#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 3.48 0.02 2.03 2.01 0.81 -5.04 115.64 118.96 2jmk s THR 2 Ca 0.00 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 61.55 2jmk s THR 2 Cb 0.00 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 70.01 2jmk s THR 2 CO 0.00 0.54 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.51 2jmk s LEU 3 N -0.04 2.50 -0.02 4.42 2.01 -1.26 -0.79 118.68 125.49 2jmk s LEU 3 Ca -0.01 -0.43 -0.09 0.00 0.01 0.00 0.00 54.13 53.62 2jmk s LEU 3 Cb -0.14 -1.47 0.01 0.00 0.01 0.00 0.00 46.19 44.61 2jmk s LEU 3 CO 0.03 0.28 0.18 0.00 1.01 0.00 0.00 176.35 177.85 2jmk s ALA 5 N -1.05 3.67 -0.45 0.00 0.00 0.89 -1.16 121.76 123.66 2jmk s ALA 5 Ca -0.11 -0.73 -0.19 0.00 0.00 0.00 0.00 51.96 50.92 2jmk s ALA 5 Cb -0.06 -1.76 0.03 0.00 0.00 0.00 0.00 23.12 21.34 2jmk s ALA 5 CO 0.02 0.63 0.57 -1.64 0.00 0.00 0.00 175.76 175.34 2jmk s MET 6 N -1.17 3.18 -0.47 0.00 -1.94 0.77 -1.37 119.30 118.31 2jmk s MET 6 Ca 0.17 -0.63 -0.17 0.00 -1.71 0.00 0.00 55.69 53.35 2jmk s MET 6 Cb -0.12 -3.99 0.06 0.00 2.01 0.00 0.00 34.83 32.78 2jmk s MET 6 CO 0.06 -1.01 0.45 -0.47 -0.01 0.00 0.00 175.02 174.04 2jmk s TYR 7 N 2.55 3.18 -0.47 -0.03 6.14 0.04 -1.14 117.35 127.63 2jmk s TYR 7 Ca 0.17 -0.72 -0.19 0.00 0.64 0.00 0.00 57.07 56.98 2jmk s TYR 7 Cb -0.16 -3.17 0.04 0.00 0.42 0.00 0.00 41.96 39.09 2jmk s TYR 7 CO 0.15 -0.83 0.58 -0.80 0.64 0.00 0.00 175.55 175.30 2jmk s ASN 8 N 2.43 6.24 -0.14 4.32 -0.87 -0.08 -0.11 114.94 126.73 2jmk s ASN 8 Ca 0.08 -0.74 -0.01 0.00 -1.57 0.00 0.00 52.86 50.63 2jmk s ASN 8 Cb -0.21 -2.28 -0.01 0.00 -0.02 0.00 0.00 41.25 38.72 2jmk s ASN 8 CO 0.09 -0.79 -0.12 -0.51 -2.57 0.00 0.00 177.10 173.20 2jmk s ILE 9 N 2.55 3.08 -0.37 0.60 2.07 -0.46 -0.26 121.20 128.41 2jmk s ILE 9 Ca 0.16 -0.64 0.00 0.00 -1.41 0.00 0.00 60.65 58.76 2jmk s ILE 9 Cb -0.18 -2.31 0.12 0.00 0.13 0.00 0.00 42.46 40.23 2jmk s ILE 9 CO 0.14 0.52 0.18 -0.94 -1.91 0.00 0.00 174.94 172.93 2jmk s SER 10 N 0.45 3.54 0.74 4.50 1.04 0.82 -0.11 113.70 124.68 2jmk s SER 10 Ca -0.09 -2.13 -0.16 0.00 0.48 0.00 0.00 55.95 54.05 2jmk s SER 10 Cb -0.16 -0.75 -0.01 0.00 0.10 0.00 0.00 66.02 65.21 2jmk s SER 10 CO 0.05 -0.33 0.70 0.80 0.98 0.00 0.00 173.24 175.44 2jmk n MET 11 N 4.17 0.32 -1.47 4.02 1.56 -1.26 -0.66 117.12 123.80 2jmk n MET 11 Ca 0.06 0.16 -0.48 0.00 -0.27 0.00 0.00 57.70 57.16 2jmk n MET 11 Cb 0.38 -1.99 -0.07 0.00 2.15 0.00 0.00 33.22 33.68 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 -2.56 1.05 -1.89 -5.12 0.00 -1.26 -1.26 120.51 109.45 2jmk n ALA 12 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2jmk n ALA 12 Cb 0.50 -2.61 0.00 0.00 0.00 0.00 0.00 19.45 17.34 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 6.46 0.71 3.32 0.00 0.00 -1.26 -4.88 105.19 109.53 2jmk n GLY 13 Ca 0.42 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 2jmk n GLY 13 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jmk s SER 14 N -2.76 -0.29 0.84 1.61 0.15 -0.39 -5.13 113.70 107.72 2jmk s SER 14 Ca 0.00 0.06 -0.11 0.00 0.70 0.00 0.00 55.95 56.60 2jmk s SER 14 Cb 0.00 0.41 0.10 0.00 -1.71 0.00 0.00 66.02 64.82 2jmk s SER 14 CO 0.00 -0.62 1.11 -1.00 1.20 0.00 0.00 173.24 173.92 2jmk s HIS 15 N -2.20 2.21 -0.06 3.44 3.76 -1.26 -4.50 115.29 116.68 2jmk s HIS 15 Ca -0.07 1.59 -0.30 0.00 -0.15 0.00 0.00 55.06 56.13 2jmk s HIS 15 Cb -0.01 -3.15 -0.05 0.00 1.11 0.00 0.00 32.58 30.47 2jmk s HIS 15 CO -0.00 -2.25 1.50 -1.25 -0.85 0.00 0.00 174.74 171.89 2jmk s PRO 16 N -4.81 4.22 -0.36 8.40 0.04 -1.26 -4.56 135.00 136.66 2jmk s PRO 16 Ca 0.63 2.02 -0.13 0.00 0.04 0.00 0.00 61.00 63.56 2jmk s PRO 16 Cb -0.19 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.55 2jmk s PRO 16 CO 0.57 -0.73 0.24 0.99 0.04 0.00 0.00 177.00 178.11 2jmk s THR 17 N 3.39 5.08 -0.55 1.26 2.01 0.85 -4.93 115.64 122.74 2jmk s THR 17 Ca 0.67 -0.48 -0.27 0.00 0.31 0.00 0.00 61.69 61.92 2jmk s THR 17 Cb -0.30 -3.71 0.03 0.00 0.01 0.00 0.00 72.50 68.53 2jmk s THR 17 CO 0.25 -0.13 1.10 -0.89 -0.69 0.00 0.00 174.62 174.26 2jmk s THR 18 N 1.67 4.18 -0.38 -0.82 2.01 -1.26 -1.36 115.64 119.67 2jmk s THR 18 Ca 0.05 0.74 -0.09 0.00 0.31 0.00 0.00 61.69 62.70 2jmk s THR 18 Cb -0.18 -4.64 0.05 0.00 0.01 0.00 0.00 72.50 67.74 2jmk s THR 18 CO 0.09 -1.21 0.20 -0.63 -0.69 0.00 0.00 174.62 172.39 2jmk s ILE 19 N 4.53 4.26 -0.12 1.82 1.01 0.85 -4.96 121.20 128.59 2jmk s ILE 19 Ca 0.39 -1.12 -0.29 0.00 0.00 0.00 0.00 60.65 59.63 2jmk s ILE 19 Cb -0.09 -3.47 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 2jmk s ILE 19 CO 0.24 -0.32 0.97 0.00 0.00 0.00 0.00 174.94 175.84 2jmk s VAL 21 N 2.05 1.75 0.69 0.00 1.01 -0.47 -3.92 120.40 121.51 2jmk s VAL 21 Ca 0.46 -1.63 -0.15 0.00 0.00 0.00 0.00 61.98 60.67 2jmk s VAL 21 Cb -0.18 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.59 2jmk s VAL 21 CO 0.17 -0.11 1.16 -0.69 0.00 0.00 0.00 175.10 175.63 2jmk s VAL 22 N -1.34 2.79 0.27 2.92 1.01 -1.26 -0.07 120.40 124.71 2jmk s VAL 22 Ca 0.08 0.38 0.35 0.00 0.00 0.00 0.00 61.98 62.80 2jmk s VAL 22 Cb -0.09 -2.92 0.36 0.00 0.00 0.00 0.00 36.38 33.72 2jmk s VAL 22 CO 0.05 -0.21 2.07 -0.03 0.00 0.00 0.00 175.10 176.98 2jmk h MET 23 N -0.07 0.00 -0.17 2.72 4.05 -0.86 0.27 114.93 120.87 2jmk h MET 23 Ca -0.47 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 2jmk h MET 23 Cb 1.27 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.07 2jmk h MET 23 CO 0.52 0.00 0.00 -3.47 0.23 0.00 0.00 176.91 174.19 2jmk n ASP 24 N -2.76 2.38 -0.00 1.39 2.03 -1.26 -4.45 116.55 113.88 2jmk n ASP 24 Ca -0.02 -1.71 0.00 0.00 0.52 0.00 0.00 54.79 53.58 2jmk n ASP 24 Cb 0.09 -0.11 -0.00 0.00 -0.72 0.00 0.00 41.12 40.38 2jmk n ASP 24 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2jmk n ARG 25 N 0.55 5.38 -0.31 -0.67 3.00 0.10 -4.69 116.66 120.02 2jmk n ARG 25 Ca 0.09 -0.00 0.18 0.00 -0.00 0.00 0.00 57.85 58.12 2jmk n ARG 25 Cb 0.34 -0.62 0.43 0.00 0.00 0.00 0.00 32.46 32.62 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 0.80 0.26 -0.14 -0.00 -0.80 -1.08 116.94 115.99 2jmk h PHE 26 Ca 0.00 0.03 -0.01 0.00 -0.00 0.00 0.00 57.97 57.98 2jmk h PHE 26 Cb 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 35.95 35.71 2jmk h PHE 26 CO 0.00 0.15 -0.13 1.25 -0.00 0.00 0.00 178.31 179.58 2jmk h LEU 27 N 0.55 -0.30 -0.80 2.10 6.46 -1.85 -1.67 115.31 119.79 2jmk h LEU 27 Ca 0.56 -0.17 0.13 0.00 -0.12 0.00 0.00 57.88 58.27 2jmk h LEU 27 Cb 1.18 0.08 -0.09 0.00 -0.73 0.00 0.00 40.66 41.10 2jmk h LEU 27 CO -0.31 0.02 0.40 -0.08 -0.62 0.00 0.00 178.44 177.85 2jmk h GLU 28 N -0.64 0.58 -0.03 1.25 4.57 -1.58 0.19 114.58 118.94 2jmk h GLU 28 Ca -0.04 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2jmk h GLU 28 Cb 0.45 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2jmk h GLU 28 CO 0.06 0.39 0.01 0.77 -1.18 0.00 0.00 179.01 179.06 2jmk h SER 29 N 0.60 0.04 -0.71 1.04 0.02 -1.18 -1.50 113.55 111.85 2jmk h SER 29 Ca 0.42 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2jmk h SER 29 Cb 0.56 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 2jmk h SER 29 CO -0.34 0.17 0.43 0.15 -1.14 0.00 0.00 176.83 176.10 2jmk h PHE 30 N -0.10 0.94 0.03 3.45 3.04 -0.50 0.59 116.94 124.39 2jmk h PHE 30 Ca 0.01 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.96 2jmk h PHE 30 Cb 0.15 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.34 2jmk h PHE 30 CO -0.03 0.64 -0.04 1.03 -2.02 0.00 0.00 178.31 177.89 2jmk h SER 31 N 0.97 -0.11 0.31 0.41 0.87 -0.50 -1.36 113.55 114.14 2jmk h SER 31 Ca 0.26 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.76 2jmk h SER 31 Cb -0.03 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2jmk h SER 31 CO -0.05 -0.06 -0.32 -0.08 -0.53 0.00 0.00 176.83 175.78 2jmk h GLU 32 N -0.09 0.02 -0.28 2.24 4.57 -1.07 -2.96 114.58 117.01 2jmk h GLU 32 Ca 0.01 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2jmk h GLU 32 Cb 0.09 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 2jmk h GLU 32 CO -0.02 0.34 0.06 1.25 -1.18 0.00 0.00 179.01 179.46 2jmk h LEU 33 N 0.02 0.44 -2.61 1.64 7.12 -0.32 -1.19 115.31 120.40 2jmk h LEU 33 Ca -0.00 -0.25 0.01 0.00 0.13 0.00 0.00 57.88 57.77 2jmk h LEU 33 Cb 0.58 -0.12 -0.00 0.00 -0.53 0.00 0.00 40.66 40.60 2jmk h LEU 33 CO 0.04 0.57 0.10 0.22 -0.13 0.00 0.00 178.44 179.25 2jmk h TYR 34 N 0.29 0.00 0.00 1.25 3.20 -1.09 0.25 116.97 120.86 2jmk h TYR 34 Ca 0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2jmk h TYR 34 Cb 0.31 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.58 2jmk h TYR 34 CO 0.02 0.00 -0.33 -0.44 -1.64 0.00 0.00 178.16 175.77 2jmk h ASP 35 N 0.00 0.00 -0.96 -2.11 3.32 -1.43 -3.36 116.42 111.88 2jmk h ASP 35 Ca 0.01 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.15 2jmk h ASP 35 Cb 0.22 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.70 2jmk h ASP 35 CO -0.00 0.59 0.62 -0.29 -1.72 0.00 0.00 179.24 178.44 2jmk h ILE 36 N -0.86 1.01 -0.74 0.35 2.10 -1.07 -0.53 117.51 117.77 2jmk h ILE 36 Ca 0.00 -0.35 0.21 0.00 1.08 0.00 0.00 64.86 65.80 2jmk h ILE 36 Cb 0.33 -0.11 -0.03 0.00 -1.09 0.00 0.00 36.82 35.92 2jmk h ILE 36 CO 0.00 0.19 0.53 -0.29 -1.08 0.00 0.00 178.15 177.50 2jmk h ILE 37 N 1.03 0.63 -0.22 2.19 6.09 -0.71 0.23 117.51 126.75 2jmk h ILE 37 Ca 0.43 0.00 0.06 0.00 -1.37 0.00 0.00 64.86 63.99 2jmk h ILE 37 Cb 0.31 0.63 -0.01 0.00 0.47 0.00 0.00 36.82 38.22 2jmk h ILE 37 CO -0.19 0.00 0.24 -0.78 -3.07 0.00 0.00 178.15 174.35 2jmk h ASP 38 N 0.00 0.00 -4.57 2.19 3.58 -1.23 -3.42 116.42 112.97 2jmk h ASP 38 Ca 0.35 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.58 2jmk h ASP 38 Cb 1.41 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.45 2jmk h ASP 38 CO -0.00 0.00 -0.09 -0.62 -2.88 0.00 0.00 179.24 175.65 2jmk n GLU 39 N -3.84 1.09 -0.58 0.28 -0.58 0.82 -5.06 120.64 112.76 2jmk n GLU 39 Ca 0.03 -1.31 0.06 0.00 -0.42 0.00 0.00 57.16 55.52 2jmk n GLU 39 Cb 0.37 0.08 0.14 0.00 -0.57 0.00 0.00 31.44 31.46 2jmk n GLU 39 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2jmk n ASN 40 N -2.15 1.60 -4.56 1.62 6.94 -1.26 -5.02 115.26 112.43 2jmk n ASN 40 Ca 0.01 -3.17 -0.38 0.00 -0.02 0.00 0.00 54.58 51.01 2jmk n ASN 40 Cb 0.24 -0.43 -0.03 0.00 -2.36 0.00 0.00 39.78 37.20 2jmk n ASN 40 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2jmk s ASP 41 N -2.71 5.02 0.07 0.53 1.01 -1.26 -4.79 116.67 114.54 2jmk s ASP 41 Ca 0.32 0.90 0.11 0.00 0.71 0.00 0.00 52.55 54.59 2jmk s ASP 41 Cb 0.31 -2.52 -0.18 0.00 1.01 0.00 0.00 42.92 41.54 2jmk s ASP 41 CO -0.05 -2.46 1.01 0.74 0.21 0.00 0.00 175.17 174.62 2jmk h THR 42 N 7.23 1.16 0.00 -1.27 2.02 -2.00 -3.15 112.91 116.89 2jmk h THR 42 Ca -0.28 -2.86 -0.06 0.00 0.77 0.00 0.00 66.41 63.98 2jmk h THR 42 Cb 1.21 2.55 -0.01 0.00 -1.74 0.00 0.00 68.15 70.16 2jmk h THR 42 CO 1.15 0.66 -0.30 -0.78 0.37 0.00 0.00 175.52 176.62 2jmk h ASP 43 N 0.00 0.00 1.14 4.18 3.58 -2.04 -2.87 116.42 120.41 2jmk h ASP 43 Ca -0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.32 2jmk h ASP 43 Cb 1.80 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.85 2jmk h ASP 43 CO 0.09 0.30 -0.80 0.58 -2.88 0.00 0.00 179.24 176.53 2jmk h VAL 44 N 0.00 0.00 -0.22 2.25 2.07 -1.96 -3.37 116.25 115.02 2jmk h VAL 44 Ca -0.00 -0.94 0.06 0.00 0.82 0.00 0.00 66.70 66.64 2jmk h VAL 44 Cb 0.82 1.53 -0.06 0.00 -1.52 0.00 0.00 31.29 32.05 2jmk h VAL 44 CO 0.04 0.00 -0.17 0.24 0.02 0.00 0.00 177.57 177.69 2jmk h MET 45 N 0.00 -0.17 -0.54 1.57 2.86 -1.46 -0.74 114.93 116.45 2jmk h MET 45 Ca 0.00 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.75 2jmk h MET 45 Cb 0.97 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.58 2jmk h MET 45 CO 0.00 -0.11 0.06 0.00 1.06 0.00 0.00 176.91 177.92 2jmk h MET 46 N -0.17 0.18 -0.80 1.72 -0.00 -1.72 0.10 114.93 114.23 2jmk h MET 46 Ca 0.13 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.82 2jmk h MET 46 Cb 0.37 -0.04 -0.04 0.00 -0.00 0.00 0.00 31.60 31.89 2jmk h MET 46 CO -0.33 0.12 0.51 -0.44 -0.00 0.00 0.00 176.91 176.77 2jmk h ASP 47 N 0.18 0.94 0.25 -0.10 5.19 -1.56 -1.07 116.42 120.25 2jmk h ASP 47 Ca 0.28 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.64 2jmk h ASP 47 Cb 0.42 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.69 2jmk h ASP 47 CO -0.41 0.69 -0.12 0.15 -3.12 0.00 0.00 179.24 176.44 2jmk h PHE 48 N 1.10 -0.31 -0.74 4.55 3.57 0.41 0.26 116.94 125.78 2jmk h PHE 48 Ca 0.29 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.88 2jmk h PHE 48 Cb -0.10 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 38.68 2jmk h PHE 48 CO 0.00 0.03 0.39 0.82 -2.23 0.00 0.00 178.31 177.31 2jmk h ILE 49 N -0.69 0.87 0.00 1.41 2.04 -0.72 -0.58 117.51 119.85 2jmk h ILE 49 Ca -0.03 -0.23 -0.13 0.00 1.00 0.00 0.00 64.86 65.47 2jmk h ILE 49 Cb 0.48 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2jmk h ILE 49 CO 0.06 0.12 -0.62 -1.28 0.00 0.00 0.00 178.15 176.43 2jmk h SER 50 N 0.66 0.00 -0.13 1.72 0.87 -1.19 0.27 113.55 115.75 2jmk h SER 50 Ca 0.36 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.90 2jmk h SER 50 Cb 0.35 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.31 2jmk h SER 50 CO -0.26 0.62 0.01 -0.09 -0.53 0.00 0.00 176.83 176.58 2jmk h ARG 51 N 0.00 0.22 0.00 2.24 9.65 0.99 -3.37 114.38 124.11 2jmk h ARG 51 Ca -0.01 -0.07 -0.07 0.00 -1.10 0.00 0.00 59.98 58.74 2jmk h ARG 51 Cb 1.20 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.75 2jmk h ARG 51 CO 0.08 0.44 -0.57 0.74 2.80 0.00 0.00 179.97 183.46 2jmk h PHE 52 N -0.03 0.00 -3.95 2.20 0.04 -1.23 -3.47 116.94 110.50 2jmk h PHE 52 Ca 0.04 0.00 -0.47 0.00 2.80 0.00 0.00 57.97 60.34 2jmk h PHE 52 Cb 0.34 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.49 2jmk h PHE 52 CO 0.03 0.53 0.38 0.00 -0.60 0.00 0.00 178.31 178.65 2jmk s ALA 53 N -2.54 3.13 -0.14 2.45 0.00 0.94 -4.88 121.76 120.72 2jmk s ALA 53 Ca -0.16 0.60 -0.18 0.00 0.00 0.00 0.00 51.96 52.21 2jmk s ALA 53 Cb 0.02 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 2jmk s ALA 53 CO 0.33 -0.03 0.49 0.50 0.00 0.00 0.00 175.76 177.05 2jmk s ARG 54 N -2.43 4.30 -1.17 0.00 3.52 -1.26 -4.21 118.95 117.71 2jmk s ARG 54 Ca 0.56 0.44 -0.17 0.00 -0.13 0.00 0.00 55.73 56.43 2jmk s ARG 54 Cb -0.19 -3.47 -0.05 0.00 -1.56 0.00 0.00 34.95 29.68 2jmk s ARG 54 CO 0.24 0.08 2.14 0.25 -0.81 0.00 0.00 175.30 177.21 2jmk n THR 55 N 3.90 2.81 -3.57 4.11 -2.24 -1.26 -4.80 114.28 113.23 2jmk n THR 55 Ca -0.06 -2.36 -0.14 0.00 -2.27 0.00 0.00 64.05 59.22 2jmk n THR 55 Cb 0.51 -2.48 -0.06 0.00 -2.10 0.00 0.00 70.33 66.21 2jmk n THR 55 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2jmk s ASP 56 N 3.86 -0.56 -0.48 3.42 1.01 -1.26 -5.04 116.67 117.62 2jmk s ASP 56 Ca 0.52 0.75 -0.01 0.00 0.71 0.00 0.00 52.55 54.52 2jmk s ASP 56 Cb 0.14 0.65 0.31 0.00 1.01 0.00 0.00 42.92 45.04 2jmk s ASP 56 CO -0.00 -0.42 2.04 1.21 0.21 0.00 0.00 175.17 178.21 2jmk n GLU 57 N 1.28 2.20 -3.20 8.23 4.07 -1.26 -4.91 120.64 127.06 2jmk n GLU 57 Ca -0.15 -2.33 -0.42 0.00 -0.06 0.00 0.00 57.16 54.20 2jmk n GLU 57 Cb 0.57 -1.92 -0.07 0.00 -0.06 0.00 0.00 31.44 29.96 2jmk n GLU 57 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 2jmk s ILE 58 N -3.40 4.96 -0.44 6.31 1.01 -1.26 -4.95 121.20 123.43 2jmk s ILE 58 Ca 0.46 0.26 0.07 0.00 0.00 0.00 0.00 60.65 61.44 2jmk s ILE 58 Cb 0.36 -4.04 0.24 0.00 0.01 0.00 0.00 42.46 39.02 2jmk s ILE 58 CO -0.02 -0.34 0.67 1.15 0.00 0.00 0.00 174.94 176.40 2jmk n MET 59 N 5.90 0.69 -0.08 2.79 0.00 -1.26 -4.95 117.12 120.21 2jmk n MET 59 Ca -0.04 -2.55 -0.11 0.00 0.00 0.00 0.00 57.70 55.00 2jmk n MET 59 Cb 0.48 -1.36 0.02 0.00 0.00 0.00 0.00 33.22 32.36 2jmk n MET 59 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 2jmk h PRO 60 N 4.17 0.82 0.00 3.17 0.13 -2.01 -3.35 132.00 134.93 2jmk h PRO 60 Ca -0.00 -0.43 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 2jmk h PRO 60 Cb 0.96 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 31.87 2jmk h PRO 60 CO 0.38 1.06 -0.81 0.39 -0.23 0.00 0.00 178.00 178.78 2jmk n GLU 61 N -4.04 0.03 -3.11 0.86 1.02 -1.26 -5.07 120.64 109.07 2jmk n GLU 61 Ca -0.02 -1.63 -0.40 0.00 -0.02 0.00 0.00 57.16 55.09 2jmk n GLU 61 Cb 0.54 -0.23 -0.06 0.00 -0.02 0.00 0.00 31.44 31.67 2jmk n GLU 61 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2jmk s ASP 62 N -1.63 6.67 0.15 1.62 1.11 -1.25 -0.13 116.67 123.21 2jmk s ASP 62 Ca 0.21 0.81 0.07 0.00 0.18 0.00 0.00 52.55 53.82 2jmk s ASP 62 Cb 0.24 -2.35 -0.04 0.00 1.07 0.00 0.00 42.92 41.84 2jmk s ASP 62 CO -0.10 -0.30 -0.16 -0.75 1.18 0.00 0.00 175.17 175.04 2jmk s LYS 63 N 2.04 1.18 0.00 8.23 2.20 0.03 -4.97 119.74 128.45 2jmk s LYS 63 Ca 0.28 -1.37 -0.30 0.00 -0.36 0.00 0.00 55.97 54.23 2jmk s LYS 63 Cb -0.16 -1.12 -0.06 0.00 -1.51 0.00 0.00 37.83 34.98 2jmk s LYS 63 CO 0.10 0.22 1.48 0.99 -0.36 0.00 0.00 175.35 177.78 2jmk s THR 64 N -2.23 3.57 -0.02 3.43 2.01 -1.26 -1.20 115.64 119.94 2jmk s THR 64 Ca 0.14 0.93 0.03 0.00 0.31 0.00 0.00 61.69 63.10 2jmk s THR 64 Cb -0.05 -3.60 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 2jmk s THR 64 CO 0.05 -0.02 0.08 0.55 -0.69 0.00 0.00 174.62 174.59 2jmk n VAL 65 N 4.81 0.00 -3.66 3.82 3.14 -0.31 -4.87 118.33 121.26 2jmk n VAL 65 Ca 0.14 -0.11 -0.05 0.00 -2.96 0.00 0.00 64.34 61.36 2jmk n VAL 65 Cb 0.43 0.48 -0.02 0.00 -1.06 0.00 0.00 33.84 33.67 2jmk n VAL 65 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 2jmk s GLY 66 N -2.28 -0.32 -0.06 7.55 0.00 -1.25 -0.09 107.32 110.86 2jmk s GLY 66 Ca -0.01 0.47 -0.11 0.00 0.00 0.00 0.00 44.72 45.07 2jmk s GLY 66 CO 0.14 0.13 0.27 -0.11 0.00 0.00 0.00 173.10 173.52 2jmk s PHE 67 N -3.17 -0.22 -0.12 1.90 -0.12 0.30 -0.16 117.98 116.38 2jmk s PHE 67 Ca 0.10 0.49 -0.01 0.00 -0.05 0.00 0.00 56.93 57.46 2jmk s PHE 67 Cb -0.01 0.08 0.03 0.00 -0.63 0.00 0.00 43.02 42.49 2jmk s PHE 67 CO -0.02 -0.24 -0.05 0.08 -0.05 0.00 0.00 175.22 174.95 2jmk s VAL 68 N -0.48 0.87 -0.34 -2.49 1.01 -0.29 -1.12 120.40 117.56 2jmk s VAL 68 Ca -0.06 -0.30 -0.20 0.00 0.00 0.00 0.00 61.98 61.42 2jmk s VAL 68 Cb -0.04 -0.99 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 2jmk s VAL 68 CO 0.02 0.25 0.60 -0.69 0.00 0.00 0.00 175.10 175.27 2jmk s VAL 69 N 1.76 4.94 -0.21 2.92 1.01 0.80 -0.91 120.40 130.71 2jmk s VAL 69 Ca 0.04 0.59 -0.01 0.00 0.00 0.00 0.00 61.98 62.60 2jmk s VAL 69 Cb -0.13 -4.02 0.06 0.00 0.00 0.00 0.00 36.38 32.28 2jmk s VAL 69 CO -0.07 -0.24 -0.01 -0.69 0.00 0.00 0.00 175.10 174.08 2jmk s VAL 70 N 2.60 1.04 -0.25 2.92 1.01 0.64 -0.08 120.40 128.28 2jmk s VAL 70 Ca 0.23 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 2jmk s VAL 70 Cb -0.15 -1.41 0.08 0.00 0.00 0.00 0.00 36.38 34.90 2jmk s VAL 70 CO 0.14 -0.14 0.05 0.20 0.00 0.00 0.00 175.10 175.35 2jmk s ASN 71 N 1.62 3.56 0.46 3.32 -0.87 -0.13 -0.13 114.94 122.77 2jmk s ASN 71 Ca -0.03 -1.25 0.25 0.00 -1.57 0.00 0.00 52.86 50.26 2jmk s ASN 71 Cb -0.18 -0.80 1.00 0.00 -0.02 0.00 0.00 41.25 41.25 2jmk s ASN 71 CO -0.07 -0.35 1.86 0.00 -2.57 0.00 0.00 177.10 175.97 2jmk h ALA 72 N 8.13 1.04 0.23 0.60 0.00 -1.14 0.31 119.26 128.43 2jmk h ALA 72 Ca -0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2jmk h ALA 72 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2jmk h ALA 72 CO 0.41 0.25 -0.11 0.38 0.00 0.00 0.00 179.25 180.18 2jmk h ASP 73 N 0.00 -0.26 -0.49 0.00 2.03 -1.76 -3.15 116.42 112.80 2jmk h ASP 73 Ca -0.00 -0.16 0.00 0.00 -0.73 0.00 0.00 57.03 56.14 2jmk h ASP 73 Cb 0.69 0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.26 2jmk h ASP 73 CO 0.03 0.01 0.00 0.29 -1.03 0.00 0.00 179.24 178.54 2jmk n LYS 74 N -5.12 2.50 -3.74 4.15 4.01 -1.21 -4.94 118.16 113.81 2jmk n LYS 74 Ca -0.09 -2.29 -0.25 0.00 -0.51 0.00 0.00 58.31 55.17 2jmk n LYS 74 Cb 0.22 -1.52 0.02 0.00 -0.51 0.00 0.00 35.03 33.24 2jmk n LYS 74 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2jmk n LYS 75 N 1.44 -3.36 -4.38 1.97 4.01 0.86 -4.97 118.16 113.73 2jmk n LYS 75 Ca 0.21 0.53 -0.34 0.00 -0.51 0.00 0.00 58.31 58.20 2jmk n LYS 75 Cb 0.58 -4.76 -0.14 0.00 -0.51 0.00 0.00 35.03 30.20 2jmk n LYS 75 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2jmk s LEU 76 N -6.63 2.71 -0.11 -0.35 1.43 0.10 -4.11 118.68 111.72 2jmk s LEU 76 Ca 0.15 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2jmk s LEU 76 Cb -0.05 -1.64 0.02 0.00 0.03 0.00 0.00 46.19 44.55 2jmk s LEU 76 CO 0.84 0.08 -0.11 -0.04 0.23 0.00 0.00 176.35 177.35 2jmk s MET 77 N 0.87 1.85 0.00 1.70 -1.94 0.58 -0.95 119.30 121.41 2jmk s MET 77 Ca -0.03 -0.40 -0.02 0.00 -1.71 0.00 0.00 55.69 53.53 2jmk s MET 77 Cb -0.15 -1.72 -0.01 0.00 2.01 0.00 0.00 34.83 34.97 2jmk s MET 77 CO 0.00 -0.17 0.04 -1.12 -0.01 0.00 0.00 175.02 173.76 2jmk s SER 78 N 1.34 0.08 -0.07 3.03 0.01 0.89 -0.77 113.70 118.21 2jmk s SER 78 Ca -0.01 -0.21 -0.03 0.00 1.31 0.00 0.00 55.95 57.02 2jmk s SER 78 Cb -0.14 0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.26 2jmk s SER 78 CO -0.05 -0.21 0.15 -0.69 0.41 0.00 0.00 173.24 172.85 2jmk s VAL 79 N -0.87 -0.08 -0.18 3.43 1.01 0.82 -0.14 120.40 124.39 2jmk s VAL 79 Ca -0.10 0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.05 2jmk s VAL 79 Cb -0.06 -0.25 0.09 0.00 0.00 0.00 0.00 36.38 36.16 2jmk s VAL 79 CO -0.00 0.08 0.23 -0.55 0.00 0.00 0.00 175.10 174.86 2jmk s SER 80 N 1.33 1.11 0.21 3.32 0.15 -0.28 -0.11 113.70 119.42 2jmk s SER 80 Ca -0.08 -0.03 0.10 0.00 0.70 0.00 0.00 55.95 56.64 2jmk s SER 80 Cb -0.12 0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 64.61 2jmk s SER 80 CO -0.06 -0.30 -0.11 -0.36 1.20 0.00 0.00 173.24 173.60 2jmk s PHE 81 N 2.35 2.56 -0.21 3.44 0.08 -1.26 -0.54 117.98 124.40 2jmk s PHE 81 Ca 0.06 -0.25 -0.03 0.00 0.12 0.00 0.00 56.93 56.83 2jmk s PHE 81 Cb -0.15 -1.22 -0.01 0.00 -0.57 0.00 0.00 43.02 41.07 2jmk s PHE 81 CO -0.11 0.55 -0.06 0.45 -0.10 0.00 0.00 175.22 175.95 2jmk s SER 82 N -3.02 4.23 -0.38 1.36 0.15 0.87 -4.78 113.70 112.12 2jmk s SER 82 Ca 0.26 -0.39 -0.12 0.00 0.70 0.00 0.00 55.95 56.40 2jmk s SER 82 Cb -0.08 -1.72 0.02 0.00 -1.71 0.00 0.00 66.02 62.53 2jmk s SER 82 CO 0.15 0.01 0.51 -0.67 1.20 0.00 0.00 173.24 174.44 2jmk n ASP 83 N 4.62 -6.97 -4.24 5.45 2.03 -1.26 -4.90 116.55 111.28 2jmk n ASP 83 Ca -0.18 0.40 -0.22 0.00 0.52 0.00 0.00 54.79 55.30 2jmk n ASP 83 Cb 0.51 -4.67 -0.13 0.00 -0.72 0.00 0.00 41.12 36.11 2jmk n ASP 83 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2jmk s ILE 84 N -2.41 1.50 0.82 5.18 -4.36 -1.26 -5.13 121.20 115.55 2jmk s ILE 84 Ca 0.19 -1.37 -0.15 0.00 -0.26 0.00 0.00 60.65 59.06 2jmk s ILE 84 Cb -0.05 -1.37 -0.00 0.00 1.25 0.00 0.00 42.46 42.29 2jmk s ILE 84 CO 0.64 -0.04 0.50 0.47 0.24 0.00 0.00 174.94 176.75 2jmk n ASP 85 N 1.35 -1.47 0.10 4.36 9.92 -1.26 -4.89 116.55 124.65 2jmk n ASP 85 Ca -0.19 0.48 -0.05 0.00 -0.53 0.00 0.00 54.79 54.50 2jmk n ASP 85 Cb 0.54 -1.23 -0.02 0.00 -0.64 0.00 0.00 41.12 39.77 2jmk n ASP 85 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2jmk h GLU 86 N -0.89 -0.33 -0.55 -1.24 5.08 -2.00 -2.90 114.58 111.76 2jmk h GLU 86 Ca -0.45 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.01 2jmk h GLU 86 Cb 1.32 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.61 2jmk h GLU 86 CO 0.39 -0.22 0.37 -0.97 -1.00 0.00 0.00 179.01 177.58 2jmk h ASN 87 N -1.08 0.37 -0.34 1.42 -0.73 -2.02 -0.76 115.58 112.45 2jmk h ASN 87 Ca -0.03 0.00 -0.07 0.00 1.87 0.00 0.00 56.30 58.07 2jmk h ASN 87 Cb 0.26 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.75 2jmk h ASN 87 CO 0.06 0.24 -0.02 -0.03 -0.37 0.00 0.00 177.43 177.30 2jmk h MET 88 N 0.42 0.72 -0.82 6.67 4.05 -1.94 -2.68 114.93 121.35 2jmk h MET 88 Ca 0.25 -0.19 0.08 0.00 -0.28 0.00 0.00 59.70 59.55 2jmk h MET 88 Cb 0.42 -0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.08 2jmk h MET 88 CO -0.07 0.75 0.53 -0.22 0.23 0.00 0.00 176.91 178.13 2jmk h LYS 89 N 0.67 0.82 0.51 0.39 3.64 -0.91 -1.35 116.57 120.34 2jmk h LYS 89 Ca 0.13 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 2jmk h LYS 89 Cb 0.45 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2jmk h LYS 89 CO 0.02 0.54 -0.25 0.87 -2.27 0.00 0.00 179.45 178.36 2jmk h LYS 90 N 0.84 -0.67 0.44 1.90 6.56 -1.46 0.25 116.57 124.43 2jmk h LYS 90 Ca 0.36 0.05 -0.01 0.00 -1.06 0.00 0.00 60.65 59.99 2jmk h LYS 90 Cb 0.31 0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 32.11 2jmk h LYS 90 CO -0.14 -0.44 -0.32 0.28 -2.06 0.00 0.00 179.45 176.78 2jmk h VAL 91 N -0.70 0.34 -0.40 0.50 2.07 -1.48 -0.37 116.25 116.22 2jmk h VAL 91 Ca -0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.52 2jmk h VAL 91 Cb 0.53 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 2jmk h VAL 91 CO 0.12 0.00 0.05 0.40 0.02 0.00 0.00 177.57 178.15 2jmk h ILE 92 N -0.75 0.75 -1.00 4.57 2.04 -1.26 -1.16 117.51 120.71 2jmk h ILE 92 Ca -0.04 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 65.83 2jmk h ILE 92 Cb 0.63 0.58 -0.07 0.00 -0.74 0.00 0.00 36.82 37.22 2jmk h ILE 92 CO 0.02 0.03 0.65 0.50 0.00 0.00 0.00 178.15 179.34 2jmk h LYS 93 N 0.16 1.13 0.00 2.37 3.64 -0.32 -0.60 116.57 122.97 2jmk h LYS 93 Ca 0.19 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2jmk h LYS 93 Cb 0.25 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2jmk h LYS 93 CO -0.28 0.75 -0.00 0.00 -2.27 0.00 0.00 179.45 177.65 2jmk h ALA 94 N 1.46 -0.00 -0.64 5.00 0.00 0.04 0.15 119.26 125.27 2jmk h ALA 94 Ca 0.43 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 2jmk h ALA 94 Cb 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2jmk h ALA 94 CO -0.17 -0.42 0.37 1.15 0.00 0.00 0.00 179.25 180.17 2jmk h THR 95 N -0.16 1.18 -0.01 0.00 2.02 -0.80 -0.19 112.91 114.95 2jmk h THR 95 Ca -0.00 -0.43 -0.17 0.00 0.77 0.00 0.00 66.41 66.58 2jmk h THR 95 Cb 0.16 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 2jmk h THR 95 CO 0.00 0.20 -0.77 0.00 0.37 0.00 0.00 175.52 175.32 2jmk h ALA 96 N 1.53 0.69 -0.05 6.16 0.00 -0.91 -3.20 119.26 123.48 2jmk h ALA 96 Ca 0.23 -0.67 -0.19 0.00 0.00 0.00 0.00 54.91 54.29 2jmk h ALA 96 Cb -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2jmk h ALA 96 CO -0.04 0.88 -0.76 1.49 0.00 0.00 0.00 179.25 180.82 2jmk h GLU 97 N 0.08 0.34 -0.36 0.00 4.81 0.01 -3.08 114.58 116.38 2jmk h GLU 97 Ca -0.02 -0.29 0.10 0.00 -0.13 0.00 0.00 59.36 59.02 2jmk h GLU 97 Cb 1.35 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.78 2jmk h GLU 97 CO 0.11 0.95 0.35 0.87 -0.73 0.00 0.00 179.01 180.56 2jmk h LYS 98 N 0.22 0.00 -0.12 1.92 1.79 -1.05 0.90 116.57 120.24 2jmk h LYS 98 Ca -0.03 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.47 2jmk h LYS 98 Cb 1.34 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.99 2jmk h LYS 98 CO 0.13 0.00 0.20 0.74 -1.08 0.00 0.00 179.45 179.43 2jmk h PHE 99 N 0.00 0.00 -1.03 -1.35 -1.00 -1.65 -1.52 116.94 110.39 2jmk h PHE 99 Ca 0.17 0.00 0.29 0.00 2.81 0.00 0.00 57.97 61.24 2jmk h PHE 99 Cb 0.86 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.37 2jmk h PHE 99 CO 0.00 0.00 0.73 1.57 -1.61 0.00 0.00 178.31 179.00 2jmk h LYS 100 N 0.00 0.09 -0.98 1.51 2.10 -0.84 0.34 116.57 118.79 2jmk h LYS 100 Ca 0.06 -0.01 0.16 0.00 -2.00 0.00 0.00 60.65 58.86 2jmk h LYS 100 Cb 0.45 -0.02 -0.09 0.00 -0.90 0.00 0.00 32.23 31.67 2jmk h LYS 100 CO -0.00 0.06 0.61 -0.91 -2.00 0.00 0.00 179.45 177.21 2jmk h ASN 101 N 0.09 0.78 0.00 7.07 2.35 -1.50 -2.50 115.58 121.87 2jmk h ASN 101 Ca 0.51 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 56.29 2jmk h ASN 101 Cb 1.85 -0.08 -0.09 0.00 0.05 0.00 0.00 38.32 40.05 2jmk h ASN 101 CO -0.07 0.35 -0.50 2.29 -1.65 0.00 0.00 177.43 177.86 2jmk n LYS 102 N -4.65 0.95 0.00 0.81 2.85 0.59 -4.92 118.16 113.78 2jmk n LYS 102 Ca 0.20 -2.52 0.00 0.00 -1.05 0.00 0.00 58.31 54.94 2jmk n LYS 102 Cb 0.49 -1.08 0.00 0.00 -0.65 0.00 0.00 35.03 33.79 2jmk n LYS 102 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2jmk n GLY 103 N -0.69 -2.03 0.46 2.58 0.00 0.86 -4.95 105.19 101.43 2jmk n GLY 103 Ca 0.13 1.05 0.27 0.00 0.00 0.00 0.00 46.02 47.47 2jmk n GLY 103 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2jmk h PHE 104 N 0.00 0.09 -0.58 1.61 0.04 -1.78 -3.25 116.94 113.07 2jmk h PHE 104 Ca 0.00 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.50 2jmk h PHE 104 Cb 0.00 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.08 2jmk h PHE 104 CO 0.00 0.02 0.77 0.21 -0.60 0.00 0.00 178.31 178.71 2jmk s LYS 105 N -5.05 2.41 -0.08 1.51 2.36 -1.26 -4.88 119.74 114.75 2jmk s LYS 105 Ca -0.06 -0.55 0.01 0.00 -2.55 0.00 0.00 55.97 52.82 2jmk s LYS 105 Cb 0.22 -5.10 0.02 0.00 -1.05 0.00 0.00 37.83 31.91 2jmk s LYS 105 CO 0.78 -3.75 -0.10 0.08 1.55 0.00 0.00 175.35 173.91 2jmk s VAL 106 N 11.01 1.05 -0.19 4.02 1.01 -1.25 -0.31 120.40 135.74 2jmk s VAL 106 Ca 0.71 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 2jmk s VAL 106 Cb -0.05 -1.01 0.06 0.00 0.00 0.00 0.00 36.38 35.38 2jmk s VAL 106 CO 0.05 0.35 0.05 -0.70 0.00 0.00 0.00 175.10 174.85 2jmk s GLU 107 N 1.12 0.52 -0.09 2.72 2.56 0.05 -5.00 118.70 120.58 2jmk s GLU 107 Ca -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 54.97 54.56 2jmk s GLU 107 Cb -0.14 -2.05 -0.03 0.00 2.00 0.00 0.00 34.13 33.91 2jmk s GLU 107 CO -0.02 -0.65 -0.08 0.95 -0.56 0.00 0.00 175.26 174.90 2jmk s THR 108 N 1.92 3.54 0.37 -1.70 -4.23 -1.26 -0.13 115.64 114.15 2jmk s THR 108 Ca -0.00 -0.52 -0.28 0.00 -1.18 0.00 0.00 61.69 59.70 2jmk s THR 108 Cb -0.17 -2.46 -0.11 0.00 1.34 0.00 0.00 72.50 71.10 2jmk s THR 108 CO -0.08 0.57 1.48 -0.67 -0.54 0.00 0.00 174.62 175.38 2jmk n ASP 109 N 2.62 3.71 -0.42 3.99 -0.08 0.84 -4.96 116.55 122.25 2jmk n ASP 109 Ca -0.18 1.22 0.05 0.00 -1.51 0.00 0.00 54.79 54.38 2jmk n ASP 109 Cb 0.53 -1.61 0.04 0.00 2.34 0.00 0.00 41.12 42.42 2jmk n ASP 109 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12