#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmk s THR 2 N 0.00 4.87 0.28 3.17 2.01 -1.25 -4.92 115.64 119.80 2jmk s THR 2 Ca 0.00 0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.88 2jmk s THR 2 Cb 0.00 -4.15 -0.09 0.00 0.01 0.00 0.00 72.50 68.26 2jmk s THR 2 CO 0.00 -0.51 1.09 -0.76 -0.69 0.00 0.00 174.62 173.74 2jmk s LEU 3 N 2.72 4.55 0.14 4.42 1.02 -1.26 -0.54 118.68 129.73 2jmk s LEU 3 Ca 0.22 2.24 -0.02 0.00 0.02 0.00 0.00 54.13 56.58 2jmk s LEU 3 Cb -0.14 -3.65 -0.03 0.00 0.02 0.00 0.00 46.19 42.39 2jmk s LEU 3 CO 0.18 -0.13 0.10 0.00 0.02 0.00 0.00 176.35 176.51 2jmk s ALA 5 N -4.04 1.61 -0.08 0.00 0.00 0.82 -0.49 121.76 119.59 2jmk s ALA 5 Ca 0.23 -0.99 -0.08 0.00 0.00 0.00 0.00 51.96 51.12 2jmk s ALA 5 Cb 0.07 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 2jmk s ALA 5 CO 0.02 0.35 0.21 -1.64 0.00 0.00 0.00 175.76 174.70 2jmk s MET 6 N -1.12 3.56 -0.23 0.00 -1.94 -0.41 -1.51 119.30 117.65 2jmk s MET 6 Ca 0.06 -0.01 -0.03 0.00 -1.71 0.00 0.00 55.69 54.00 2jmk s MET 6 Cb -0.08 -3.18 0.07 0.00 2.01 0.00 0.00 34.83 33.65 2jmk s MET 6 CO 0.02 0.75 0.06 -0.47 -0.01 0.00 0.00 175.02 175.37 2jmk s TYR 7 N -1.07 1.06 -0.65 -0.03 6.14 0.89 -1.12 117.35 122.56 2jmk s TYR 7 Ca 0.18 -1.04 -0.18 0.00 0.64 0.00 0.00 57.07 56.67 2jmk s TYR 7 Cb -0.13 -1.16 0.12 0.00 0.42 0.00 0.00 41.96 41.21 2jmk s TYR 7 CO 0.08 -0.70 0.76 1.21 0.64 0.00 0.00 175.55 177.53 2jmk s ASN 8 N 1.84 6.29 -0.19 4.32 2.47 0.86 -0.14 114.94 130.40 2jmk s ASN 8 Ca 0.03 -1.64 -0.08 0.00 0.42 0.00 0.00 52.86 51.59 2jmk s ASN 8 Cb -0.17 -2.30 -0.04 0.00 -1.45 0.00 0.00 41.25 37.29 2jmk s ASN 8 CO -0.16 -1.05 0.08 -0.51 -3.72 0.00 0.00 177.10 171.74 2jmk s ILE 9 N 2.42 4.89 -0.36 -5.21 2.07 -0.14 -0.06 121.20 124.81 2jmk s ILE 9 Ca 0.14 0.00 -0.00 0.00 -1.41 0.00 0.00 60.65 59.39 2jmk s ILE 9 Cb -0.21 -3.21 0.12 0.00 0.13 0.00 0.00 42.46 39.29 2jmk s ILE 9 CO 0.03 0.45 0.17 -0.55 -1.91 0.00 0.00 174.94 173.12 2jmk s SER 10 N 0.44 3.67 0.58 4.50 0.15 0.70 -0.11 113.70 123.63 2jmk s SER 10 Ca 0.04 -2.02 -0.20 0.00 0.70 0.00 0.00 55.95 54.47 2jmk s SER 10 Cb -0.12 -0.78 -0.04 0.00 -1.71 0.00 0.00 66.02 63.36 2jmk s SER 10 CO 0.00 -0.35 1.16 0.80 1.20 0.00 0.00 173.24 176.05 2jmk n MET 11 N 4.32 1.21 -1.68 5.44 1.56 -1.26 -0.42 117.12 126.29 2jmk n MET 11 Ca 0.04 0.46 -0.52 0.00 -0.27 0.00 0.00 57.70 57.40 2jmk n MET 11 Cb 0.39 -2.36 -0.06 0.00 2.15 0.00 0.00 33.22 33.34 2jmk n MET 11 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2jmk n ALA 12 N -1.49 0.32 -2.44 -5.12 0.00 -1.26 -2.08 120.51 108.43 2jmk n ALA 12 Ca 0.13 0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.88 2jmk n ALA 12 Cb 0.46 -2.34 0.03 0.00 0.00 0.00 0.00 19.45 17.60 2jmk n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jmk n GLY 13 N 4.06 0.20 3.81 0.00 0.00 -1.26 -4.86 105.19 107.13 2jmk n GLY 13 Ca 0.23 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 2jmk n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jmk s SER 14 N -3.42 0.01 0.43 1.61 0.01 -0.89 -5.12 113.70 106.33 2jmk s SER 14 Ca 0.00 -1.16 -0.02 0.00 1.31 0.00 0.00 55.95 56.08 2jmk s SER 14 Cb -0.00 0.85 -0.03 0.00 0.21 0.00 0.00 66.02 67.06 2jmk s SER 14 CO 0.22 -1.70 0.68 -1.00 0.41 0.00 0.00 173.24 171.85 2jmk s HIS 15 N -2.27 3.48 0.10 2.43 3.76 -1.26 -4.80 115.29 116.73 2jmk s HIS 15 Ca 0.16 0.54 -0.31 0.00 -0.15 0.00 0.00 55.06 55.29 2jmk s HIS 15 Cb -0.05 -2.15 -0.07 0.00 1.11 0.00 0.00 32.58 31.42 2jmk s HIS 15 CO 0.11 -0.14 1.37 -1.25 -0.85 0.00 0.00 174.74 173.99 2jmk s PRO 16 N -4.55 4.33 -0.23 8.40 0.04 -1.26 -4.52 135.00 137.20 2jmk s PRO 16 Ca 0.45 2.03 -0.05 0.00 0.04 0.00 0.00 61.00 63.47 2jmk s PRO 16 Cb -0.10 -3.30 -0.01 0.00 0.04 0.00 0.00 34.50 31.13 2jmk s PRO 16 CO 0.40 -0.44 -0.01 0.99 0.04 0.00 0.00 177.00 177.99 2jmk s THR 17 N 1.25 3.60 -0.51 1.26 2.01 0.84 -4.97 115.64 119.12 2jmk s THR 17 Ca 0.64 -0.47 -0.22 0.00 0.31 0.00 0.00 61.69 61.95 2jmk s THR 17 Cb -0.35 -2.68 0.04 0.00 0.01 0.00 0.00 72.50 69.52 2jmk s THR 17 CO 0.30 0.36 0.80 -0.89 -0.69 0.00 0.00 174.62 174.50 2jmk s THR 18 N 1.50 4.60 -0.20 -0.82 2.01 -1.26 -0.96 115.64 120.51 2jmk s THR 18 Ca 0.05 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.09 2jmk s THR 18 Cb -0.15 -4.41 -0.03 0.00 0.01 0.00 0.00 72.50 67.93 2jmk s THR 18 CO -0.01 -0.92 0.01 -0.63 -0.69 0.00 0.00 174.62 172.38 2jmk s ILE 19 N 3.38 4.12 -0.22 1.82 1.01 0.81 -4.96 121.20 127.16 2jmk s ILE 19 Ca 0.26 -0.26 -0.08 0.00 0.00 0.00 0.00 60.65 60.57 2jmk s ILE 19 Cb -0.14 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 2jmk s ILE 19 CO 0.18 0.43 0.08 0.00 0.00 0.00 0.00 174.94 175.63 2jmk s VAL 21 N 0.95 1.36 0.82 0.00 1.01 -0.57 -3.94 120.40 120.03 2jmk s VAL 21 Ca 0.04 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.18 2jmk s VAL 21 Cb -0.14 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2jmk s VAL 21 CO 0.03 0.39 0.59 1.33 0.00 0.00 0.00 175.10 177.44 2jmk n VAL 22 N 2.95 1.16 0.60 2.92 0.24 -1.26 -0.13 118.33 124.82 2jmk n VAL 22 Ca -0.17 -0.29 0.10 0.00 -2.04 0.00 0.00 64.34 61.95 2jmk n VAL 22 Cb 0.53 -0.77 0.43 0.00 -1.47 0.00 0.00 33.84 32.56 2jmk n VAL 22 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 2jmk n MET 23 N -1.50 0.07 0.04 7.34 1.56 0.18 -0.04 117.12 124.77 2jmk n MET 23 Ca 0.09 0.23 0.11 0.00 -0.27 0.00 0.00 57.70 57.86 2jmk n MET 23 Cb 0.51 -1.61 -0.03 0.00 2.15 0.00 0.00 33.22 34.24 2jmk n MET 23 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 2jmk n ASP 24 N -1.74 0.55 0.00 6.12 9.92 -1.26 -4.19 116.55 125.95 2jmk n ASP 24 Ca 0.04 -0.03 0.00 0.00 -0.53 0.00 0.00 54.79 54.27 2jmk n ASP 24 Cb 0.25 0.96 0.00 0.00 -0.64 0.00 0.00 41.12 41.69 2jmk n ASP 24 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2jmk n ARG 25 N -2.21 2.10 -0.26 -1.24 3.00 -0.99 -4.75 116.66 112.30 2jmk n ARG 25 Ca 0.00 -1.21 0.12 0.00 -0.00 0.00 0.00 57.85 56.75 2jmk n ARG 25 Cb 0.49 -0.89 0.38 0.00 0.00 0.00 0.00 32.46 32.44 2jmk n ARG 25 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2jmk h PHE 26 N 0.00 0.82 0.13 -0.14 -0.00 -0.62 -1.19 116.94 115.94 2jmk h PHE 26 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.99 2jmk h PHE 26 Cb 0.57 -0.26 0.00 0.00 -0.00 0.00 0.00 35.95 36.26 2jmk h PHE 26 CO 0.00 0.31 -0.06 1.25 -0.00 0.00 0.00 178.31 179.81 2jmk h LEU 27 N 0.70 -0.15 -0.75 2.10 5.85 -1.85 -1.89 115.31 119.31 2jmk h LEU 27 Ca 0.44 -0.31 0.12 0.00 0.84 0.00 0.00 57.88 58.97 2jmk h LEU 27 Cb 0.69 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.68 2jmk h LEU 27 CO -0.20 0.26 0.34 -0.08 -0.34 0.00 0.00 178.44 178.42 2jmk h GLU 28 N -0.59 0.52 -0.17 1.25 4.57 -1.74 0.96 114.58 119.37 2jmk h GLU 28 Ca -0.02 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2jmk h GLU 28 Cb 0.46 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2jmk h GLU 28 CO 0.03 0.34 0.06 0.66 -1.18 0.00 0.00 179.01 178.93 2jmk h SER 29 N 0.54 0.25 -0.73 1.04 4.64 -1.23 -1.50 113.55 116.55 2jmk h SER 29 Ca 0.39 -0.18 0.01 0.00 -0.47 0.00 0.00 61.79 61.54 2jmk h SER 29 Cb 0.52 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 62.51 2jmk h SER 29 CO -0.34 0.36 0.48 0.15 -0.87 0.00 0.00 176.83 176.62 2jmk h PHE 30 N 0.11 0.91 0.22 4.77 3.04 -0.49 -0.03 116.94 125.47 2jmk h PHE 30 Ca 0.06 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.02 2jmk h PHE 30 Cb 0.20 -0.31 0.00 0.00 2.56 0.00 0.00 35.95 38.41 2jmk h PHE 30 CO -0.01 0.57 -0.11 1.03 -2.02 0.00 0.00 178.31 177.77 2jmk h SER 31 N 0.98 -0.25 -0.53 0.41 0.87 -0.69 -1.46 113.55 112.88 2jmk h SER 31 Ca 0.27 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.79 2jmk h SER 31 Cb -0.09 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 2jmk h SER 31 CO -0.07 -0.11 0.33 -0.33 -0.53 0.00 0.00 176.83 176.12 2jmk h GLU 32 N -0.37 0.72 -0.43 2.24 4.39 -1.08 -2.42 114.58 117.62 2jmk h GLU 32 Ca -0.03 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 2jmk h GLU 32 Cb 0.28 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2jmk h GLU 32 CO 0.05 0.49 0.12 1.25 -1.16 0.00 0.00 179.01 179.76 2jmk h LEU 33 N 0.73 0.64 -2.51 1.33 7.12 -0.69 -1.36 115.31 120.57 2jmk h LEU 33 Ca 0.19 -0.22 0.01 0.00 0.13 0.00 0.00 57.88 58.00 2jmk h LEU 33 Cb -0.05 -0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 39.91 2jmk h LEU 33 CO -0.04 0.69 0.13 0.22 -0.13 0.00 0.00 178.44 179.31 2jmk h TYR 34 N 0.56 0.00 0.00 1.25 3.20 -0.76 0.15 116.97 121.37 2jmk h TYR 34 Ca 0.14 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2jmk h TYR 34 Cb 0.29 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2jmk h TYR 34 CO 0.02 0.00 -0.40 -0.44 -1.64 0.00 0.00 178.16 175.70 2jmk h ASP 35 N 0.00 0.00 -0.68 -2.11 5.19 -1.32 -3.38 116.42 114.13 2jmk h ASP 35 Ca 0.02 0.00 0.14 0.00 -0.62 0.00 0.00 57.03 56.58 2jmk h ASP 35 Cb 0.29 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.76 2jmk h ASP 35 CO -0.00 0.66 0.46 -0.29 -3.12 0.00 0.00 179.24 176.95 2jmk h ILE 36 N -0.93 0.79 -0.28 0.35 2.10 -1.09 0.88 117.51 119.33 2jmk h ILE 36 Ca 0.00 -0.10 0.08 0.00 1.08 0.00 0.00 64.86 65.92 2jmk h ILE 36 Cb 0.40 0.46 -0.01 0.00 -1.09 0.00 0.00 36.82 36.57 2jmk h ILE 36 CO 0.00 0.06 0.26 -0.29 -1.08 0.00 0.00 178.15 177.09 2jmk h ILE 37 N 0.31 0.58 0.00 2.19 6.09 -0.88 0.23 117.51 126.02 2jmk h ILE 37 Ca 0.33 0.00 -0.07 0.00 -1.37 0.00 0.00 64.86 63.75 2jmk h ILE 37 Cb 0.85 0.80 -0.01 0.00 0.47 0.00 0.00 36.82 38.94 2jmk h ILE 37 CO -0.08 0.00 -0.33 0.44 -3.07 0.00 0.00 178.15 175.10 2jmk h ASP 38 N 0.00 0.00 -2.35 2.19 5.19 -0.98 -3.45 116.42 117.02 2jmk h ASP 38 Ca 0.13 0.00 -0.45 0.00 -0.62 0.00 0.00 57.03 56.10 2jmk h ASP 38 Cb 0.65 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.18 2jmk h ASP 38 CO -0.00 0.33 -0.16 -0.70 -3.12 0.00 0.00 179.24 175.59 2jmk s GLU 39 N -3.60 2.97 -0.40 3.56 2.56 0.79 -5.04 118.70 119.55 2jmk s GLU 39 Ca 0.00 -0.74 0.05 0.00 0.00 0.00 0.00 54.97 54.29 2jmk s GLU 39 Cb 0.11 -2.63 0.44 0.00 2.00 0.00 0.00 34.13 34.05 2jmk s GLU 39 CO 0.67 -0.26 1.30 -1.71 -0.56 0.00 0.00 175.26 174.70 2jmk n ASN 40 N -1.99 5.28 -4.45 -1.70 2.85 -1.26 -4.97 115.26 109.02 2jmk n ASN 40 Ca 0.03 -3.75 -0.44 0.00 -0.11 0.00 0.00 54.58 50.31 2jmk n ASN 40 Cb 0.58 -0.47 -0.03 0.00 1.24 0.00 0.00 39.78 41.10 2jmk n ASN 40 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 2jmk s ASP 41 N -3.28 6.47 0.14 1.20 1.01 -1.26 -4.83 116.67 116.12 2jmk s ASP 41 Ca 0.52 -1.71 0.09 0.00 0.71 0.00 0.00 52.55 52.16 2jmk s ASP 41 Cb 0.42 -2.40 -0.15 0.00 1.01 0.00 0.00 42.92 41.80 2jmk s ASP 41 CO -0.05 -1.17 1.26 0.74 0.21 0.00 0.00 175.17 176.15 2jmk h THR 42 N 5.89 1.45 -0.16 -1.27 2.02 -1.99 -2.45 112.91 116.39 2jmk h THR 42 Ca 0.01 -3.09 -0.11 0.00 0.77 0.00 0.00 66.41 63.99 2jmk h THR 42 Cb 1.04 2.71 -0.01 0.00 -1.74 0.00 0.00 68.15 70.15 2jmk h THR 42 CO 1.13 0.82 -0.36 -0.78 0.37 0.00 0.00 175.52 176.71 2jmk h ASP 43 N 0.00 0.35 0.76 4.18 3.58 -2.04 -2.88 116.42 120.38 2jmk h ASP 43 Ca -0.03 -0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2jmk h ASP 43 Cb 1.70 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.66 2jmk h ASP 43 CO 0.11 0.69 -0.89 0.52 -2.88 0.00 0.00 179.24 176.79 2jmk n VAL 44 N -4.06 0.38 -0.08 2.25 0.31 -1.23 -4.22 118.33 111.67 2jmk n VAL 44 Ca -0.01 -0.36 -0.06 0.00 -0.01 0.00 0.00 64.34 63.90 2jmk n VAL 44 Cb 0.46 -0.10 -0.00 0.00 -0.91 0.00 0.00 33.84 33.29 2jmk n VAL 44 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 2jmk h MET 45 N 0.00 -0.05 -0.58 5.55 2.86 -1.20 -1.65 114.93 119.86 2jmk h MET 45 Ca 0.00 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.75 2jmk h MET 45 Cb 0.83 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.41 2jmk h MET 45 CO 0.00 -0.03 0.11 0.00 1.06 0.00 0.00 176.91 178.04 2jmk h MET 46 N -0.05 0.23 -0.91 1.72 -0.00 -1.73 0.16 114.93 114.34 2jmk h MET 46 Ca 0.16 -0.01 0.04 0.00 -0.00 0.00 0.00 59.70 59.89 2jmk h MET 46 Cb 0.29 -0.05 -0.05 0.00 -0.00 0.00 0.00 31.60 31.79 2jmk h MET 46 CO -0.35 0.15 0.60 0.22 -0.00 0.00 0.00 176.91 177.52 2jmk h ASP 47 N 0.23 0.97 0.20 -0.10 3.58 -1.56 0.47 116.42 120.23 2jmk h ASP 47 Ca 0.30 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.73 2jmk h ASP 47 Cb 0.45 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2jmk h ASP 47 CO -0.40 0.66 -0.10 0.15 -2.88 0.00 0.00 179.24 176.67 2jmk h PHE 48 N 1.12 -0.25 -0.97 0.28 3.57 -0.19 0.28 116.94 120.77 2jmk h PHE 48 Ca 0.37 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.87 2jmk h PHE 48 Cb 0.05 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.83 2jmk h PHE 48 CO -0.00 0.03 0.64 0.82 -2.23 0.00 0.00 178.31 177.57 2jmk h ILE 49 N -0.53 1.25 0.00 1.41 2.04 -0.90 0.20 117.51 120.99 2jmk h ILE 49 Ca -0.03 -0.46 -0.09 0.00 1.00 0.00 0.00 64.86 65.28 2jmk h ILE 49 Cb 0.40 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 2jmk h ILE 49 CO 0.05 0.24 -0.44 0.28 0.00 0.00 0.00 178.15 178.28 2jmk h SER 50 N 1.32 0.00 0.03 1.72 0.02 -0.84 0.28 113.55 116.08 2jmk h SER 50 Ca 0.36 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.25 2jmk h SER 50 Cb -0.15 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.39 2jmk h SER 50 CO -0.08 0.44 -0.25 0.03 -1.14 0.00 0.00 176.83 175.84 2jmk h ARG 51 N 0.00 0.12 0.00 3.45 3.08 0.47 -3.39 114.38 118.10 2jmk h ARG 51 Ca -0.00 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 2jmk h ARG 51 Cb 1.05 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.16 2jmk h ARG 51 CO 0.06 1.01 -0.00 0.74 -1.07 0.00 0.00 179.97 180.71 2jmk h PHE 52 N -0.70 0.00 -3.77 3.04 -1.00 -0.69 -3.46 116.94 110.36 2jmk h PHE 52 Ca -0.04 0.00 -0.49 0.00 2.81 0.00 0.00 57.97 60.25 2jmk h PHE 52 Cb 1.12 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.66 2jmk h PHE 52 CO 0.23 0.52 0.29 0.00 -1.61 0.00 0.00 178.31 177.73 2jmk s ALA 53 N -2.38 3.29 -0.73 2.45 0.00 0.97 -4.84 121.76 120.53 2jmk s ALA 53 Ca -0.10 0.46 -0.03 0.00 0.00 0.00 0.00 51.96 52.28 2jmk s ALA 53 Cb -0.02 -3.10 0.18 0.00 0.00 0.00 0.00 23.12 20.19 2jmk s ALA 53 CO 0.36 0.22 0.57 0.50 0.00 0.00 0.00 175.76 177.41 2jmk s ARG 54 N -1.81 2.87 -1.33 0.00 6.06 -1.26 -4.28 118.95 119.20 2jmk s ARG 54 Ca 0.46 -2.77 -0.11 0.00 -2.50 0.00 0.00 55.73 50.81 2jmk s ARG 54 Cb -0.20 -3.85 -0.06 0.00 0.06 0.00 0.00 34.95 30.90 2jmk s ARG 54 CO 0.25 -1.21 2.52 -2.37 -2.50 0.00 0.00 175.30 171.98 2jmk n THR 55 N 3.14 3.45 -3.89 4.11 5.66 -1.26 -4.84 114.28 120.65 2jmk n THR 55 Ca 0.13 -2.27 0.00 0.00 -3.05 0.00 0.00 64.05 58.86 2jmk n THR 55 Cb 0.38 -2.46 0.00 0.00 -1.55 0.00 0.00 70.33 66.70 2jmk n THR 55 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2jmk n ASP 56 N 4.54 1.93 -4.56 1.09 2.03 -1.26 -5.02 116.55 115.29 2jmk n ASP 56 Ca 0.62 -0.93 -0.23 0.00 0.52 0.00 0.00 54.79 54.77 2jmk n ASP 56 Cb 0.25 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.59 2jmk n ASP 56 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2jmk s GLU 57 N -1.77 2.27 0.03 -0.67 2.02 -1.26 -4.93 118.70 114.39 2jmk s GLU 57 Ca 0.00 -0.25 -0.10 0.00 0.02 0.00 0.00 54.97 54.63 2jmk s GLU 57 Cb 0.00 -5.02 -0.05 0.00 0.10 0.00 0.00 34.13 29.15 2jmk s GLU 57 CO 0.00 -3.80 0.36 -1.50 0.02 0.00 0.00 175.26 170.34 2jmk s ILE 58 N 11.56 5.15 0.44 -1.63 1.10 -1.26 -5.10 121.20 131.46 2jmk s ILE 58 Ca 0.75 0.49 -0.03 0.00 -0.51 0.00 0.00 60.65 61.35 2jmk s ILE 58 Cb -0.07 -3.63 -0.03 0.00 0.15 0.00 0.00 42.46 38.88 2jmk s ILE 58 CO 0.04 0.41 0.71 -0.04 -2.11 0.00 0.00 174.94 173.94 2jmk s MET 59 N -1.59 3.46 0.18 3.50 -1.94 -1.26 -4.98 119.30 116.67 2jmk s MET 59 Ca 0.28 -0.03 0.21 0.00 -1.71 0.00 0.00 55.69 54.44 2jmk s MET 59 Cb -0.14 -2.47 0.87 0.00 2.01 0.00 0.00 34.83 35.09 2jmk s MET 59 CO 0.15 -0.12 1.63 -0.35 -0.01 0.00 0.00 175.02 176.32 2jmk n PRO 60 N -2.11 0.14 0.18 2.03 -0.04 -1.26 -2.97 135.00 130.96 2jmk n PRO 60 Ca -0.01 0.38 0.18 0.00 -0.04 0.00 0.00 63.50 64.01 2jmk n PRO 60 Cb 0.56 -1.76 0.81 0.00 -0.04 0.00 0.00 33.50 33.06 2jmk n PRO 60 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2jmk h GLU 61 N 0.00 0.00 -6.75 0.54 3.07 -1.96 -3.43 114.58 106.05 2jmk h GLU 61 Ca 0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 2jmk h GLU 61 Cb 0.32 0.00 0.22 0.00 -0.84 0.00 0.00 28.75 28.45 2jmk h GLU 61 CO 0.00 0.00 -0.63 -0.25 -1.40 0.00 0.00 179.01 176.73 2jmk n ASP 62 N -3.80 -2.25 -4.29 1.42 9.92 -1.16 -3.12 116.55 113.27 2jmk n ASP 62 Ca 0.03 0.33 -0.16 0.00 -0.53 0.00 0.00 54.79 54.46 2jmk n ASP 62 Cb 0.39 -1.19 -0.10 0.00 -0.64 0.00 0.00 41.12 39.58 2jmk n ASP 62 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2jmk s LYS 63 N -3.56 1.28 -0.13 -1.24 1.02 0.30 -4.84 119.74 112.58 2jmk s LYS 63 Ca 0.56 -1.66 -0.02 0.00 0.02 0.00 0.00 55.97 54.87 2jmk s LYS 63 Cb -0.21 -0.35 -0.03 0.00 -0.52 0.00 0.00 37.83 36.72 2jmk s LYS 63 CO 0.68 -0.19 -0.06 0.99 -0.92 0.00 0.00 175.35 175.85 2jmk s THR 64 N -3.64 3.73 -0.16 2.17 2.01 -1.26 -0.55 115.64 117.94 2jmk s THR 64 Ca 0.30 -0.43 0.09 0.00 0.31 0.00 0.00 61.69 61.97 2jmk s THR 64 Cb 0.07 -2.60 -0.13 0.00 0.01 0.00 0.00 72.50 69.84 2jmk s THR 64 CO 0.09 0.52 0.27 1.33 -0.69 0.00 0.00 174.62 176.14 2jmk n VAL 65 N 3.26 0.00 0.00 3.82 0.24 0.36 -4.86 118.33 121.15 2jmk n VAL 65 Ca -0.18 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 61.88 2jmk n VAL 65 Cb 0.53 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 33.43 2jmk n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jmk n GLY 66 N 1.70 1.62 2.87 7.63 0.00 -1.26 -0.08 105.19 117.66 2jmk n GLY 66 Ca -0.01 -1.00 -0.17 0.00 0.00 0.00 0.00 46.02 44.84 2jmk n GLY 66 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jmk s PHE 67 N -2.00 0.38 -0.17 1.61 5.36 0.95 -1.29 117.98 122.82 2jmk s PHE 67 Ca 0.00 -0.05 -0.03 0.00 -0.96 0.00 0.00 56.93 55.90 2jmk s PHE 67 Cb 0.00 -0.38 -0.02 0.00 -0.34 0.00 0.00 43.02 42.29 2jmk s PHE 67 CO 0.00 -0.10 -0.07 0.08 -1.46 0.00 0.00 175.22 173.67 2jmk s VAL 68 N 0.64 3.43 -0.28 3.12 1.01 -0.28 -0.07 120.40 127.98 2jmk s VAL 68 Ca -0.07 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.32 2jmk s VAL 68 Cb -0.10 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 2jmk s VAL 68 CO -0.01 0.48 0.11 -0.69 0.00 0.00 0.00 175.10 174.99 2jmk s VAL 69 N 0.72 4.41 -0.23 2.92 1.01 0.85 -0.10 120.40 129.98 2jmk s VAL 69 Ca -0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 2jmk s VAL 69 Cb -0.15 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.13 2jmk s VAL 69 CO 0.02 0.20 -0.03 -0.69 0.00 0.00 0.00 175.10 174.61 2jmk s VAL 70 N 1.60 1.27 -0.35 2.92 1.01 0.91 -0.35 120.40 127.41 2jmk s VAL 70 Ca 0.05 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 61.01 2jmk s VAL 70 Cb -0.16 -1.60 0.10 0.00 0.00 0.00 0.00 36.38 34.72 2jmk s VAL 70 CO 0.05 -0.14 0.08 0.21 0.00 0.00 0.00 175.10 175.30 2jmk s ASN 71 N 1.51 4.58 0.32 3.32 3.84 -0.15 -0.22 114.94 128.14 2jmk s ASN 71 Ca -0.04 -2.14 0.14 0.00 0.21 0.00 0.00 52.86 51.03 2jmk s ASN 71 Cb -0.18 -1.48 0.51 0.00 -0.55 0.00 0.00 41.25 39.55 2jmk s ASN 71 CO -0.07 -0.37 1.68 0.00 -2.79 0.00 0.00 177.10 175.55 2jmk h ALA 72 N 7.60 1.03 0.11 1.71 0.00 -1.01 0.28 119.26 128.98 2jmk h ALA 72 Ca -0.06 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2jmk h ALA 72 Cb 1.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2jmk h ALA 72 CO 0.52 0.64 -0.06 0.22 0.00 0.00 0.00 179.25 180.57 2jmk h ASP 73 N 0.00 -0.13 1.12 0.00 3.58 -1.75 -3.23 116.42 116.02 2jmk h ASP 73 Ca -0.01 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 57.02 2jmk h ASP 73 Cb 0.98 0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2jmk h ASP 73 CO 0.07 0.41 -0.05 0.29 -2.88 0.00 0.00 179.24 177.08 2jmk n LYS 74 N -4.90 0.10 -3.08 0.28 5.02 -1.23 -4.90 118.16 109.44 2jmk n LYS 74 Ca -0.08 0.07 -0.13 0.00 -2.02 0.00 0.00 58.31 56.15 2jmk n LYS 74 Cb 0.27 -1.61 0.07 0.00 -0.02 0.00 0.00 35.03 33.75 2jmk n LYS 74 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jmk n LYS 75 N -1.77 -4.33 -3.75 1.97 5.02 0.81 -5.03 118.16 111.08 2jmk n LYS 75 Ca 0.06 0.69 -0.20 0.00 -2.02 0.00 0.00 58.31 56.84 2jmk n LYS 75 Cb 0.37 -5.15 -0.17 0.00 -0.02 0.00 0.00 35.03 30.06 2jmk n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jmk s LEU 76 N -5.34 0.52 -0.13 -0.35 1.43 -0.26 -4.25 118.68 110.30 2jmk s LEU 76 Ca 0.11 0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 2jmk s LEU 76 Cb -0.01 -0.24 0.02 0.00 0.03 0.00 0.00 46.19 45.99 2jmk s LEU 76 CO 0.59 -0.20 -0.14 -0.04 0.23 0.00 0.00 176.35 176.79 2jmk s MET 77 N 1.83 2.22 -0.21 1.70 -1.94 -0.25 -0.98 119.30 121.66 2jmk s MET 77 Ca 0.01 -0.54 -0.04 0.00 -1.71 0.00 0.00 55.69 53.41 2jmk s MET 77 Cb -0.12 -1.97 0.08 0.00 2.01 0.00 0.00 34.83 34.83 2jmk s MET 77 CO -0.03 -0.15 0.14 -1.12 -0.01 0.00 0.00 175.02 173.84 2jmk s SER 78 N 1.24 2.33 -0.05 3.03 0.01 0.53 -0.05 113.70 120.75 2jmk s SER 78 Ca -0.01 -0.67 -0.15 0.00 1.31 0.00 0.00 55.95 56.44 2jmk s SER 78 Cb -0.14 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 2jmk s SER 78 CO -0.06 -0.36 0.38 0.68 0.41 0.00 0.00 173.24 174.29 2jmk s VAL 79 N 2.18 5.12 -0.37 3.43 -7.23 -0.29 -0.11 120.40 123.14 2jmk s VAL 79 Ca 0.05 0.77 0.02 0.00 -1.81 0.00 0.00 61.98 61.01 2jmk s VAL 79 Cb -0.16 -3.70 0.11 0.00 0.56 0.00 0.00 36.38 33.20 2jmk s VAL 79 CO -0.16 0.52 0.13 -0.55 -0.31 0.00 0.00 175.10 174.72 2jmk s SER 80 N -0.60 4.22 -0.14 4.85 0.15 0.91 -0.80 113.70 122.29 2jmk s SER 80 Ca 0.22 -2.17 -0.06 0.00 0.70 0.00 0.00 55.95 54.64 2jmk s SER 80 Cb -0.16 -1.24 -0.04 0.00 -1.71 0.00 0.00 66.02 62.88 2jmk s SER 80 CO 0.11 -0.35 0.08 -0.36 1.20 0.00 0.00 173.24 173.91 2jmk s PHE 81 N 0.90 3.35 0.01 3.44 0.40 -1.26 -0.04 117.98 124.79 2jmk s PHE 81 Ca 0.13 0.26 0.00 0.00 -0.60 0.00 0.00 56.93 56.72 2jmk s PHE 81 Cb -0.20 -1.97 -0.01 0.00 0.51 0.00 0.00 43.02 41.34 2jmk s PHE 81 CO -0.11 0.42 -0.02 0.45 0.70 0.00 0.00 175.22 176.65 2jmk s SER 82 N -0.36 0.21 -1.13 1.36 0.15 0.88 -4.87 113.70 109.95 2jmk s SER 82 Ca 0.09 -0.28 -0.05 0.00 0.70 0.00 0.00 55.95 56.42 2jmk s SER 82 Cb -0.12 0.04 -0.03 0.00 -1.71 0.00 0.00 66.02 64.20 2jmk s SER 82 CO 0.02 -0.15 0.91 0.47 1.20 0.00 0.00 173.24 175.69 2jmk n ASP 83 N 2.27 -4.49 -4.30 5.45 9.92 -1.26 -4.55 116.55 119.60 2jmk n ASP 83 Ca -0.18 -0.72 -0.16 0.00 -0.53 0.00 0.00 54.79 53.19 2jmk n ASP 83 Cb 0.57 -4.89 -0.10 0.00 -0.64 0.00 0.00 41.12 36.06 2jmk n ASP 83 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 2jmk s ILE 84 N -3.42 1.46 0.75 0.53 -4.36 -1.26 -5.06 121.20 109.85 2jmk s ILE 84 Ca 0.27 -2.13 -0.15 0.00 -0.26 0.00 0.00 60.65 58.38 2jmk s ILE 84 Cb -0.04 -1.94 0.05 0.00 1.25 0.00 0.00 42.46 41.78 2jmk s ILE 84 CO 0.76 -0.66 1.24 -1.81 0.24 0.00 0.00 174.94 174.70 2jmk s ASP 85 N -3.23 3.92 0.22 4.36 1.11 -1.26 -4.93 116.67 116.88 2jmk s ASP 85 Ca 0.19 2.45 0.09 0.00 0.18 0.00 0.00 52.55 55.47 2jmk s ASP 85 Cb 0.01 -2.60 0.17 0.00 1.07 0.00 0.00 42.92 41.57 2jmk s ASP 85 CO 0.04 -2.45 1.50 1.05 1.18 0.00 0.00 175.17 176.49 2jmk h GLU 86 N -0.42 0.00 -0.01 8.23 4.11 -2.00 -3.06 114.58 121.41 2jmk h GLU 86 Ca -0.48 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.88 2jmk h GLU 86 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2jmk h GLU 86 CO 0.48 0.74 -0.26 -0.91 0.07 0.00 0.00 179.01 179.13 2jmk h ASN 87 N 0.00 0.26 -0.18 3.06 4.21 -2.03 -3.21 115.58 117.68 2jmk h ASN 87 Ca -0.01 -0.74 0.05 0.00 1.21 0.00 0.00 56.30 56.82 2jmk h ASN 87 Cb 1.31 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 38.43 2jmk h ASN 87 CO 0.10 0.96 0.16 -0.03 -1.29 0.00 0.00 177.43 177.32 2jmk h MET 88 N -0.43 0.00 -0.83 0.81 4.05 -1.95 -1.17 114.93 115.42 2jmk h MET 88 Ca -0.03 0.00 0.08 0.00 -0.28 0.00 0.00 59.70 59.47 2jmk h MET 88 Cb 0.99 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.73 2jmk h MET 88 CO 0.05 0.00 0.54 0.87 0.23 0.00 0.00 176.91 178.60 2jmk h LYS 89 N 0.00 0.83 0.51 0.39 1.57 -1.53 -1.11 116.57 117.23 2jmk h LYS 89 Ca 0.09 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2jmk h LYS 89 Cb 0.40 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2jmk h LYS 89 CO -0.00 0.55 -0.25 -0.22 -0.57 0.00 0.00 179.45 178.96 2jmk h LYS 90 N 0.86 -0.67 0.51 3.15 3.64 -1.34 0.22 116.57 122.94 2jmk h LYS 90 Ca 0.37 0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.77 2jmk h LYS 90 Cb 0.31 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2jmk h LYS 90 CO -0.14 -0.45 -0.31 0.28 -2.27 0.00 0.00 179.45 176.57 2jmk h VAL 91 N -0.70 0.37 -0.47 2.00 2.07 -1.56 -0.58 116.25 117.39 2jmk h VAL 91 Ca -0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 2jmk h VAL 91 Cb 0.54 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 2jmk h VAL 91 CO 0.11 0.00 0.08 0.40 0.02 0.00 0.00 177.57 178.18 2jmk h ILE 92 N -0.77 0.72 -0.85 4.57 2.04 -1.21 -0.69 117.51 121.32 2jmk h ILE 92 Ca -0.06 -0.07 0.05 0.00 1.00 0.00 0.00 64.86 65.77 2jmk h ILE 92 Cb 0.63 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 37.14 2jmk h ILE 92 CO 0.07 0.04 0.54 0.50 0.00 0.00 0.00 178.15 179.29 2jmk h LYS 93 N 0.21 0.98 -0.41 2.37 3.64 -0.38 -0.71 116.57 122.28 2jmk h LYS 93 Ca 0.24 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 2jmk h LYS 93 Cb 0.32 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2jmk h LYS 93 CO -0.32 0.65 0.18 0.00 -2.27 0.00 0.00 179.45 177.69 2jmk h ALA 94 N 1.37 0.53 -0.56 5.00 0.00 0.02 0.95 119.26 126.58 2jmk h ALA 94 Ca 0.35 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2jmk h ALA 94 Cb 0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2jmk h ALA 94 CO -0.14 0.12 0.25 1.15 0.00 0.00 0.00 179.25 180.63 2jmk h THR 95 N 0.52 1.21 -0.13 0.00 2.02 -0.64 0.52 112.91 116.41 2jmk h THR 95 Ca 0.14 -0.63 -0.12 0.00 0.77 0.00 0.00 66.41 66.57 2jmk h THR 95 Cb 0.16 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 2jmk h THR 95 CO -0.01 0.25 -0.44 0.00 0.37 0.00 0.00 175.52 175.69 2jmk h ALA 96 N 1.09 1.02 -0.01 6.16 0.00 -0.98 -2.96 119.26 123.57 2jmk h ALA 96 Ca 0.19 -0.44 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 2jmk h ALA 96 Cb 0.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2jmk h ALA 96 CO -0.02 0.62 -0.75 0.93 0.00 0.00 0.00 179.25 180.03 2jmk h GLU 97 N 0.25 0.12 0.00 0.00 5.08 -0.46 -3.06 114.58 116.50 2jmk h GLU 97 Ca 0.02 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2jmk h GLU 97 Cb 0.88 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2jmk h GLU 97 CO 0.07 0.81 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.63 2jmk h LYS 98 N 0.07 0.00 -0.11 2.33 1.63 -0.73 -1.48 116.57 118.29 2jmk h LYS 98 Ca -0.02 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.81 2jmk h LYS 98 Cb 1.32 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.94 2jmk h LYS 98 CO 0.11 0.04 0.20 0.74 -3.45 0.00 0.00 179.45 177.08 2jmk h PHE 99 N 0.00 0.00 -1.00 1.91 -1.00 -1.55 -1.45 116.94 113.84 2jmk h PHE 99 Ca -0.00 0.00 0.29 0.00 2.81 0.00 0.00 57.97 61.07 2jmk h PHE 99 Cb 0.08 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.60 2jmk h PHE 99 CO 0.00 0.00 0.73 0.87 -1.61 0.00 0.00 178.31 178.30 2jmk h LYS 100 N 0.00 0.00 -0.78 1.51 1.79 -1.39 0.33 116.57 118.03 2jmk h LYS 100 Ca 0.05 0.00 0.16 0.00 -2.18 0.00 0.00 60.65 58.68 2jmk h LYS 100 Cb 0.45 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.00 2jmk h LYS 100 CO -0.00 0.00 0.31 -0.91 -1.08 0.00 0.00 179.45 177.77 2jmk h ASN 101 N 0.00 0.27 0.00 0.86 2.35 -1.50 -2.72 115.58 114.85 2jmk h ASN 101 Ca 0.48 0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 56.30 2jmk h ASN 101 Cb 1.93 0.10 -0.09 0.00 0.05 0.00 0.00 38.32 40.32 2jmk h ASN 101 CO -0.01 0.08 -0.50 0.29 -1.65 0.00 0.00 177.43 175.64 2jmk n LYS 102 N -5.02 0.94 -3.26 0.81 5.02 0.07 -4.93 118.16 111.79 2jmk n LYS 102 Ca 0.16 -2.52 -0.11 0.00 -2.02 0.00 0.00 58.31 53.81 2jmk n LYS 102 Cb 0.46 -1.07 -0.05 0.00 -0.02 0.00 0.00 35.03 34.35 2jmk n LYS 102 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2jmk s GLY 103 N -2.57 -0.44 0.59 0.72 0.00 0.93 -4.98 107.32 101.56 2jmk s GLY 103 Ca 0.31 -0.66 0.30 0.00 0.00 0.00 0.00 44.72 44.66 2jmk s GLY 103 CO -0.06 3.07 2.24 0.27 0.00 0.00 0.00 173.10 178.63 2jmk h PHE 104 N 6.74 0.00 -3.46 1.90 -0.00 -1.84 -3.35 116.94 116.94 2jmk h PHE 104 Ca 0.07 0.00 -0.76 0.00 -0.00 0.00 0.00 57.97 57.28 2jmk h PHE 104 Cb 1.09 0.00 -0.27 0.00 -0.00 0.00 0.00 35.95 36.77 2jmk h PHE 104 CO 0.25 0.01 -0.14 0.21 -0.00 0.00 0.00 178.31 178.64 2jmk s LYS 105 N -4.58 3.10 0.03 6.09 2.47 -1.26 -5.04 119.74 120.56 2jmk s LYS 105 Ca -0.05 -2.10 0.03 0.00 -1.56 0.00 0.00 55.97 52.30 2jmk s LYS 105 Cb 0.15 -4.23 -0.02 0.00 -1.46 0.00 0.00 37.83 32.27 2jmk s LYS 105 CO 0.55 -1.28 -0.10 0.54 0.16 0.00 0.00 175.35 175.22 2jmk s VAL 106 N 0.83 0.75 -0.02 4.02 0.11 -1.26 -1.09 120.40 123.75 2jmk s VAL 106 Ca 0.11 -0.80 -0.17 0.00 -2.93 0.00 0.00 61.98 58.19 2jmk s VAL 106 Cb -0.21 -0.71 0.03 0.00 -1.53 0.00 0.00 36.38 33.97 2jmk s VAL 106 CO -0.03 -0.07 0.36 -1.61 -3.33 0.00 0.00 175.10 170.42 2jmk s GLU 107 N -0.96 0.72 -0.05 1.54 2.02 0.93 -4.97 118.70 117.93 2jmk s GLU 107 Ca -0.02 -0.13 -0.02 0.00 0.02 0.00 0.00 54.97 54.83 2jmk s GLU 107 Cb -0.07 0.32 0.04 0.00 0.10 0.00 0.00 34.13 34.52 2jmk s GLU 107 CO 0.01 -0.20 0.10 0.95 0.02 0.00 0.00 175.26 176.13 2jmk s THR 108 N -1.30 -0.09 0.27 3.63 -4.23 -1.26 -1.14 115.64 111.51 2jmk s THR 108 Ca -0.13 0.25 -0.30 0.00 -1.18 0.00 0.00 61.69 60.33 2jmk s THR 108 Cb -0.04 -0.18 -0.10 0.00 1.34 0.00 0.00 72.50 73.51 2jmk s THR 108 CO 0.05 0.10 1.40 -1.81 -0.54 0.00 0.00 174.62 173.82 2jmk s ASP 109 N 1.43 6.70 0.00 3.99 1.11 0.02 -4.98 116.67 124.94 2jmk s ASP 109 Ca -0.06 2.65 0.14 0.00 0.18 0.00 0.00 52.55 55.47 2jmk s ASP 109 Cb -0.12 -2.63 0.11 0.00 1.07 0.00 0.00 42.92 41.35 2jmk s ASP 109 CO -0.05 -0.65 0.95 0.23 1.18 0.00 0.00 175.17 176.84