.14 -2.42 1.07 0.00 0.00 0.00 0.00 23.12 21.63 1jhk s ALA 25 CO 0.04 0.48 1.54 -1.13 0.00 0.00 0.00 175.76 176.69 1jhk n SER 26 N 1.53 0.00 -3.44 0.00 3.41 -0.24 -4.75 113.62 110.13 1jhk n SER 26 Ca -0.11 -0.39 -0.11 0.00 -0.26 0.00 0.00 58.87 57.99 1jhk n SER 26 Cb 0.52 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.35 1jhk n SER 26 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1jhk s GLY 27 N -2.19 -0.59 0.20 5.00 0.00 -1.26 -4.92 107.32 103.56 1jhk s GLY 27 Ca 0.25 0.61 -0.32 0.00 0.00 0.00 0.00 44.72 45.26 1jhk s GLY 27 CO 0.24 0.21 1.73 -2.01 0.00 0.00 0.00 173.10 173.27 1jhk n ASN 28 N -0.33 3.96 -0.00 1.64 2.85 -1.26 -4.66 115.26 117.46 1jhk n ASN 28 Ca -0.15 1.05 0.00 0.00 -0.11 0.00 0.00 54.58 55.37 1jhk n ASN 28 Cb 0.64 -1.56 0.00 0.00 1.24 0.00 0.00 39.78 40.10 1jhk n ASN 28 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1jhk n ILE 29 N 4.02 0.46 -4.01 -1.44 -5.35 -1.01 -5.01 119.36 107.02 1jhk n ILE 29 Ca 0.16 -0.73 -0.27 0.00 -0.27 0.00 0.00 62.75 61.65 1jhk n ILE 29 Cb 0.35 0.77 -0.03 0.00 -1.74 0.00 0.00 39.64 38.99 1jhk n ILE 29 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1jhk n HIS 30 N -0.22 -1.58 -1.01 4.28 8.25 -1.26 -1.75 115.22 121.92 1jhk n HIS 30 Ca 0.00 0.70 -0.00 0.00 -0.26 0.00 0.00 57.72 58.16 1jhk n HIS 30 Cb 0.12 -3.56 -0.00 0.00 1.12 0.00 0.00 29.99 27.66 1jhk n HIS 30 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1jhk n ASN 31 N -2.95 -4.92 -3.56 0.41 3.02 -1.26 -4.90 115.26 101.10 1jhk n ASN 31 Ca -0.31 0.01 -0.41 0.00 -0.03 0.00 0.00 54.58 53.85 1jhk n ASN 31 Cb 0.68 -2.46 -0.01 0.00 -0.61 0.00 0.00 39.78 37.39 1jhk n ASN 31 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1jhk n TYR 32 N -2.37 2.84 -4.88 3.10 4.02 -0.72 -2.68 117.16 116.48 1jhk n TYR 32 Ca -0.00 -2.94 -0.25 0.00 -0.01 0.00 0.00 57.90 54.69 1jhk n TYR 32 Cb 0.33 -2.25 -0.15 0.00 -0.02 0.00 0.00 39.34 37.25 1jhk n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1jhk s LEU 33 N 0.06 2.04 -0.04 7.72 2.96 -1.26 -1.21 118.68 128.95 1jhk s LEU 33 Ca 0.54 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 54.17 1jhk s LEU 33 Cb 0.15 -0.94 -0.01 0.00 0.50 0.00 0.00 46.19 45.89 1jhk s LEU 33 CO -0.06 0.22 -0.20 0.00 -1.32 0.00 0.00 176.35 174.99 1jhk s ALA 34 N -0.44 1.71 -0.18 5.97 0.00 0.31 -1.10 121.76 128.04 1jhk s ALA 34 Ca 0.07 -0.83 -0.06 0.00 0.00 0.00 0.00 51.96 51.14 1jhk s ALA 34 Cb -0.07 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1jhk s ALA 34 CO -0.01 0.36 0.02 -1.58 0.00 0.00 0.00 175.76 174.55 1jhk s TRP 35 N -0.20 3.12 0.22 0.00 0.52 0.15 -0.12 118.94 122.63 1jhk s TRP 35 Ca 0.01 -0.17 0.11 0.00 0.02 0.00 0.00 56.10 56.06 1jhk s TRP 35 Cb -0.10 -2.05 -0.04 0.00 -1.15 0.00 0.00 33.47 30.12 1jhk s TRP 35 CO 0.01 -0.01 -0.17 0.71 0.02 0.00 0.00 176.95 177.51 1jhk s TYR 36 N 0.56 2.43 -0.03 -1.98 1.51 0.14 -0.28 117.35 119.69 1jhk s TYR 36 Ca 0.00 -0.30 0.05 0.00 -1.01 0.00 0.00 57.07 55.81 1jhk s TYR 36 Cb -0.14 -1.15 -0.01 0.00 -0.11 0.00 0.00 41.96 40.56 1jhk s TYR 36 CO 0.02 0.57 -0.18 -1.14 -1.11 0.00 0.00 175.55 173.71 1jhk s GLN 37 N -3.03 1.71 -0.03 -0.62 0.74 -0.42 -1.50 119.66 116.51 1jhk s GLN 37 Ca 0.25 -0.64 0.01 0.00 0.05 0.00 0.00 55.36 55.04 1jhk s GLN 37 Cb -0.07 -1.54 0.02 0.00 1.10 0.00 0.00 33.01 32.52 1jhk s GLN 37 CO 0.14 0.30 -0.04 -1.14 -0.55 0.00 0.00 175.29 174.00 1jhk s GLN 38 N -0.13 0.64 0.02 1.67 0.74 -0.36 0.37 119.66 122.61 1jhk s GLN 38 Ca -0.00 -0.09 0.09 0.00 0.05 0.00 0.00 55.36 55.41 1jhk s GLN 38 Cb -0.10 -0.68 -0.02 0.00 1.10 0.00 0.00 33.01 33.30 1jhk s GLN 38 CO 0.01 -0.05 -0.25 0.15 -0.55 0.00 0.00 175.29 174.60 1jhk s LYS 39 N 0.72 1.83 -0.90 1.67 -0.14 -1.26 -1.68 119.74 119.99 1jhk s LYS 39 Ca -0.09 -1.02 -0.14 0.00 -1.36 0.00 0.00 55.97 53.36 1jhk s LYS 39 Cb -0.12 -1.92 0.02 0.00 -1.68 0.00 0.00 37.83 34.13 1jhk s LYS 39 CO -0.00 0.51 0.27 1.04 -0.76 0.00 0.00 175.35 176.41 1jhk n GLN 40 N 2.02 -0.67 -0.16 1.68 6.02 -1.26 -0.15 117.38 124.86 1jhk n GLN 40 Ca -0.17 -0.06 0.00 0.00 -0.01 0.00 0.00 57.00 56.76 1jhk n GLN 40 Cb 0.52 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 30.05 1jhk n GLN 40 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jhk n GLY 41 N -1.85 0.13 2.19 1.08 0.00 -1.26 -4.93 105.19 100.55 1jhk n GLY 41 Ca -0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 1jhk n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jhk n LYS 42 N -2.00 -3.53 -2.52 1.61 5.02 0.79 -4.95 118.16 112.58 1jhk n LYS 42 Ca 0.00 -1.03 -0.40 0.00 -2.02 0.00 0.00 58.31 54.86 1jhk n LYS 42 Cb 0.00 -1.22 -0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1jhk n LYS 42 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1jhk s SER 43 N -2.95 7.22 0.57 4.39 0.01 -1.26 -4.61 113.70 117.07 1jhk s SER 43 Ca 0.46 2.19 -0.20 0.00 1.31 0.00 0.00 55.95 59.70 1jhk s SER 43 Cb -0.07 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 1jhk s SER 43 CO 0.37 -0.17 1.30 -2.84 0.41 0.00 0.00 173.24 172.31 1jhk s PRO 44 N -1.61 3.01 -0.17 12.44 0.02 -1.26 -4.69 135.00 142.74 1jhk s PRO 44 Ca 0.47 2.09 0.01 0.00 0.02 0.00 0.00 61.00 63.59 1jhk s PRO 44 Cb -0.29 -2.11 0.01 0.00 0.02 0.00 0.00 34.50 32.13 1jhk s PRO 44 CO 0.38 -1.25 -0.20 -0.65 -0.33 0.00 0.00 177.00 174.95 1jhk s GLN 45 N -3.07 3.03 0.23 5.54 -1.52 0.16 -4.92 119.66 119.11 1jhk s GLN 45 Ca 0.75 -0.82 -0.31 0.00 -1.95 0.00 0.00 55.36 53.03 1jhk s GLN 45 Cb -0.37 -2.55 -0.10 0.00 -0.22 0.00 0.00 33.01 29.76 1jhk s GLN 45 CO 0.42 -0.14 1.52 -1.17 -0.25 0.00 0.00 175.29 175.68 1jhk s LEU 46 N 1.13 4.37 -0.16 2.90 2.96 -1.26 -1.30 118.68 127.32 1jhk s LEU 46 Ca 0.01 2.71 -0.08 0.00 -0.22 0.00 0.00 54.13 56.54 1jhk s LEU 46 Cb -0.14 -3.61 -0.07 0.00 0.50 0.00 0.00 46.19 42.87 1jhk s LEU 46 CO -0.08 -0.79 -0.20 0.18 -1.32 0.00 0.00 176.35 174.13 1jhk n LEU 47 N 2.91 1.12 -3.85 -0.68 4.77 0.61 -4.73 117.00 117.15 1jhk n LEU 47 Ca 0.10 0.19 -0.12 0.00 -0.03 0.00 0.00 56.01 56.15 1jhk n LEU 47 Cb 0.39 -0.47 -0.13 0.00 -2.33 0.00 0.00 43.42 40.88 1jhk n LEU 47 CO 0.61 0.31 -0.28 -0.69 -1.33 0.00 0.00 177.39 176.01 1jhk s VAL 48 N -2.29 -0.00 0.10 4.08 1.01 -1.13 -1.16 120.40 121.01 1jhk s VAL 48 Ca -0.22 0.00 0.06 0.00 0.00 0.00 0.00 61.98 61.82 1jhk s VAL 48 Cb 0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.32 1jhk s VAL 48 CO 0.28 0.00 -0.14 -0.72 0.00 0.00 0.00 175.10 174.52 1jhk s TYR 49 N 0.04 1.32 -1.54 5.22 -0.85 0.37 0.30 117.35 122.21 1jhk s TYR 49 Ca -0.00 -0.53 0.00 0.00 -0.52 0.00 0.00 57.07 56.02 1jhk s TYR 49 Cb -0.01 -0.71 0.00 0.00 0.38 0.00 0.00 41.96 41.62 1jhk s TYR 49 CO 0.00 0.10 0.00 0.09 -1.52 0.00 0.00 175.55 174.23 1jhk n ASN 50 N 0.81 -5.09 0.00 -0.18 5.03 -0.26 -2.07 115.26 113.50 1jhk n ASN 50 Ca -0.18 0.05 0.00 0.00 0.87 0.00 0.00 54.58 55.32 1jhk n ASN 50 Cb 0.56 -4.17 0.00 0.00 -1.02 0.00 0.00 39.78 35.15 1jhk n ASN 50 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1jhk n ALA 51 N -1.37 0.00 -0.40 5.41 0.00 -0.29 -4.38 120.51 119.49 1jhk n ALA 51 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1jhk n ALA 51 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1jhk n ALA 51 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1jhk n LYS 52 N 0.00 -0.33 -3.65 0.00 2.85 -1.24 -3.20 118.16 112.59 1jhk n LYS 52 Ca 0.00 -0.39 -0.37 0.00 -1.05 0.00 0.00 58.31 56.50 1jhk n LYS 52 Cb 0.00 -0.80 -0.10 0.00 -0.65 0.00 0.00 35.03 33.48 1jhk n LYS 52 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1jhk s THR 53 N -0.07 5.31 0.26 0.58 2.01 -0.88 -4.64 115.64 118.21 1jhk s THR 53 Ca 0.00 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 61.87 1jhk s THR 53 Cb 0.00 -3.49 -0.09 0.00 0.01 0.00 0.00 72.50 68.93 1jhk s THR 53 CO 0.00 0.32 1.20 -0.76 -0.69 0.00 0.00 174.62 174.70 1jhk s LEU 54 N 1.25 4.48 0.99 4.42 1.43 -1.26 -0.48 118.68 129.50 1jhk s LEU 54 Ca 0.07 2.39 -0.13 0.00 -1.03 0.00 0.00 54.13 55.42 1jhk s LEU 54 Cb -0.14 -3.63 0.18 0.00 0.03 0.00 0.00 46.19 42.63 1jhk s LEU 54 CO 0.06 -0.35 1.13 0.00 0.23 0.00 0.00 176.35 177.42 1jhk s ALA 55 N -0.71 1.36 0.21 4.21 0.00 -0.31 -4.87 121.76 121.64 1jhk s ALA 55 Ca 0.49 -0.58 -0.31 0.00 0.00 0.00 0.00 51.96 51.56 1jhk s ALA 55 Cb -0.35 -3.02 -0.11 0.00 0.00 0.00 0.00 23.12 19.64 1jhk s ALA 55 CO 0.43 -2.67 1.60 0.34 0.00 0.00 0.00 175.76 175.46 1jhk s ASP 56 N -3.88 6.50 0.00 0.00 -1.08 -1.26 -2.73 116.67 114.21 1jhk s ASP 56 Ca 0.66 2.75 0.00 0.00 -0.52 0.00 0.00 52.55 55.44 1jhk s ASP 56 Cb -0.15 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.71 1jhk s ASP 56 CO 0.55 -0.87 0.00 0.61 0.52 0.00 0.00 175.17 175.98 1jhk n GLY 57 N 3.35 0.70 3.70 2.66 0.00 -1.26 -5.00 105.19 109.33 1jhk n GLY 57 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1jhk n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jhk s VAL 58 N -3.03 4.68 0.59 1.61 1.01 -1.11 -5.00 120.40 119.16 1jhk s VAL 58 Ca 0.00 1.94 -0.18 0.00 0.00 0.00 0.00 61.98 63.73 1jhk s VAL 58 Cb 0.00 -4.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 1jhk s VAL 58 CO 0.00 0.08 0.92 -2.65 0.00 0.00 0.00 175.10 173.45 1jhk n PRO 59 N 4.46 0.86 0.00 2.72 -0.02 -1.26 -4.87 135.00 136.88 1jhk n PRO 59 Ca 0.08 0.34 0.08 0.00 -2.02 0.00 0.00 63.50 61.97 1jhk n PRO 59 Cb 0.49 -2.12 0.37 0.00 -0.02 0.00 0.00 33.50 32.23 1jhk n PRO 59 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1jhk n SER 60 N -0.61 0.00 0.00 2.55 7.64 -1.26 -2.61 113.62 119.33 1jhk n SER 60 Ca 0.13 0.21 0.11 0.00 1.01 0.00 0.00 58.87 60.34 1jhk n SER 60 Cb 0.47 -0.36 0.56 0.00 -1.01 0.00 0.00 64.21 63.87 1jhk n SER 60 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1jhk n ARG 61 N -1.36 0.27 -3.60 1.43 1.85 -1.26 -4.62 116.66 109.37 1jhk n ARG 61 Ca 0.06 0.08 -0.37 0.00 -1.00 0.00 0.00 57.85 56.62 1jhk n ARG 61 Cb 0.14 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 29.99 1jhk n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1jhk s PHE 62 N -2.65 3.61 -0.24 2.89 0.08 -1.07 -2.32 117.98 118.28 1jhk s PHE 62 Ca 0.20 0.76 -0.23 0.00 0.12 0.00 0.00 56.93 57.77 1jhk s PHE 62 Cb 0.15 -2.23 0.06 0.00 -0.57 0.00 0.00 43.02 40.44 1jhk s PHE 62 CO 0.36 0.53 0.67 -1.54 -0.10 0.00 0.00 175.22 175.14 1jhk s SER 63 N -0.56 -0.69 0.16 1.36 1.04 -0.81 -4.99 113.70 109.21 1jhk s SER 63 Ca 0.20 1.30 0.10 0.00 0.48 0.00 0.00 55.95 58.03 1jhk s SER 63 Cb -0.14 1.32 -0.04 0.00 0.10 0.00 0.00 66.02 67.25 1jhk s SER 63 CO 0.08 -0.25 -0.19 -0.83 0.98 0.00 0.00 173.24 173.04 1jhk s GLY 64 N 0.27 1.70 0.32 7.32 0.00 -1.26 -0.13 107.32 115.54 1jhk s GLY 64 Ca -0.01 -1.50 -0.07 0.00 0.00 0.00 0.00 44.72 43.14 1jhk s GLY 64 CO 0.01 -1.51 0.52 -1.35 0.00 0.00 0.00 173.10 170.77 1jhk s SER 65 N -2.52 0.51 0.00 1.64 1.04 -0.74 -4.36 113.70 109.26 1jhk s SER 65 Ca 0.21 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.34 1jhk s SER 65 Cb -0.09 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1jhk s SER 65 CO 0.11 -1.31 0.00 0.61 0.98 0.00 0.00 173.24 173.63 1jhk n GLY 66 N -0.51 2.00 3.64 7.32 0.00 -1.26 -2.13 105.19 114.25 1jhk n GLY 66 Ca -0.01 -2.19 -0.04 0.00 0.00 0.00 0.00 46.02 43.79 1jhk n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jhk s SER 67 N 0.00 -0.19 1.62 1.61 1.04 -0.29 -4.93 113.70 112.57 1jhk s SER 67 Ca 0.00 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1jhk s SER 67 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1jhk s SER 67 CO 0.00 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.22 1jhk n GLY 68 N -0.37 1.24 0.12 7.32 0.00 -1.26 -1.84 105.19 110.39 1jhk n GLY 68 Ca -0.06 0.32 0.02 0.00 0.00 0.00 0.00 46.02 46.29 1jhk n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jhk n THR 69 N 0.00 0.00 -4.29 2.61 -2.24 -1.26 -2.41 114.28 106.69 1jhk n THR 69 Ca 0.00 -0.49 -0.33 0.00 -2.27 0.00 0.00 64.05 60.96 1jhk n THR 69 Cb 0.00 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.14 1jhk n THR 69 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1jhk s GLN 70 N -0.45 3.10 0.09 -0.78 -0.21 -0.77 0.16 119.66 120.80 1jhk s GLN 70 Ca 0.04 -0.79 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1jhk s GLN 70 Cb 0.03 -2.62 -0.04 0.00 1.00 0.00 0.00 33.01 31.38 1jhk s GLN 70 CO 0.06 -0.12 -0.03 0.71 -2.12 0.00 0.00 175.29 173.79 1jhk s TYR 71 N 1.12 0.74 0.01 0.91 1.51 -0.48 -1.14 117.35 120.02 1jhk s TYR 71 Ca 0.01 -1.04 -0.24 0.00 -1.01 0.00 0.00 57.07 54.78 1jhk s TYR 71 Cb -0.14 -0.47 0.05 0.00 -0.11 0.00 0.00 41.96 41.30 1jhk s TYR 71 CO -0.07 -0.32 0.55 -1.54 -1.11 0.00 0.00 175.55 173.07 1jhk s SER 72 N -3.00 -0.48 -0.16 2.29 1.04 -0.90 -1.10 113.70 111.38 1jhk s SER 72 Ca 0.12 0.34 -0.01 0.00 0.48 0.00 0.00 55.95 56.89 1jhk s SER 72 Cb 0.07 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 1jhk s SER 72 CO -0.05 -0.65 -0.12 -0.22 0.98 0.00 0.00 173.24 173.17 1jhk s LEU 73 N -1.64 2.66 -0.12 2.42 2.96 0.18 -1.80 118.68 123.35 1jhk s LEU 73 Ca -0.08 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.41 1jhk s LEU 73 Cb -0.01 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 1jhk s LEU 73 CO 0.03 0.09 -0.05 -0.75 -1.32 0.00 0.00 176.35 174.34 1jhk s LYS 74 N 0.80 3.31 -0.16 1.98 2.20 0.82 -0.31 119.74 128.38 1jhk s LYS 74 Ca -0.04 -0.53 0.01 0.00 -0.36 0.00 0.00 55.97 55.04 1jhk s LYS 74 Cb -0.15 -2.78 0.03 0.00 -1.51 0.00 0.00 37.83 33.42 1jhk s LYS 74 CO 0.01 0.41 -0.13 0.42 -0.36 0.00 0.00 175.35 175.69 1jhk s ILE 75 N -0.10 1.61 0.07 5.43 1.01 -0.36 -1.92 121.20 126.94 1jhk s ILE 75 Ca 0.02 -0.76 0.07 0.00 0.00 0.00 0.00 60.65 59.98 1jhk s ILE 75 Cb -0.13 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 1jhk s ILE 75 CO 0.03 0.37 -0.15 0.54 0.00 0.00 0.00 174.94 175.73 1jhk s ASN 76 N 1.45 4.02 -1.05 3.58 2.20 -0.98 -0.96 114.94 123.21 1jhk s ASN 76 Ca 0.03 -0.42 -0.08 0.00 -0.94 0.00 0.00 52.86 51.44 1jhk s ASN 76 Cb -0.14 -0.69 -0.06 0.00 -2.00 0.00 0.00 41.25 38.37 1jhk s ASN 76 CO -0.10 0.22 0.89 -1.20 -2.94 0.00 0.00 177.10 173.97 1jhk n SER 77 N 1.20 -6.47 -4.63 3.54 7.64 -0.85 -4.78 113.62 109.27 1jhk n SER 77 Ca -0.15 -0.74 -0.48 0.00 1.01 0.00 0.00 58.87 58.50 1jhk n SER 77 Cb 0.52 -4.90 -0.05 0.00 -1.01 0.00 0.00 64.21 58.78 1jhk n SER 77 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1jhk n LEU 78 N -3.34 2.31 -4.94 -3.43 4.77 -0.43 -4.54 117.00 107.40 1jhk n LEU 78 Ca -0.07 1.12 -0.25 0.00 -0.03 0.00 0.00 56.01 56.78 1jhk n LEU 78 Cb 0.61 -1.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.37 1jhk n LEU 78 CO 0.60 -0.77 -0.09 -1.10 -1.33 0.00 0.00 177.39 174.71 1jhk s GLN 79 N 0.33 3.41 0.61 3.23 -1.52 -1.26 -1.17 119.66 123.28 1jhk s GLN 79 Ca 0.78 -0.66 0.32 0.00 -1.95 0.00 0.00 55.36 53.85 1jhk s GLN 79 Cb -0.80 -2.92 1.85 0.00 -0.22 0.00 0.00 33.01 30.91 1jhk s GLN 79 CO 0.45 0.49 2.20 -1.00 -0.25 0.00 0.00 175.29 177.19 1jhk h PRO 80 N 1.88 0.00 -0.01 2.91 0.13 -1.99 -0.68 132.00 134.25 1jhk h PRO 80 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1jhk h PRO 80 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1jhk h PRO 80 CO 0.66 0.00 -0.08 -0.85 -0.23 0.00 0.00 178.00 177.50 1jhk n GLU 81 N -3.67 0.96 0.09 0.86 0.00 -1.26 -3.57 120.64 114.05 1jhk n GLU 81 Ca -0.01 -0.38 0.13 0.00 0.00 0.00 0.00 57.16 56.90 1jhk n GLU 81 Cb 0.19 -1.49 0.44 0.00 0.00 0.00 0.00 31.44 30.57 1jhk n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1jhk n ASP 82 N -0.69 0.68 -4.70 -1.84 10.43 -0.26 -4.81 116.55 115.36 1jhk n ASP 82 Ca 0.17 0.56 -0.42 0.00 2.57 0.00 0.00 54.79 57.67 1jhk n ASP 82 Cb 0.27 -0.75 -0.03 0.00 1.84 0.00 0.00 41.12 42.45 1jhk n ASP 82 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1jhk s PHE 83 N -3.08 3.58 -2.41 1.24 0.40 -1.23 -4.90 117.98 111.58 1jhk s PHE 83 Ca 0.11 1.59 0.00 0.00 -0.60 0.00 0.00 56.93 58.03 1jhk s PHE 83 Cb 0.13 -3.10 0.00 0.00 0.51 0.00 0.00 43.02 40.56 1jhk s PHE 83 CO 0.59 -0.09 0.00 0.41 0.70 0.00 0.00 175.22 176.83 1jhk n GLY 84 N 3.03 -0.58 3.76 4.36 0.00 -1.10 -4.96 105.19 109.70 1jhk n GLY 84 Ca 0.06 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 1jhk n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jhk s THR 85 N -3.38 4.53 0.12 2.61 2.01 -0.67 -0.72 115.64 120.14 1jhk s THR 85 Ca 0.00 -0.63 0.10 0.00 0.31 0.00 0.00 61.69 61.47 1jhk s THR 85 Cb 0.00 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 1jhk s THR 85 CO 0.00 0.24 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.62 1jhk s TYR 86 N -1.28 2.06 -0.03 4.92 1.51 0.10 -1.23 117.35 123.40 1jhk s TYR 86 Ca 0.26 -0.40 -0.05 0.00 -1.01 0.00 0.00 57.07 55.87 1jhk s TYR 86 Cb -0.12 -1.12 0.01 0.00 -0.11 0.00 0.00 41.96 40.62 1jhk s TYR 86 CO 0.18 0.28 0.11 0.71 -1.11 0.00 0.00 175.55 175.72 1jhk s TYR 87 N -1.13 -0.05 0.08 2.71 1.51 -0.56 -1.22 117.35 118.69 1jhk s TYR 87 Ca 0.11 0.13 0.03 0.00 -1.01 0.00 0.00 57.07 56.33 1jhk s TYR 87 Cb -0.10 0.00 -0.04 0.00 -0.11 0.00 0.00 41.96 41.71 1jhk s TYR 87 CO 0.05 -0.13 0.05 0.00 -1.11 0.00 0.00 175.55 174.42 1jhk s HIS 89 N -1.35 -0.53 0.48 0.00 5.04 0.82 0.41 115.29 120.17 1jhk s HIS 89 Ca 0.28 0.60 -0.04 0.00 -1.54 0.00 0.00 55.06 54.36 1jhk s HIS 89 Cb -0.12 -0.15 -0.02 0.00 0.04 0.00 0.00 32.58 32.33 1jhk s HIS 89 CO 0.20 -0.61 0.75 -3.38 -2.34 0.00 0.00 174.74 169.36 1jhk s HIS 90 N 2.43 3.44 -0.33 3.88 -3.43 -1.05 -0.53 115.29 119.71 1jhk s HIS 90 Ca 0.08 0.62 0.16 0.00 -0.80 0.00 0.00 55.06 55.12 1jhk s HIS 90 Cb -0.15 -2.33 0.44 0.00 -1.43 0.00 0.00 32.58 29.12 1jhk s HIS 90 CO -0.13 -0.34 1.24 1.97 -2.00 0.00 0.00 174.74 175.48 1jhk n PHE 91 N -2.23 -0.49 -0.02 0.38 -1.74 -0.35 -3.83 117.46 109.19 1jhk n PHE 91 Ca 0.01 -2.15 -0.20 0.00 -0.56 0.00 0.00 57.45 54.55 1jhk n PHE 91 Cb 0.56 0.62 -0.13 0.00 1.52 0.00 0.00 39.48 42.05 1jhk n PHE 91 CO 0.00 0.00 0.00 2.35 -0.56 0.00 0.00 176.76 178.55 1jhk h TRP 92 N 2.16 0.30 -3.20 2.97 2.91 -1.84 -3.48 115.95 115.77 1jhk h TRP 92 Ca -0.24 -0.22 -0.14 0.00 1.13 0.00 0.00 58.89 59.42 1jhk h TRP 92 Cb 1.26 -0.01 -0.23 0.00 -0.51 0.00 0.00 29.16 29.67 1jhk h TRP 92 CO 0.27 1.38 -0.40 -1.54 -1.03 0.00 0.00 178.44 177.12 1jhk s SER 93 N -6.82 -0.17 0.30 2.65 1.04 -1.26 -5.13 113.70 104.32 1jhk s SER 93 Ca -0.20 0.20 -0.29 0.00 0.48 0.00 0.00 55.95 56.14 1jhk s SER 93 Cb 0.02 0.38 -0.10 0.00 0.10 0.00 0.00 66.02 66.42 1jhk s SER 93 CO 0.73 -0.27 1.37 -0.89 0.98 0.00 0.00 173.24 175.17 1jhk s THR 94 N -0.69 2.65 0.16 2.02 2.01 -1.26 -3.78 115.64 116.76 1jhk s THR 94 Ca -0.08 0.61 -0.23 0.00 0.31 0.00 0.00 61.69 62.30 1jhk s THR 94 Cb -0.04 -3.39 -0.08 0.00 0.01 0.00 0.00 72.50 69.00 1jhk s THR 94 CO 0.02 0.13 0.73 -2.16 -0.69 0.00 0.00 174.62 172.65 1jhk s PRO 95 N -1.26 4.45 -0.81 4.92 0.04 -1.26 -4.60 135.00 136.48 1jhk s PRO 95 Ca 0.53 1.03 -0.25 0.00 0.04 0.00 0.00 61.00 62.35 1jhk s PRO 95 Cb -0.41 -3.18 0.01 0.00 0.04 0.00 0.00 34.50 30.96 1jhk s PRO 95 CO 0.50 0.55 1.61 -1.58 0.04 0.00 0.00 177.00 178.12 1jhk s TRP 96 N -1.22 2.08 0.30 0.56 0.51 -1.25 -4.67 118.94 115.25 1jhk s TRP 96 Ca 0.36 0.11 -0.17 0.00 -2.12 0.00 0.00 56.10 54.29 1jhk s TRP 96 Cb -0.21 -4.39 -0.09 0.00 -0.81 0.00 0.00 33.47 27.97 1jhk s TRP 96 CO 0.24 -2.03 0.74 0.95 -0.51 0.00 0.00 176.95 176.34 1jhk s THR 97 N 7.33 4.63 0.25 2.01 -4.23 -1.25 -4.81 115.64 119.58 1jhk s THR 97 Ca 0.53 1.07 0.01 0.00 -1.18 0.00 0.00 61.69 62.13 1jhk s THR 97 Cb -0.07 -3.68 -0.04 0.00 1.34 0.00 0.00 72.50 70.05 1jhk s THR 97 CO 0.07 -0.07 0.42 -0.36 -0.54 0.00 0.00 174.62 174.14 1jhk s PHE 98 N -1.85 3.48 0.81 3.99 0.40 -1.26 -2.53 117.98 121.01 1jhk s PHE 98 Ca 0.51 0.23 -0.12 0.00 -0.60 0.00 0.00 56.93 56.95 1jhk s PHE 98 Cb -0.12 -1.77 0.08 0.00 0.51 0.00 0.00 43.02 41.72 1jhk s PHE 98 CO 0.18 0.33 1.13 0.20 0.70 0.00 0.00 175.22 177.76 1jhk s GLY 99 N -3.66 1.60 0.20 4.36 0.00 0.17 -4.55 107.32 105.44 1jhk s GLY 99 Ca 0.37 -0.43 0.20 0.00 0.00 0.00 0.00 44.72 44.87 1jhk s GLY 99 CO 0.31 0.04 1.61 0.61 0.00 0.00 0.00 173.10 175.67 1jhk n GLY 100 N -2.61 -1.11 0.00 0.20 0.00 -1.26 -4.72 105.19 95.70 1jhk n GLY 100 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1jhk n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jhk n GLY 101 N -0.30 1.29 2.74 -0.02 0.00 -1.26 -5.04 105.19 102.61 1jhk n GLY 101 Ca 0.02 -1.75 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 1jhk n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jhk s THR 102 N -2.75 0.25 -0.36 2.61 2.01 -0.35 -4.51 115.64 112.53 1jhk s THR 102 Ca 0.00 0.19 -0.20 0.00 0.31 0.00 0.00 61.69 61.99 1jhk s THR 102 Cb 0.00 -0.44 0.00 0.00 0.01 0.00 0.00 72.50 72.07 1jhk s THR 102 CO 0.00 0.23 0.61 -0.75 -0.69 0.00 0.00 174.62 174.02 1jhk s LYS 103 N 2.02 3.62 -0.44 4.92 2.47 0.43 -0.73 119.74 132.04 1jhk s LYS 103 Ca 0.05 -0.04 -0.16 0.00 -1.56 0.00 0.00 55.97 54.27 1jhk s LYS 103 Cb -0.12 -3.82 0.05 0.00 -1.46 0.00 0.00 37.83 32.47 1jhk s LYS 103 CO -0.05 -0.75 0.37 -1.17 0.16 0.00 0.00 175.35 173.91 1jhk s LEU 104 N 2.66 5.34 0.21 5.43 2.96 0.10 -1.16 118.68 134.21 1jhk s LEU 104 Ca 0.23 -1.09 0.07 0.00 -0.22 0.00 0.00 54.13 53.12 1jhk s LEU 104 Cb -0.15 -2.20 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 1jhk s LEU 104 CO 0.15 -0.57 0.09 -1.61 -1.32 0.00 0.00 176.35 173.09 1jhk s GLU 105 N 1.73 2.68 0.19 1.98 2.02 0.86 -2.70 118.70 125.45 1jhk s GLU 105 Ca 0.05 -1.07 -0.30 0.00 0.02 0.00 0.00 54.97 53.68 1jhk s GLU 105 Cb -0.21 -2.47 -0.08 0.00 0.10 0.00 0.00 34.13 31.47 1jhk s GLU 105 CO 0.09 0.44 1.10 0.08 0.02 0.00 0.00 175.26 176.98 1jhk s VAL 106 N -1.94 3.83 -0.22 2.63 1.01 -1.26 -2.18 120.40 122.26 1jhk s VAL 106 Ca 0.31 1.61 -0.09 0.00 0.00 0.00 0.00 61.98 63.80 1jhk s VAL 106 Cb -0.09 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 1jhk s VAL 106 CO 0.22 0.29 0.13 -0.75 0.00 0.00 0.00 175.10 174.99 1jhk s LYS 107 N -0.51 4.03 0.23 2.72 2.20 -0.08 -4.82 119.74 123.51 1jhk s LYS 107 Ca 0.49 -0.30 0.05 0.00 -0.36 0.00 0.00 55.97 55.85 1jhk s LYS 107 Cb -0.30 -3.43 -0.02 0.00 -1.51 0.00 0.00 37.83 32.57 1jhk s LYS 107 CO 0.35 0.12 0.20 2.89 -0.36 0.00 0.00 175.35 178.55 1jhk n ARG 108 N 4.06 0.28 -1.63 4.03 1.85 -1.26 -4.66 116.66 119.33 1jhk n ARG 108 Ca -0.16 -2.28 -0.32 0.00 -1.00 0.00 0.00 57.85 54.10 1jhk n ARG 108 Cb 0.52 1.88 0.05 0.00 -1.05 0.00 0.00 32.46 33.86 1jhk n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1jhk s ALA 109 N -2.92 2.47 0.53 2.89 0.00 -1.26 -4.96 121.76 118.51 1jhk s ALA 109 Ca 0.27 0.39 -0.22 0.00 0.00 0.00 0.00 51.96 52.41 1jhk s ALA 109 Cb 0.01 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 1jhk s ALA 109 CO 0.19 -1.34 1.30 -0.51 0.00 0.00 0.00 175.76 175.39 1jhk s ASP 110 N -2.98 5.47 -0.15 0.00 1.11 -1.26 -4.78 116.67 114.08 1jhk s ASP 110 Ca 0.64 2.62 -0.06 0.00 0.18 0.00 0.00 52.55 55.92 1jhk s ASP 110 Cb -0.18 -2.62 0.07 0.00 1.07 0.00 0.00 42.92 41.25 1jhk s ASP 110 CO 0.46 -1.42 0.33 0.00 1.18 0.00 0.00 175.17 175.72 1jhk s ALA 111 N -1.39 -0.81 0.40 5.23 0.00 1.00 -4.91 121.76 121.29 1jhk s ALA 111 Ca 0.70 1.21 -0.23 0.00 0.00 0.00 0.00 51.96 53.64 1jhk s ALA 111 Cb -0.37 -0.99 -0.09 0.00 0.00 0.00 0.00 23.12 21.67 1jhk s ALA 111 CO 0.43 -0.49 1.02 0.00 0.00 0.00 0.00 175.76 176.72 1jhk s ALA 112 N 1.99 3.07 0.61 0.00 0.00 -1.26 -0.92 121.76 125.24 1jhk s ALA 112 Ca -0.04 0.61 -0.17 0.00 0.00 0.00 0.00 51.96 52.36 1jhk s ALA 112 Cb -0.11 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 1jhk s ALA 112 CO -0.10 -0.11 1.14 -1.25 0.00 0.00 0.00 175.76 175.43 1jhk s PRO 113 N -2.64 3.00 -0.43 0.00 0.04 -1.26 -4.56 135.00 129.15 1jhk s PRO 113 Ca 0.59 1.56 -0.13 0.00 0.04 0.00 0.00 61.00 63.05 1jhk s PRO 113 Cb -0.19 -1.96 0.05 0.00 0.04 0.00 0.00 34.50 32.44 1jhk s PRO 113 CO 0.24 -1.13 0.31 0.99 0.04 0.00 0.00 177.00 177.45 1jhk s THR 114 N -1.99 4.95 -0.01 1.26 2.01 -0.09 -4.87 115.64 116.90 1jhk s THR 114 Ca 0.71 -0.95 -0.19 0.00 0.31 0.00 0.00 61.69 61.57 1jhk s THR 114 Cb -0.24 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 1jhk s THR 114 CO 0.35 -0.42 0.55 -0.69 -0.69 0.00 0.00 174.62 173.72 1jhk s VAL 115 N 1.60 4.95 -0.03 3.82 1.01 -1.25 -1.82 120.40 128.69 1jhk s VAL 115 Ca 0.04 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.16 1jhk s VAL 115 Cb -0.21 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.31 1jhk s VAL 115 CO 0.07 0.44 -0.01 -0.44 0.00 0.00 0.00 175.10 175.16 1jhk s SER 116 N -0.28 0.44 -0.06 3.32 0.01 -0.28 -4.91 113.70 111.94 1jhk s SER 116 Ca 0.29 -0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.56 1jhk s SER 116 Cb -0.18 -0.21 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 1jhk s SER 116 CO 0.16 -0.07 -0.20 -0.51 0.41 0.00 0.00 173.24 173.02 1jhk s ILE 117 N 0.82 2.50 -0.16 1.44 2.07 -1.26 0.18 121.20 126.79 1jhk s ILE 117 Ca -0.08 -0.91 0.00 0.00 -1.41 0.00 0.00 60.65 58.25 1jhk s ILE 117 Cb -0.12 -1.95 0.03 0.00 0.13 0.00 0.00 42.46 40.55 1jhk s ILE 117 CO -0.01 0.57 -0.13 -0.36 -1.91 0.00 0.00 174.94 173.10 1jhk s PHE 118 N -0.32 2.21 1.00 3.50 0.08 0.18 -4.99 117.98 119.63 1jhk s PHE 118 Ca 0.02 -1.29 -0.12 0.00 0.12 0.00 0.00 56.93 55.66 1jhk s PHE 118 Cb -0.13 -1.60 0.19 0.00 -0.57 0.00 0.00 43.02 40.91 1jhk s PHE 118 CO 0.02 -0.68 1.08 -2.14 -0.10 0.00 0.00 175.22 173.41 1jhk s PRO 119 N 1.47 0.40 0.55 0.24 0.02 -1.26 -1.96 135.00 134.46 1jhk s PRO 119 Ca 0.04 1.05 -0.21 0.00 0.02 0.00 0.00 61.00 61.89 1jhk s PRO 119 Cb -0.13 -1.69 -0.05 0.00 0.02 0.00 0.00 34.50 32.65 1jhk s PRO 119 CO -0.10 -2.89 1.30 -2.14 -0.33 0.00 0.00 177.00 172.83 1jhk s PRO 120 N -4.68 3.15 0.75 5.54 0.02 -1.25 -4.79 135.00 133.74 1jhk s PRO 120 Ca 0.66 2.08 -0.12 0.00 0.02 0.00 0.00 61.00 63.64 1jhk s PRO 120 Cb -0.22 -2.19 0.04 0.00 0.02 0.00 0.00 34.50 32.16 1jhk s PRO 120 CO 0.60 -1.13 1.11 -1.54 -0.33 0.00 0.00 177.00 175.71 1jhk s SER 121 N -1.17 5.04 0.05 2.53 1.04 -1.26 -4.91 113.70 115.02 1jhk s SER 121 Ca 0.72 1.10 -0.25 0.00 0.48 0.00 0.00 55.95 58.01 1jhk s SER 121 Cb -0.37 -1.83 -0.17 0.00 0.10 0.00 0.00 66.02 63.75 1jhk s SER 121 CO 0.42 -1.60 1.57 0.28 0.98 0.00 0.00 173.24 174.90 1jhk h SER 122 N -0.84 -0.11 -0.45 7.02 0.02 -1.99 -2.23 113.55 114.98 1jhk h SER 122 Ca -0.46 -0.12 0.09 0.00 -0.84 0.00 0.00 61.79 60.46 1jhk h SER 122 Cb 1.27 0.03 -0.09 0.00 0.14 0.00 0.00 62.40 63.75 1jhk h SER 122 CO 0.63 0.06 -0.17 -0.08 -1.14 0.00 0.00 176.83 176.13 1jhk h GLU 123 N -0.27 -0.08 -0.42 3.45 4.81 -2.00 -0.64 114.58 119.44 1jhk h GLU 123 Ca -0.01 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1jhk h GLU 123 Cb 0.22 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 1jhk h GLU 123 CO 0.02 -0.05 0.14 0.37 -0.73 0.00 0.00 179.01 178.76 1jhk h GLN 124 N -0.08 0.64 -0.79 1.92 4.15 -1.86 -2.73 115.11 116.36 1jhk h GLN 124 Ca 0.22 -0.14 0.02 0.00 0.77 0.00 0.00 58.65 59.52 1jhk h GLN 124 Cb 0.41 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.96 1jhk h GLN 124 CO -0.50 0.63 0.52 -0.07 -1.93 0.00 0.00 178.83 177.48 1jhk h LEU 125 N 0.53 0.88 -1.29 -2.39 3.38 -0.90 -0.46 115.31 115.06 1jhk h LEU 125 Ca 0.14 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1jhk h LEU 125 Cb 0.25 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1jhk h LEU 125 CO -0.01 0.63 0.51 0.74 0.09 0.00 0.00 178.44 180.40 1jhk h THR 126 N 1.04 1.07 -0.01 0.22 2.02 -0.84 -0.61 112.91 115.79 1jhk h THR 126 Ca 0.30 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1jhk h THR 126 Cb -0.06 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 1jhk h THR 126 CO -0.07 0.16 0.00 -1.54 0.37 0.00 0.00 175.52 174.44 1jhk n SER 127 N -4.47 0.31 0.00 4.18 3.41 -0.25 -4.89 113.62 111.91 1jhk n SER 127 Ca 0.11 -1.20 0.00 0.00 -0.26 0.00 0.00 58.87 57.52 1jhk n SER 127 Cb 0.18 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1jhk n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jhk n GLY 128 N 0.99 0.66 3.85 5.00 0.00 -0.24 -5.06 105.19 110.40 1jhk n GLY 128 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 1jhk n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jhk s GLY 129 N -1.33 1.84 -0.36 -0.02 0.00 -0.81 -1.10 107.32 105.54 1jhk s GLY 129 Ca 0.00 -1.69 0.06 0.00 0.00 0.00 0.00 44.72 43.08 1jhk s GLY 129 CO 0.00 -1.60 0.54 0.00 0.00 0.00 0.00 173.10 172.03 1jhk s ALA 130 N -2.33 -1.81 -0.25 3.20 0.00 -0.08 -2.93 121.76 117.55 1jhk s ALA 130 Ca 0.42 0.16 -0.09 0.00 0.00 0.00 0.00 51.96 52.45 1jhk s ALA 130 Cb -0.05 -2.46 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1jhk s ALA 130 CO 0.27 -2.04 0.14 -1.12 0.00 0.00 0.00 175.76 173.00 1jhk s SER 131 N 2.09 5.74 -0.27 0.00 0.01 -1.26 -0.60 113.70 119.41 1jhk s SER 131 Ca 0.14 -0.03 -0.11 0.00 1.31 0.00 0.00 55.95 57.25 1jhk s SER 131 Cb -0.09 -2.04 -0.05 0.00 0.21 0.00 0.00 66.02 64.05 1jhk s SER 131 CO -0.14 0.00 0.20 -0.69 0.41 0.00 0.00 173.24 173.02 1jhk s VAL 132 N 1.43 5.31 -0.01 3.43 1.01 0.16 -3.86 120.40 127.86 1jhk s VAL 132 Ca 0.06 0.22 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 1jhk s VAL 132 Cb -0.15 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1jhk s VAL 132 CO 0.06 0.26 0.08 -0.69 0.00 0.00 0.00 175.10 174.82 1jhk s VAL 133 N 1.64 4.77 -0.03 2.92 1.01 -0.83 -0.99 120.40 128.89 1jhk s VAL 133 Ca 0.08 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1jhk s VAL 133 Cb -0.15 -3.17 0.01 0.00 0.00 0.00 0.00 36.38 33.07 1jhk s VAL 133 CO 0.10 0.37 -0.05 0.00 0.00 0.00 0.00 175.10 175.51 1jhk s PHE 135 N 0.59 2.85 -0.52 0.00 0.08 0.13 -1.64 117.98 119.47 1jhk s PHE 135 Ca -0.08 -0.48 0.03 0.00 0.12 0.00 0.00 56.93 56.52 1jhk s PHE 135 Cb -0.11 -1.84 0.13 0.00 -0.57 0.00 0.00 43.02 40.63 1jhk s PHE 135 CO 0.00 -0.10 0.27 -0.51 -0.10 0.00 0.00 175.22 174.78 1jhk s LEU 136 N 0.18 4.49 0.20 -0.37 1.02 -0.72 -1.13 118.68 122.35 1jhk s LEU 136 Ca -0.06 -2.92 0.02 0.00 0.02 0.00 0.00 54.13 51.19 1jhk s LEU 136 Cb -0.15 -1.67 -0.04 0.00 0.02 0.00 0.00 46.19 44.36 1jhk s LEU 136 CO 0.04 -0.26 0.36 0.20 0.02 0.00 0.00 176.35 176.71 1jhk s ASN 137 N -0.05 6.34 -1.25 2.29 0.01 -0.75 -0.41 114.94 121.12 1jhk s ASN 137 Ca 0.16 0.24 -0.29 0.00 -0.71 0.00 0.00 52.86 52.26 1jhk s ASN 137 Cb -0.25 -1.94 0.03 0.00 0.41 0.00 0.00 41.25 39.51 1jhk s ASN 137 CO -0.01 -0.03 0.62 0.59 -1.51 0.00 0.00 177.10 176.76 1jhk n ASN 138 N -0.90 -3.68 -4.69 -1.22 4.13 -1.16 -0.91 115.26 106.85 1jhk n ASN 138 Ca -0.07 -1.26 -0.25 0.00 1.68 0.00 0.00 54.58 54.68 1jhk n ASN 138 Cb 0.55 -1.90 -0.08 0.00 -1.54 0.00 0.00 39.78 36.81 1jhk n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1jhk s PHE 139 N -3.62 2.58 -0.28 3.10 -0.71 -0.34 -4.62 117.98 114.10 1jhk s PHE 139 Ca 0.43 -0.54 -0.23 0.00 -1.04 0.00 0.00 56.93 55.56 1jhk s PHE 139 Cb -0.23 -1.77 0.09 0.00 -1.21 0.00 0.00 43.02 39.91 1jhk s PHE 139 CO 0.96 0.33 0.83 -0.47 -1.34 0.00 0.00 175.22 175.52 1jhk s TYR 140 N -2.58 -0.73 1.13 3.49 5.04 -0.10 -0.27 117.35 123.33 1jhk s TYR 140 Ca 0.38 1.68 -0.16 0.00 -2.44 0.00 0.00 57.07 56.52 1jhk s TYR 140 Cb 0.03 0.37 0.25 0.00 0.35 0.00 0.00 41.96 42.97 1jhk s TYR 140 CO 0.21 -0.36 1.09 -1.25 -1.34 0.00 0.00 175.55 173.91 1jhk s PRO 141 N 0.65 -0.67 0.56 4.97 0.04 -1.26 -0.00 135.00 139.29 1jhk s PRO 141 Ca -0.02 0.18 0.35 0.00 0.04 0.00 0.00 61.00 61.56 1jhk s PRO 141 Cb -0.05 -1.64 1.52 0.00 0.04 0.00 0.00 34.50 34.37 1jhk s PRO 141 CO -0.06 -3.40 2.03 1.57 0.04 0.00 0.00 177.00 177.19 1jhk h LYS 142 N -2.36 0.00 -6.47 4.56 2.10 -1.97 -3.44 116.57 108.99 1jhk h LYS 142 Ca -0.50 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.62 1jhk h LYS 142 Cb 1.31 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.67 1jhk h LYS 142 CO 0.44 0.00 0.98 -0.51 -2.00 0.00 0.00 179.45 178.36 1jhk s ASP 143 N -5.56 6.61 -0.16 7.07 1.01 -1.26 -4.97 116.67 119.40 1jhk s ASP 143 Ca 0.00 2.49 -0.28 0.00 0.71 0.00 0.00 52.55 55.47 1jhk s ASP 143 Cb 0.10 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.55 1jhk s ASP 143 CO 0.52 -0.87 0.82 -0.51 0.21 0.00 0.00 175.17 175.34 1jhk s ILE 144 N 2.44 0.00 0.02 0.77 2.07 -1.26 -4.66 121.20 120.58 1jhk s ILE 144 Ca 0.73 0.00 0.05 0.00 -1.41 0.00 0.00 60.65 60.02 1jhk s ILE 144 Cb -0.40 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.17 1jhk s ILE 144 CO 0.32 0.00 -0.16 0.20 -1.91 0.00 0.00 174.94 173.39 1jhk s ASN 145 N -0.59 1.87 -0.00 4.50 0.01 -1.07 -5.00 114.94 114.66 1jhk s ASN 145 Ca -0.04 -0.39 0.08 0.00 -0.71 0.00 0.00 52.86 51.81 1jhk s ASN 145 Cb -0.02 -0.17 -0.02 0.00 0.41 0.00 0.00 41.25 41.45 1jhk s ASN 145 CO 0.03 0.13 -0.26 -0.69 -1.51 0.00 0.00 177.10 174.80 1jhk s VAL 146 N -0.61 2.11 -0.04 1.60 1.01 -1.26 -1.15 120.40 122.06 1jhk s VAL 146 Ca 0.05 -1.17 0.01 0.00 0.00 0.00 0.00 61.98 60.86 1jhk s VAL 146 Cb -0.07 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.58 1jhk s VAL 146 CO 0.01 0.52 -0.02 -0.75 0.00 0.00 0.00 175.10 174.86 1jhk s LYS 147 N -0.78 0.56 0.16 2.72 2.20 0.41 -5.00 119.74 120.01 1jhk s LYS 147 Ca 0.11 0.00 -0.03 0.00 -0.36 0.00 0.00 55.97 55.68 1jhk s LYS 147 Cb -0.10 -0.69 -0.05 0.00 -1.51 0.00 0.00 37.83 35.48 1jhk s LYS 147 CO -0.00 -0.13 0.38 -1.58 -0.36 0.00 0.00 175.35 173.66 1jhk s TRP 148 N 1.07 3.48 -0.02 4.03 0.52 -1.26 -1.01 118.94 125.75 1jhk s TRP 148 Ca -0.09 0.47 0.00 0.00 0.02 0.00 0.00 56.10 56.50 1jhk s TRP 148 Cb -0.14 -1.94 0.03 0.00 -1.15 0.00 0.00 33.47 30.27 1jhk s TRP 148 CO -0.01 0.42 0.02 0.15 0.02 0.00 0.00 176.95 177.55 1jhk s LYS 149 N -2.88 0.05 -0.19 4.98 1.02 -0.35 -1.02 119.74 121.35 1jhk s LYS 149 Ca 0.40 0.15 0.01 0.00 0.02 0.00 0.00 55.97 56.55 1jhk s LYS 149 Cb -0.12 -0.30 0.02 0.00 -0.52 0.00 0.00 37.83 36.91 1jhk s LYS 149 CO 0.26 -0.16 -0.19 0.42 -0.92 0.00 0.00 175.35 174.77 1jhk s ILE 150 N 1.03 2.13 -1.40 2.17 1.01 -0.12 -0.83 121.20 125.20 1jhk s ILE 150 Ca -0.09 -0.95 -0.01 0.00 0.00 0.00 0.00 60.65 59.60 1jhk s ILE 150 Cb -0.13 -1.92 0.01 0.00 0.01 0.00 0.00 42.46 40.43 1jhk s ILE 150 CO -0.03 0.50 0.48 0.47 0.00 0.00 0.00 174.94 176.37 1jhk n ASP 151 N 4.62 -0.59 -0.10 3.58 8.00 -0.36 -1.22 116.55 130.48 1jhk n ASP 151 Ca -0.21 -0.97 -0.01 0.00 0.71 0.00 0.00 54.79 54.31 1jhk n ASP 151 Cb 0.50 -3.24 -0.01 0.00 -0.02 0.00 0.00 41.12 38.35 1jhk n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jhk n GLY 152 N -1.89 0.36 3.24 0.44 0.00 -1.26 -5.00 105.19 101.07 1jhk n GLY 152 Ca -0.30 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.36 1jhk n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jhk s SER 153 N -2.11 2.87 0.52 1.61 0.01 -0.36 -5.07 113.70 111.17 1jhk s SER 153 Ca 0.00 -0.47 -0.23 0.00 1.31 0.00 0.00 55.95 56.56 1jhk s SER 153 Cb 0.00 -0.75 -0.06 0.00 0.21 0.00 0.00 66.02 65.42 1jhk s SER 153 CO 0.00 0.23 1.34 1.21 0.41 0.00 0.00 173.24 176.43 1jhk n GLU 154 N 2.94 1.78 -4.31 12.44 2.13 -1.26 -0.94 120.64 133.43 1jhk n GLU 154 Ca -0.17 0.65 -0.25 0.00 0.66 0.00 0.00 57.16 58.04 1jhk n GLU 154 Cb 0.52 -2.54 -0.17 0.00 0.27 0.00 0.00 31.44 29.52 1jhk n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1jhk s ARG 155 N -2.71 1.60 -0.01 5.31 6.06 -0.19 -4.83 118.95 124.19 1jhk s ARG 155 Ca 0.69 -0.34 0.00 0.00 -2.50 0.00 0.00 55.73 53.58 1jhk s ARG 155 Cb -0.43 -1.45 -0.01 0.00 0.06 0.00 0.00 34.95 33.12 1jhk s ARG 155 CO 0.52 -0.09 -0.00 1.04 -2.50 0.00 0.00 175.30 174.27 1jhk n GLN 156 N 4.25 2.83 -3.05 5.12 6.02 -1.26 -4.01 117.38 127.28 1jhk n GLN 156 Ca -0.19 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.45 1jhk n GLN 156 Cb 0.51 -1.01 -0.06 0.00 1.02 0.00 0.00 30.24 30.69 1jhk n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1jhk s ASN 157 N -3.34 7.00 0.00 1.08 0.01 -1.26 -3.79 114.94 114.63 1jhk s ASN 157 Ca -0.00 1.45 0.00 0.00 -0.71 0.00 0.00 52.86 53.60 1jhk s ASN 157 Cb 0.00 -2.44 0.00 0.00 0.41 0.00 0.00 41.25 39.23 1jhk s ASN 157 CO 0.02 -0.09 0.00 0.61 -1.51 0.00 0.00 177.10 176.13 1jhk n GLY 158 N 0.25 0.95 3.75 0.66 0.00 -1.26 -4.87 105.19 104.67 1jhk n GLY 158 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1jhk n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jhk s VAL 159 N -2.76 5.24 -0.04 1.61 1.01 -1.25 -0.96 120.40 123.25 1jhk s VAL 159 Ca 0.00 0.68 0.02 0.00 0.00 0.00 0.00 61.98 62.67 1jhk s VAL 159 Cb 0.00 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.72 1jhk s VAL 159 CO 0.00 0.42 -0.08 -0.76 0.00 0.00 0.00 175.10 174.68 1jhk s LEU 160 N 0.17 1.53 0.15 3.92 1.43 -0.60 -4.97 118.68 120.32 1jhk s LEU 160 Ca 0.20 -0.19 0.11 0.00 -1.03 0.00 0.00 54.13 53.22 1jhk s LEU 160 Cb -0.14 -0.57 -0.04 0.00 0.03 0.00 0.00 46.19 45.47 1jhk s LEU 160 CO 0.07 -0.00 -0.24 0.20 0.23 0.00 0.00 176.35 176.61 1jhk s ASN 161 N 0.66 3.46 0.01 2.29 0.01 -1.26 -1.32 114.94 118.80 1jhk s ASN 161 Ca -0.11 -0.77 0.01 0.00 -0.71 0.00 0.00 52.86 51.29 1jhk s ASN 161 Cb -0.13 -0.29 -0.01 0.00 0.41 0.00 0.00 41.25 41.23 1jhk s ASN 161 CO 0.01 0.15 -0.04 -0.55 -1.51 0.00 0.00 177.10 175.17 1jhk s SER 162 N -2.33 0.45 -0.09 -1.22 0.15 -0.40 -4.99 113.70 105.26 1jhk s SER 162 Ca 0.17 -0.20 0.02 0.00 0.70 0.00 0.00 55.95 56.64 1jhk s SER 162 Cb -0.09 -0.01 0.01 0.00 -1.71 0.00 0.00 66.02 64.22 1jhk s SER 162 CO 0.08 -0.04 -0.13 0.26 1.20 0.00 0.00 173.24 174.61 1jhk s TRP 163 N -0.47 1.71 0.82 3.44 0.51 -1.26 -0.99 118.94 122.69 1jhk s TRP 163 Ca -0.03 -0.74 -0.12 0.00 -2.12 0.00 0.00 56.10 53.09 1jhk s TRP 163 Cb -0.04 -1.26 0.08 0.00 -0.81 0.00 0.00 33.47 31.44 1jhk s TRP 163 CO -0.00 -0.39 1.12 0.95 -0.51 0.00 0.00 176.95 178.12 1jhk s THR 164 N 0.92 2.68 0.67 2.01 -4.23 -0.71 -5.02 115.64 111.96 1jhk s THR 164 Ca -0.09 0.22 -0.04 0.00 -1.18 0.00 0.00 61.69 60.60 1jhk s THR 164 Cb -0.15 -3.05 0.06 0.00 1.34 0.00 0.00 72.50 70.70 1jhk s THR 164 CO 0.00 -0.29 0.96 -1.81 -0.54 0.00 0.00 174.62 172.94 1jhk s ASP 165 N -4.12 4.84 0.13 3.99 1.11 -1.26 -4.52 116.67 116.85 1jhk s ASP 165 Ca 0.61 0.24 -0.32 0.00 0.18 0.00 0.00 52.55 53.26 1jhk s ASP 165 Cb -0.13 -0.92 -0.12 0.00 1.07 0.00 0.00 42.92 42.82 1jhk s ASP 165 CO 0.53 -1.53 1.74 1.67 1.18 0.00 0.00 175.17 178.76 1jhk n GLN 166 N -2.78 2.56 -1.98 8.23 7.27 -1.26 -4.71 117.38 124.70 1jhk n GLN 166 Ca 0.09 0.93 -0.41 0.00 0.07 0.00 0.00 57.00 57.67 1jhk n GLN 166 Cb 0.60 -2.77 -0.02 0.00 2.41 0.00 0.00 30.24 30.46 1jhk n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1jhk s ASP 167 N 1.97 6.60 0.53 1.69 -1.08 0.25 -4.90 116.67 121.73 1jhk s ASP 167 Ca 0.80 2.78 0.33 0.00 -0.52 0.00 0.00 52.55 55.94 1jhk s ASP 167 Cb -0.56 -2.64 1.32 0.00 -1.46 0.00 0.00 42.92 39.58 1jhk s ASP 167 CO 0.38 -0.70 1.96 0.77 0.52 0.00 0.00 175.17 178.09 1jhk h SER 168 N 4.05 0.00 0.12 -0.34 4.64 -1.91 -1.79 113.55 118.32 1jhk h SER 168 Ca -0.48 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.48 1jhk h SER 168 Cb 1.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.25 1jhk h SER 168 CO 0.71 0.00 -2.23 0.29 -0.87 0.00 0.00 176.83 174.73 1jhk n LYS 169 N -3.05 0.68 0.00 4.77 5.02 -1.26 -4.69 118.16 119.62 1jhk n LYS 169 Ca 0.01 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1jhk n LYS 169 Cb 0.31 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1jhk n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1jhk n ASP 170 N -3.00 0.85 -1.21 4.39 5.68 -1.25 -5.02 116.55 117.00 1jhk n ASP 170 Ca -0.32 -1.23 -0.16 0.00 -0.50 0.00 0.00 54.79 52.58 1jhk n ASP 170 Cb 1.09 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 41.00 1jhk n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1jhk n SER 171 N -0.11 -5.32 -4.98 -1.12 7.64 -0.67 -4.97 113.62 104.08 1jhk n SER 171 Ca 0.00 0.39 -0.19 0.00 1.01 0.00 0.00 58.87 60.08 1jhk n SER 171 Cb 0.19 -4.21 0.03 0.00 -1.01 0.00 0.00 64.21 59.21 1jhk n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1jhk s THR 172 N -2.44 2.69 0.17 0.44 -4.23 -1.26 -4.67 115.64 106.34 1jhk s THR 172 Ca 0.00 -0.90 0.10 0.00 -1.18 0.00 0.00 61.69 59.72 1jhk s THR 172 Cb 0.00 -2.79 -0.04 0.00 1.34 0.00 0.00 72.50 71.01 1jhk s THR 172 CO 0.00 0.00 -0.23 -0.31 -0.54 0.00 0.00 174.62 173.54 1jhk s TYR 173 N -2.56 2.16 0.12 3.99 2.02 0.63 -0.58 117.35 123.12 1jhk s TYR 173 Ca 0.58 -0.39 0.03 0.00 -0.37 0.00 0.00 57.07 56.92 1jhk s TYR 173 Cb -0.09 -1.09 -0.04 0.00 -0.40 0.00 0.00 41.96 40.33 1jhk s TYR 173 CO 0.36 0.41 -0.09 -1.12 -1.57 0.00 0.00 175.55 173.54 1jhk s SER 174 N -2.50 1.53 0.04 2.29 0.01 -1.26 -1.20 113.70 112.61 1jhk s SER 174 Ca 0.17 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.47 1jhk s SER 174 Cb -0.08 0.02 -0.03 0.00 0.21 0.00 0.00 66.02 66.15 1jhk s SER 174 CO 0.08 -0.36 -0.04 -0.32 0.41 0.00 0.00 173.24 173.01 1jhk s MET 175 N -3.57 0.47 -0.09 12.44 1.75 0.45 -1.74 119.30 129.02 1jhk s MET 175 Ca 0.13 -0.87 0.01 0.00 -1.25 0.00 0.00 55.69 53.72 1jhk s MET 175 Cb 0.02 0.05 0.02 0.00 2.84 0.00 0.00 34.83 37.76 1jhk s MET 175 CO -0.01 -0.05 -0.12 0.45 -0.65 0.00 0.00 175.02 174.64 1jhk s SER 176 N -2.03 2.02 -0.10 1.11 0.15 -0.16 -1.76 113.70 112.94 1jhk s SER 176 Ca -0.06 -0.33 0.03 0.00 0.70 0.00 0.00 55.95 56.29 1jhk s SER 176 Cb -0.04 -0.89 0.01 0.00 -1.71 0.00 0.00 66.02 63.39 1jhk s SER 176 CO -0.04 -0.01 -0.20 -0.55 1.20 0.00 0.00 173.24 173.65 1jhk s SER 177 N 1.00 2.69 -0.11 5.45 0.15 -0.65 -1.28 113.70 120.94 1jhk s SER 177 Ca -0.08 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.09 1jhk s SER 177 Cb -0.15 -1.23 0.02 0.00 -1.71 0.00 0.00 66.02 62.95 1jhk s SER 177 CO -0.01 0.10 -0.10 -0.89 1.20 0.00 0.00 173.24 173.55 1jhk s THR 178 N 0.56 1.16 -0.36 6.45 2.01 -0.43 -1.03 115.64 124.00 1jhk s THR 178 Ca -0.15 -0.39 -0.14 0.00 0.31 0.00 0.00 61.69 61.32 1jhk s THR 178 Cb -0.17 -1.14 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 1jhk s THR 178 CO 0.05 0.39 0.31 -0.22 -0.69 0.00 0.00 174.62 174.46 1jhk s LEU 179 N 1.52 4.60 -0.13 4.42 2.96 -0.16 -1.55 118.68 130.34 1jhk s LEU 179 Ca 0.02 -0.44 -0.10 0.00 -0.22 0.00 0.00 54.13 53.40 1jhk s LEU 179 Cb -0.13 -2.24 -0.05 0.00 0.50 0.00 0.00 46.19 44.27 1jhk s LEU 179 CO -0.07 -0.33 0.19 -0.89 -1.32 0.00 0.00 176.35 173.92 1jhk s THR 180 N 1.87 5.40 0.26 3.68 2.01 -0.13 0.40 115.64 129.13 1jhk s THR 180 Ca 0.09 0.33 -0.07 0.00 0.31 0.00 0.00 61.69 62.34 1jhk s THR 180 Cb -0.17 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.84 1jhk s THR 180 CO 0.11 0.54 0.38 -0.76 -0.69 0.00 0.00 174.62 174.20 1jhk s LEU 181 N -0.47 0.74 0.36 4.42 1.43 0.23 -4.75 118.68 120.64 1jhk s LEU 181 Ca 0.14 -1.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.04 1jhk s LEU 181 Cb -0.12 1.31 -0.03 0.00 0.03 0.00 0.00 46.19 47.38 1jhk s LEU 181 CO 0.04 -1.10 0.57 0.42 0.23 0.00 0.00 176.35 176.50 1jhk s THR 182 N -3.79 4.99 0.32 5.49 -4.23 -1.26 -0.91 115.64 116.24 1jhk s THR 182 Ca 0.29 -0.45 0.06 0.00 -1.18 0.00 0.00 61.69 60.41 1jhk s THR 182 Cb 0.01 -3.82 0.31 0.00 1.34 0.00 0.00 72.50 70.34 1jhk s THR 182 CO 0.13 -0.55 1.82 0.50 -0.54 0.00 0.00 174.62 175.98 1jhk h LYS 183 N 0.70 0.76 -0.12 3.99 3.64 -1.32 -0.76 116.57 123.47 1jhk h LYS 183 Ca -0.49 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 58.79 1jhk h LYS 183 Cb 1.22 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1jhk h LYS 183 CO 0.61 0.51 -0.11 -0.44 -2.27 0.00 0.00 179.45 177.74 1jhk h ASP 184 N 0.79 0.31 -0.63 4.20 3.45 -1.94 -1.57 116.42 121.03 1jhk h ASP 184 Ca 0.53 -0.48 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 1jhk h ASP 184 Cb 0.78 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 39.43 1jhk h ASP 184 CO -0.30 0.72 0.38 -0.33 -1.57 0.00 0.00 179.24 178.14 1jhk h GLU 185 N -0.10 0.86 -0.59 3.56 5.08 -1.83 -2.66 114.58 118.90 1jhk h GLU 185 Ca 0.02 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1jhk h GLU 185 Cb 0.63 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1jhk h GLU 185 CO 0.03 0.62 0.10 -0.92 -1.00 0.00 0.00 179.01 177.84 1jhk h TYR 186 N 0.86 0.99 0.00 4.33 5.03 -1.15 -2.94 116.97 124.09 1jhk h TYR 186 Ca 0.23 -0.12 0.00 0.00 2.58 0.00 0.00 58.73 61.42 1jhk h TYR 186 Cb -0.02 -0.28 0.00 0.00 1.55 0.00 0.00 36.73 37.98 1jhk h TYR 186 CO -0.02 0.84 0.00 0.39 -1.32 0.00 0.00 178.16 178.06 1jhk n GLU 187 N -4.23 0.24 0.00 1.82 1.02 -0.59 -3.08 120.64 115.81 1jhk n GLU 187 Ca 0.04 0.02 0.14 0.00 -0.02 0.00 0.00 57.16 57.34 1jhk n GLU 187 Cb 0.27 -1.50 0.65 0.00 -0.02 0.00 0.00 31.44 30.84 1jhk n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1jhk n ARG 188 N -1.37 0.25 -4.24 3.49 1.74 -1.03 -4.86 116.66 110.63 1jhk n ARG 188 Ca 0.11 -0.02 -0.16 0.00 -0.77 0.00 0.00 57.85 57.01 1jhk n ARG 188 Cb 0.27 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.10 1jhk n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1jhk s HIS 189 N -2.77 1.31 -0.21 -1.55 3.76 -1.18 -5.09 115.29 109.56 1jhk s HIS 189 Ca 0.21 -0.67 -0.09 0.00 -0.15 0.00 0.00 55.06 54.37 1jhk s HIS 189 Cb 0.20 -0.67 -0.10 0.00 1.11 0.00 0.00 32.58 33.12 1jhk s HIS 189 CO 0.51 0.11 -0.27 -1.71 -0.85 0.00 0.00 174.74 172.54 1jhk n ASN 190 N 0.11 1.64 -4.75 1.40 5.15 -1.26 -4.77 115.26 112.78 1jhk n ASN 190 Ca -0.12 0.21 -0.35 0.00 -0.60 0.00 0.00 54.58 53.72 1jhk n ASN 190 Cb 0.59 -0.59 -0.08 0.00 -0.53 0.00 0.00 39.78 39.17 1jhk n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1jhk s SER 191 N -6.81 6.05 -0.12 1.20 1.04 -1.26 -0.95 113.70 112.84 1jhk s SER 191 Ca -0.30 0.26 0.02 0.00 0.48 0.00 0.00 55.95 56.41 1jhk s SER 191 Cb 0.11 -2.00 0.01 0.00 0.10 0.00 0.00 66.02 64.24 1jhk s SER 191 CO 0.39 0.27 -0.17 -0.31 0.98 0.00 0.00 173.24 174.40 1jhk s TYR 192 N -0.18 2.15 -0.04 5.02 1.51 -0.11 -1.22 117.35 124.49 1jhk s TYR 192 Ca 0.09 -1.04 0.04 0.00 -1.01 0.00 0.00 57.07 55.15 1jhk s TYR 192 Cb -0.12 -1.53 -0.00 0.00 -0.11 0.00 0.00 41.96 40.20 1jhk s TYR 192 CO 0.01 -0.52 -0.16 0.99 -1.11 0.00 0.00 175.55 174.76 1jhk s THR 193 N 0.97 1.35 -0.27 -0.71 2.01 -0.01 -1.29 115.64 117.68 1jhk s THR 193 Ca -0.06 -0.67 -0.05 0.00 0.31 0.00 0.00 61.69 61.21 1jhk s THR 193 Cb -0.15 -1.16 0.01 0.00 0.01 0.00 0.00 72.50 71.21 1jhk s THR 193 CO -0.02 0.39 0.03 0.00 -0.69 0.00 0.00 174.62 174.33 1jhk s GLU 195 N 1.47 3.18 0.04 0.00 2.02 -0.18 -2.30 118.70 122.92 1jhk s GLU 195 Ca 0.03 -0.78 0.03 0.00 0.02 0.00 0.00 54.97 54.27 1jhk s GLU 195 Cb -0.16 -2.56 -0.04 0.00 0.10 0.00 0.00 34.13 31.47 1jhk s GLU 195 CO 0.00 0.04 -0.00 0.00 0.02 0.00 0.00 175.26 175.32 1jhk s ALA 196 N 0.73 3.27 -0.17 5.21 0.00 -0.23 -0.45 121.76 130.13 1jhk s ALA 196 Ca -0.07 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.87 1jhk s ALA 196 Cb -0.16 -1.27 0.02 0.00 0.00 0.00 0.00 23.12 21.71 1jhk s ALA 196 CO 0.01 0.67 -0.17 0.99 0.00 0.00 0.00 175.76 177.25 1jhk s THR 197 N -1.17 1.87 0.04 0.00 2.01 -0.30 0.11 115.64 118.19 1jhk s THR 197 Ca 0.22 -0.84 -0.00 0.00 0.31 0.00 0.00 61.69 61.38 1jhk s THR 197 Cb -0.12 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.64 1jhk s THR 197 CO 0.13 0.49 -0.03 -2.28 -0.69 0.00 0.00 174.62 172.24 1jhk s HIS 198 N 1.36 0.44 -0.71 4.92 5.04 -1.26 -2.60 115.29 122.49 1jhk s HIS 198 Ca 0.05 -0.81 0.11 0.00 -1.54 0.00 0.00 55.06 52.87 1jhk s HIS 198 Cb -0.13 -0.32 0.56 0.00 0.04 0.00 0.00 32.58 32.73 1jhk s HIS 198 CO -0.12 -0.27 1.35 0.36 -2.34 0.00 0.00 174.74 173.72 1jhk n LYS 199 N 0.78 0.06 -0.03 2.88 2.85 -1.26 -2.11 118.16 121.34 1jhk n LYS 199 Ca -0.18 0.49 0.07 0.00 -1.05 0.00 0.00 58.31 57.64 1jhk n LYS 199 Cb 0.58 -1.67 0.37 0.00 -0.65 0.00 0.00 35.03 33.66 1jhk n LYS 199 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1jhk n THR 200 N -1.80 0.08 -3.61 0.58 -2.24 -1.26 -4.80 114.28 101.22 1jhk n THR 200 Ca 0.00 -0.11 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 1jhk n THR 200 Cb 0.07 -0.06 -0.07 0.00 -2.10 0.00 0.00 70.33 68.17 1jhk n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1jhk s SER 201 N -1.42 -0.62 0.00 3.42 0.15 -0.90 -4.96 113.70 109.38 1jhk s SER 201 Ca 0.23 1.09 0.27 0.00 0.70 0.00 0.00 55.95 58.25 1jhk s SER 201 Cb 0.11 1.08 0.94 0.00 -1.71 0.00 0.00 66.02 66.44 1jhk s SER 201 CO 0.18 -0.28 1.68 0.35 1.20 0.00 0.00 173.24 176.37 1jhk n THR 202 N 2.15 0.00 -4.23 6.45 -2.24 -1.26 -4.42 114.28 110.73 1jhk n THR 202 Ca -0.14 -0.27 -0.23 0.00 -2.27 0.00 0.00 64.05 61.14 1jhk n THR 202 Cb 0.56 0.59 -0.07 0.00 -2.10 0.00 0.00 70.33 69.31 1jhk n THR 202 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1jhk s SER 203 N -2.04 4.54 0.43 3.42 0.01 -1.26 -5.10 113.70 113.70 1jhk s SER 203 Ca 0.36 -0.74 -0.24 0.00 1.31 0.00 0.00 55.95 56.64 1jhk s SER 203 Cb 0.21 -0.76 -0.08 0.00 0.21 0.00 0.00 66.02 65.60 1jhk s SER 203 CO 0.35 -0.14 1.14 -2.84 0.41 0.00 0.00 173.24 172.15 1jhk s PRO 204 N -3.74 3.93 -0.47 12.44 0.02 -1.26 -4.76 135.00 141.17 1jhk s PRO 204 Ca 0.34 1.72 -0.15 0.00 0.02 0.00 0.00 61.00 62.94 1jhk s PRO 204 Cb -0.04 -2.50 0.07 0.00 0.02 0.00 0.00 34.50 32.05 1jhk s PRO 204 CO 0.21 -0.39 0.38 0.42 -0.33 0.00 0.00 177.00 177.28 1jhk s ILE 205 N -1.54 5.11 0.35 2.83 1.01 0.12 -4.90 121.20 124.18 1jhk s ILE 205 Ca 0.61 -1.10 0.09 0.00 0.00 0.00 0.00 60.65 60.24 1jhk s ILE 205 Cb -0.27 -4.06 -0.06 0.00 0.01 0.00 0.00 42.46 38.08 1jhk s ILE 205 CO 0.34 -0.57 0.01 0.68 0.00 0.00 0.00 174.94 175.40 1jhk s VAL 206 N 1.62 2.52 -0.27 2.92 -7.23 -1.26 -1.06 120.40 117.63 1jhk s VAL 206 Ca 0.04 -1.98 -0.22 0.00 -1.81 0.00 0.00 61.98 58.00 1jhk s VAL 206 Cb -0.24 -2.80 0.07 0.00 0.56 0.00 0.00 36.38 33.97 1jhk s VAL 206 CO 0.06 -0.17 0.72 -0.75 -0.31 0.00 0.00 175.10 174.65 1jhk s LYS 207 N -3.72 0.79 0.36 4.82 2.47 -0.97 -4.99 119.74 118.50 1jhk s LYS 207 Ca 0.35 1.06 -0.06 0.00 -1.56 0.00 0.00 55.97 55.76 1jhk s LYS 207 Cb 0.01 0.32 0.02 0.00 -1.46 0.00 0.00 37.83 36.72 1jhk s LYS 207 CO 0.19 -0.11 0.56 -1.54 0.16 0.00 0.00 175.35 174.60 1jhk s SER 208 N 0.77 0.70 0.18 1.43 1.04 -1.26 -1.29 113.70 115.27 1jhk s SER 208 Ca -0.03 -1.40 -0.14 0.00 0.48 0.00 0.00 55.95 54.86 1jhk s SER 208 Cb -0.05 0.71 0.01 0.00 0.10 0.00 0.00 66.02 66.80 1jhk s SER 208 CO -0.06 -1.40 0.42 0.72 0.98 0.00 0.00 173.24 173.90 1jhk s PHE 209 N -2.86 0.09 -0.04 5.02 -0.12 -0.42 -4.99 117.98 114.66 1jhk s PHE 209 Ca 0.27 -0.44 0.03 0.00 -0.05 0.00 0.00 56.93 56.73 1jhk s PHE 209 Cb -0.02 0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.57 1jhk s PHE 209 CO 0.18 -0.82 -0.13 -0.80 -0.05 0.00 0.00 175.22 173.60 1jhk s ASN 210 N -2.91 1.72 0.19 1.98 0.01 -1.26 -0.93 114.94 113.74 1jhk s ASN 210 Ca 0.12 -0.28 -0.11 0.00 -0.71 0.00 0.00 52.86 51.88 1jhk s ASN 210 Cb 0.01 -0.55 0.18 0.00 0.41 0.00 0.00 41.25 41.30 1jhk s ASN 210 CO -0.02 0.09 1.80 0.03 -1.51 0.00 0.00 177.10 177.49 1jhk h ARG 211 N 6.47 0.56 -3.33 -0.60 3.08 -1.35 -3.07 114.38 116.15 1jhk h ARG 211 Ca -0.33 -0.03 -0.67 0.00 0.07 0.00 0.00 59.98 59.02 1jhk h ARG 211 Cb 1.18 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 31.11 1jhk h ARG 211 CO 0.48 0.37 3.57 -1.71 -1.07 0.00 0.00 179.97 181.62 1jhk n ASN 212 N -4.84 7.10 0.00 7.04 5.15 -1.26 -5.15 115.26 123.29 1jhk n ASN 212 Ca 0.06 -2.64 0.00 0.00 -0.60 0.00 0.00 54.58 51.40 1jhk n ASN 212 Cb 0.15 -1.56 0.00 0.00 -0.53 0.00 0.00 39.78 37.84 1jhk n ASN 212 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04