#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 4.60 -0.34 2.03 2.01 -1.26 -4.93 115.64 117.75 2jmk s THR 2 Ca 0.00 1.30 -0.06 0.00 0.31 0.00 0.00 61.69 63.25 2jmk s THR 2 Cb 0.00 -3.92 0.05 0.00 0.01 0.00 0.00 72.50 68.64 2jmk s THR 2 CO 0.00 0.38 0.11 -0.76 -0.69 0.00 0.00 174.62 173.66 2jmk s LEU 3 N -1.55 4.39 -0.08 4.42 1.43 -1.25 -0.50 118.68 125.53 2jmk s LEU 3 Ca 0.37 -1.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.25 2jmk s LEU 3 Cb -0.19 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 2jmk s LEU 3 CO 0.21 -0.35 -0.15 0.00 0.23 0.00 0.00 176.35 176.30 2jmk s ALA 5 N -0.26 3.46 -0.22 0.00 0.00 0.37 -0.09 121.76 125.02 2jmk s ALA 5 Ca 0.01 -0.96 -0.06 0.00 0.00 0.00 0.00 51.96 50.96 2jmk s ALA 5 Cb -0.13 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 2jmk s ALA 5 CO 0.03 0.70 0.02 -1.64 0.00 0.00 0.00 175.76 174.87 2jmk s MET 6 N -1.93 3.59 -0.31 0.00 -1.94 -0.46 -1.04 119.30 117.20 2jmk s MET 6 Ca 0.24 -0.52 0.01 0.00 -1.71 0.00 0.00 55.69 53.71 2jmk s MET 6 Cb -0.12 -3.17 0.07 0.00 2.01 0.00 0.00 34.83 33.63 2jmk s MET 6 CO 0.16 -0.11 -0.01 -0.47 -0.01 0.00 0.00 175.02 174.59 2jmk s TYR 7 N 1.33 3.43 -0.53 -0.03 6.14 0.07 -1.06 117.35 126.69 2jmk s TYR 7 Ca 0.04 -2.39 -0.18 0.00 0.64 0.00 0.00 57.07 55.18 2jmk s TYR 7 Cb -0.15 -2.38 0.08 0.00 0.42 0.00 0.00 41.96 39.94 2jmk s TYR 7 CO 0.01 -0.89 0.61 1.21 0.64 0.00 0.00 175.55 177.13 2jmk s ASN 8 N 1.18 6.19 -0.16 4.32 3.84 -0.30 -0.11 114.94 129.91 2jmk s ASN 8 Ca -0.01 -1.24 -0.02 0.00 0.21 0.00 0.00 52.86 51.80 2jmk s ASN 8 Cb -0.20 -2.27 -0.02 0.00 -0.55 0.00 0.00 41.25 38.21 2jmk s ASN 8 CO -0.05 -0.93 -0.08 -0.51 -2.79 0.00 0.00 177.10 172.75 2jmk s ILE 9 N 2.40 3.45 -0.07 -5.21 2.07 -0.38 -0.10 121.20 123.36 2jmk s ILE 9 Ca 0.11 -0.51 -0.00 0.00 -1.41 0.00 0.00 60.65 58.84 2jmk s ILE 9 Cb -0.23 -2.50 0.03 0.00 0.13 0.00 0.00 42.46 39.89 2jmk s ILE 9 CO 0.08 0.49 -0.03 -0.94 -1.91 0.00 0.00 174.94 172.64 2jmk s SER 10 N 0.56 1.49 0.27 4.50 1.04 0.18 -0.09 113.70 121.64 2jmk s SER 10 Ca -0.05 -0.13 -0.21 0.00 0.48 0.00 0.00 55.95 56.03 2jmk s SER 10 Cb -0.15 -0.51 -0.09 0.00 0.10 0.00 0.00 66.02 65.37 2jmk s SER 10 CO 0.03 -0.14 0.80 -0.32 0.98 0.00 0.00 173.24 174.59 2jmk s MET 11 N 1.59 4.33 -0.34 4.02 1.75 -1.26 -0.67 119.30 128.72 2jmk s MET 11 Ca -0.00 1.00 -0.35 0.00 -1.25 0.00 0.00 55.69 55.10 2jmk s MET 11 Cb -0.13 -2.80 -0.11 0.00 2.84 0.00 0.00 34.83 34.63 2jmk s MET 11 CO -0.04 0.33 2.20 0.00 -0.65 0.00 0.00 175.02 176.86 2jmk n ALA 12 N 0.55 1.13 -0.80 4.11 0.00 -1.26 -0.86 120.51 123.38 2jmk n ALA 12 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2jmk n ALA 12 Cb 0.51 -2.58 0.00 0.00 0.00 0.00 0.00 19.45 17.38 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 6.49 1.29 3.37 0.00 0.00 -1.26 -4.89 105.19 110.19 2jmk n GLY 13 Ca 0.41 -0.32 -0.15 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.38 -0.41 0.90 1.61 0.15 -0.04 -5.16 113.70 108.37 2jmk s SER 14 Ca 0.00 0.33 -0.10 0.00 0.70 0.00 0.00 55.95 56.88 2jmk s SER 14 Cb 0.00 0.43 0.14 0.00 -1.71 0.00 0.00 66.02 64.88 2jmk s SER 14 CO 0.00 -0.57 1.13 -1.00 1.20 0.00 0.00 173.24 174.00 2jmk s HIS 15 N -1.53 1.80 0.30 3.44 0.09 -1.26 -4.34 115.29 113.79 2jmk s HIS 15 Ca -0.11 1.71 -0.29 0.00 -0.00 0.00 0.00 55.06 56.37 2jmk s HIS 15 Cb -0.02 -3.27 -0.10 0.00 -0.00 0.00 0.00 32.58 29.19 2jmk s HIS 15 CO 0.05 -2.67 1.23 -1.25 -0.00 0.00 0.00 174.74 172.10 2jmk s PRO 16 N -4.69 4.46 -0.27 8.40 0.04 -1.26 -4.50 135.00 137.17 2jmk s PRO 16 Ca 0.66 2.06 -0.04 0.00 0.04 0.00 0.00 61.00 63.72 2jmk s PRO 16 Cb -0.22 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.22 2jmk s PRO 16 CO 0.58 -0.05 0.00 0.99 0.04 0.00 0.00 177.00 178.56 2jmk s THR 17 N -1.04 3.33 -0.53 1.26 2.01 0.87 -4.97 115.64 116.56 2jmk s THR 17 Ca 0.48 -0.92 -0.25 0.00 0.31 0.00 0.00 61.69 61.31 2jmk s THR 17 Cb -0.37 -2.72 0.04 0.00 0.01 0.00 0.00 72.50 69.46 2jmk s THR 17 CO 0.47 0.12 0.98 -0.89 -0.69 0.00 0.00 174.62 174.61 2jmk s THR 18 N 1.39 4.35 -0.39 -0.82 2.01 -1.26 -1.25 115.64 119.67 2jmk s THR 18 Ca 0.01 0.48 -0.07 0.00 0.31 0.00 0.00 61.69 62.41 2jmk s THR 18 Cb -0.17 -4.54 0.07 0.00 0.01 0.00 0.00 72.50 67.86 2jmk s THR 18 CO -0.01 -1.09 0.19 -0.63 -0.69 0.00 0.00 174.62 172.40 2jmk s ILE 19 N 4.06 3.93 -0.32 1.82 1.01 0.85 -4.97 121.20 127.58 2jmk s ILE 19 Ca 0.34 -1.39 -0.23 0.00 0.00 0.00 0.00 60.65 59.36 2jmk s ILE 19 Cb -0.11 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2jmk s ILE 19 CO 0.22 -0.41 0.77 0.00 0.00 0.00 0.00 174.94 175.52 2jmk s VAL 21 N 2.96 0.81 0.65 0.00 1.01 -0.21 -4.30 120.40 121.32 2jmk s VAL 21 Ca 0.31 -0.27 -0.17 0.00 0.00 0.00 0.00 61.98 61.85 2jmk s VAL 21 Cb -0.14 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.40 2jmk s VAL 21 CO 0.14 0.29 0.69 1.33 0.00 0.00 0.00 175.10 177.54 2jmk n VAL 22 N 4.07 2.56 0.16 2.92 0.24 -1.26 -0.48 118.33 126.55 2jmk n VAL 22 Ca -0.22 -0.45 0.18 0.00 -2.04 0.00 0.00 64.34 61.80 2jmk n VAL 22 Cb 0.51 -0.86 0.79 0.00 -1.47 0.00 0.00 33.84 32.80 2jmk n VAL 22 CO 0.00 0.00 0.00 -0.03 -2.14 0.00 0.00 176.83 174.66 2jmk h MET 23 N 0.03 0.00 0.00 7.34 4.05 -1.53 0.33 114.93 125.15 2jmk h MET 23 Ca -0.47 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 58.89 2jmk h MET 23 Cb 1.37 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.16 2jmk h MET 23 CO 0.46 0.00 -0.29 -0.44 0.23 0.00 0.00 176.91 176.87 2jmk h ASP 24 N 0.00 0.00 -0.15 1.39 3.32 -1.88 -2.98 116.42 116.12 2jmk h ASP 24 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2jmk h ASP 24 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2jmk h ASP 24 CO -0.00 0.29 0.00 0.54 -1.72 0.00 0.00 179.24 178.35 2jmk n ARG 25 N -3.56 2.77 0.24 3.56 3.00 0.83 -4.71 116.66 118.79 2jmk n ARG 25 Ca -0.01 -1.71 -0.14 0.00 -0.01 0.00 0.00 57.85 55.99 2jmk n ARG 25 Cb 0.43 -1.12 -0.08 0.00 0.00 0.00 0.00 32.46 31.69 2jmk n ARG 25 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 2jmk h PHE 26 N 0.94 -0.58 -0.35 -1.55 3.57 -0.44 -0.72 116.94 117.81 2jmk h PHE 26 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.53 2jmk h PHE 26 Cb 0.59 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.48 2jmk h PHE 26 CO 0.10 -0.26 0.10 1.25 -2.23 0.00 0.00 178.31 177.28 2jmk h LEU 27 N -0.94 0.09 -0.27 0.59 5.85 -1.84 -1.43 115.31 117.36 2jmk h LEU 27 Ca -0.06 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.72 2jmk h LEU 27 Cb 0.59 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2jmk h LEU 27 CO 0.11 0.09 0.11 -0.08 -0.34 0.00 0.00 178.44 178.32 2jmk h GLU 28 N 0.24 0.24 -0.31 1.25 4.57 -1.85 -0.84 114.58 117.89 2jmk h GLU 28 Ca 0.16 -0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.38 2jmk h GLU 28 Cb 0.16 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.65 2jmk h GLU 28 CO -0.19 0.16 0.01 1.03 -1.18 0.00 0.00 179.01 178.84 2jmk h SER 29 N 0.25 -0.10 -0.74 1.04 0.87 -0.68 -1.32 113.55 112.87 2jmk h SER 29 Ca 0.11 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2jmk h SER 29 Cb 0.06 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.10 2jmk h SER 29 CO -0.10 -0.02 0.47 0.15 -0.53 0.00 0.00 176.83 176.81 2jmk h PHE 30 N 0.10 0.94 -0.10 2.24 3.04 -0.96 0.10 116.94 122.30 2jmk h PHE 30 Ca 0.15 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.14 2jmk h PHE 30 Cb 0.19 -0.31 -0.02 0.00 2.56 0.00 0.00 35.95 38.36 2jmk h PHE 30 CO -0.22 0.61 -0.05 1.03 -2.02 0.00 0.00 178.31 177.66 2jmk h SER 31 N 1.00 -0.17 0.45 0.41 0.87 -0.44 -1.24 113.55 114.43 2jmk h SER 31 Ca 0.27 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.77 2jmk h SER 31 Cb -0.09 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2jmk h SER 31 CO -0.06 -0.07 -0.45 -0.08 -0.53 0.00 0.00 176.83 175.64 2jmk h GLU 32 N -0.04 0.00 -0.38 2.24 4.57 -1.02 -3.07 114.58 116.87 2jmk h GLU 32 Ca 0.06 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2jmk h GLU 32 Cb 0.13 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2jmk h GLU 32 CO -0.13 0.45 0.15 1.25 -1.18 0.00 0.00 179.01 179.55 2jmk h LEU 33 N 0.00 0.52 -2.76 1.64 7.12 -0.08 -1.20 115.31 120.55 2jmk h LEU 33 Ca -0.00 -0.16 0.00 0.00 0.13 0.00 0.00 57.88 57.84 2jmk h LEU 33 Cb 0.80 -0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 40.79 2jmk h LEU 33 CO 0.06 0.54 0.04 0.22 -0.13 0.00 0.00 178.44 179.17 2jmk h TYR 34 N 0.47 0.00 0.00 1.25 3.20 -1.15 0.25 116.97 120.99 2jmk h TYR 34 Ca 0.13 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 2jmk h TYR 34 Cb 0.18 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2jmk h TYR 34 CO -0.00 0.00 -0.47 -0.44 -1.64 0.00 0.00 178.16 175.61 2jmk h ASP 35 N 0.00 0.00 -0.77 -2.11 5.19 -1.41 -3.31 116.42 114.00 2jmk h ASP 35 Ca 0.00 -0.22 -0.00 0.00 -0.62 0.00 0.00 57.03 56.20 2jmk h ASP 35 Cb 0.08 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.55 2jmk h ASP 35 CO -0.00 0.86 0.48 -0.29 -3.12 0.00 0.00 179.24 177.18 2jmk h ILE 36 N -1.00 1.21 -0.06 0.35 2.10 -1.02 -1.47 117.51 117.62 2jmk h ILE 36 Ca -0.07 -0.44 0.02 0.00 1.08 0.00 0.00 64.86 65.44 2jmk h ILE 36 Cb 0.59 0.10 -0.00 0.00 -1.09 0.00 0.00 36.82 36.42 2jmk h ILE 36 CO -0.04 0.22 0.05 -0.29 -1.08 0.00 0.00 178.15 177.01 2jmk h ILE 37 N 1.07 0.75 -0.79 2.19 6.09 -0.69 -0.49 117.51 125.64 2jmk h ILE 37 Ca 0.28 0.00 -0.40 0.00 -1.37 0.00 0.00 64.86 63.37 2jmk h ILE 37 Cb -0.07 0.96 -0.24 0.00 0.47 0.00 0.00 36.82 37.95 2jmk h ILE 37 CO -0.06 0.00 0.42 -0.67 -3.07 0.00 0.00 178.15 174.77 2jmk n ASP 38 N -4.20 3.44 0.00 2.19 2.03 -0.56 -4.19 116.55 115.26 2jmk n ASP 38 Ca -0.02 -3.64 0.00 0.00 0.52 0.00 0.00 54.79 51.66 2jmk n ASP 38 Cb 0.15 -0.77 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 2jmk n ASP 38 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jmk n GLU 39 N -1.08 3.31 -2.49 -0.67 -0.58 -0.19 -5.00 120.64 113.93 2jmk n GLU 39 Ca 0.51 -0.19 -0.13 0.00 -0.42 0.00 0.00 57.16 56.93 2jmk n GLU 39 Cb 1.47 -0.67 -0.01 0.00 -0.57 0.00 0.00 31.44 31.67 2jmk n GLU 39 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2jmk n ASN 40 N -0.53 -3.93 -4.26 1.62 4.13 -1.24 -4.90 115.26 106.15 2jmk n ASN 40 Ca 0.00 0.16 -0.44 0.00 1.68 0.00 0.00 54.58 55.98 2jmk n ASN 40 Cb 0.01 -3.34 -0.05 0.00 -1.54 0.00 0.00 39.78 34.86 2jmk n ASN 40 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2jmk s ASP 41 N -2.07 6.17 0.20 6.41 2.15 -1.26 -4.87 116.67 123.40 2jmk s ASP 41 Ca 0.02 -2.37 0.24 0.00 0.43 0.00 0.00 52.55 50.87 2jmk s ASP 41 Cb -0.01 -2.11 0.42 0.00 -0.30 0.00 0.00 42.92 40.92 2jmk s ASP 41 CO 0.03 -0.62 1.45 0.74 -0.17 0.00 0.00 175.17 176.59 2jmk h THR 42 N 5.37 0.00 0.00 1.71 2.02 -1.93 -3.25 112.91 116.83 2jmk h THR 42 Ca -0.06 -0.63 -0.10 0.00 0.77 0.00 0.00 66.41 66.38 2jmk h THR 42 Cb 1.04 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.81 2jmk h THR 42 CO 0.83 0.00 -0.49 -0.78 0.37 0.00 0.00 175.52 175.44 2jmk h ASP 43 N 0.00 0.00 0.72 4.18 3.58 -2.01 -3.00 116.42 119.89 2jmk h ASP 43 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jmk h ASP 43 Cb 0.82 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.87 2jmk h ASP 43 CO 0.00 0.49 -0.90 0.55 -2.88 0.00 0.00 179.24 176.50 2jmk n VAL 44 N -3.62 0.34 -0.09 2.25 3.14 -1.24 -4.23 118.33 114.89 2jmk n VAL 44 Ca -0.00 -0.34 -0.06 0.00 -2.96 0.00 0.00 64.34 60.98 2jmk n VAL 44 Cb 0.57 -0.06 -0.00 0.00 -1.06 0.00 0.00 33.84 33.29 2jmk n VAL 44 CO 0.00 0.00 0.00 0.24 -6.46 0.00 0.00 176.83 170.61 2jmk h MET 45 N 0.00 -0.04 -0.58 1.45 2.86 -1.55 0.52 114.93 117.58 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 0.81 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.39 2jmk h MET 45 CO 0.00 -0.03 0.11 0.00 1.06 0.00 0.00 176.91 178.05 2jmk h MET 46 N -0.04 0.23 -0.49 1.72 -0.00 -1.74 0.16 114.93 114.77 2jmk h MET 46 Ca 0.16 -0.01 -0.07 0.00 -0.00 0.00 0.00 59.70 59.78 2jmk h MET 46 Cb 0.29 -0.05 -0.02 0.00 -0.00 0.00 0.00 31.60 31.81 2jmk h MET 46 CO -0.36 0.15 0.01 0.22 -0.00 0.00 0.00 176.91 176.93 2jmk h ASP 47 N 0.23 0.77 -0.42 -0.10 3.58 -1.55 -0.86 116.42 118.08 2jmk h ASP 47 Ca 0.30 -0.18 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 2jmk h ASP 47 Cb 0.45 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 2jmk h ASP 47 CO -0.40 0.83 0.03 0.15 -2.88 0.00 0.00 179.24 176.97 2jmk h PHE 48 N 0.76 0.77 -0.42 0.28 3.57 0.80 0.24 116.94 122.95 2jmk h PHE 48 Ca 0.15 -0.12 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 2jmk h PHE 48 Cb 0.44 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2jmk h PHE 48 CO 0.02 0.76 -0.17 0.82 -2.23 0.00 0.00 178.31 177.51 2jmk h ILE 49 N 0.56 1.28 0.00 1.41 2.04 -0.58 -1.07 117.51 121.14 2jmk h ILE 49 Ca 0.12 -1.31 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 2jmk h ILE 49 Cb 0.44 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 2jmk h ILE 49 CO 0.02 0.44 -0.43 0.28 0.00 0.00 0.00 178.15 178.46 2jmk h SER 50 N 0.67 0.00 0.00 1.72 0.02 -1.08 0.24 113.55 115.12 2jmk h SER 50 Ca 0.10 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 2jmk h SER 50 Cb 0.73 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.27 2jmk h SER 50 CO 0.06 0.43 -0.21 -0.09 -1.14 0.00 0.00 176.83 175.87 2jmk h ARG 51 N 0.00 0.14 0.00 3.45 2.43 -0.34 -3.39 114.38 116.67 2jmk h ARG 51 Ca -0.00 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2jmk h ARG 51 Cb 1.00 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 2jmk h ARG 51 CO 0.06 0.91 -0.00 0.74 -1.51 0.00 0.00 179.97 180.16 2jmk h PHE 52 N -0.56 -0.00 -3.33 2.20 -1.00 -1.23 -3.45 116.94 109.57 2jmk h PHE 52 Ca -0.03 -0.00 -0.53 0.00 2.81 0.00 0.00 57.97 60.22 2jmk h PHE 52 Cb 0.98 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.54 2jmk h PHE 52 CO 0.19 0.38 0.48 0.00 -1.61 0.00 0.00 178.31 177.75 2jmk s ALA 53 N -2.45 3.31 -0.27 2.45 0.00 0.83 -4.83 121.76 120.80 2jmk s ALA 53 Ca -0.07 0.74 -0.02 0.00 0.00 0.00 0.00 51.96 52.61 2jmk s ALA 53 Cb -0.01 -3.39 0.09 0.00 0.00 0.00 0.00 23.12 19.80 2jmk s ALA 53 CO 0.27 -0.32 0.08 1.03 0.00 0.00 0.00 175.76 176.82 2jmk s ARG 54 N 0.78 0.69 -1.26 0.00 0.52 -1.26 -4.36 118.95 114.06 2jmk s ARG 54 Ca 0.55 -0.84 -0.12 0.00 -0.52 0.00 0.00 55.73 54.80 2jmk s ARG 54 Cb -0.27 -1.97 0.16 0.00 0.52 0.00 0.00 34.95 33.40 2jmk s ARG 54 CO 0.30 -0.88 1.69 0.25 0.02 0.00 0.00 175.30 176.67 2jmk n THR 55 N 4.94 4.25 -0.02 0.02 -2.24 -1.26 -4.66 114.28 115.30 2jmk n THR 55 Ca -0.05 -4.48 -0.02 0.00 -2.27 0.00 0.00 64.05 57.23 2jmk n THR 55 Cb 0.43 -2.42 -0.01 0.00 -2.10 0.00 0.00 70.33 66.24 2jmk n THR 55 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2jmk n ASP 56 N 4.98 0.56 -3.67 3.42 9.92 -1.26 -5.04 116.55 125.46 2jmk n ASP 56 Ca 0.39 0.09 -0.15 0.00 -0.53 0.00 0.00 54.79 54.60 2jmk n ASP 56 Cb 0.40 -0.51 -0.14 0.00 -0.64 0.00 0.00 41.12 40.22 2jmk n ASP 56 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2jmk s GLU 57 N -1.54 0.10 -0.15 -1.24 2.12 -1.26 -5.14 118.70 111.59 2jmk s GLU 57 Ca -0.08 0.66 -0.00 0.00 0.36 0.00 0.00 54.97 55.91 2jmk s GLU 57 Cb 0.01 -0.13 -0.01 0.00 0.26 0.00 0.00 34.13 34.26 2jmk s GLU 57 CO 0.11 -0.29 -0.13 0.42 -0.54 0.00 0.00 175.26 174.83 2jmk s ILE 58 N 2.29 2.92 0.26 -3.70 1.01 -1.26 -5.12 121.20 117.59 2jmk s ILE 58 Ca 0.01 -0.69 0.07 0.00 0.00 0.00 0.00 60.65 60.03 2jmk s ILE 58 Cb -0.12 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.08 2jmk s ILE 58 CO -0.07 0.51 0.26 -0.04 0.00 0.00 0.00 174.94 175.60 2jmk s MET 59 N 0.62 3.05 0.14 2.79 -1.94 -1.26 -5.04 119.30 117.67 2jmk s MET 59 Ca -0.07 -1.00 -0.11 0.00 -1.71 0.00 0.00 55.69 52.80 2jmk s MET 59 Cb -0.16 -2.65 -0.04 0.00 2.01 0.00 0.00 34.83 33.99 2jmk s MET 59 CO 0.03 0.37 1.47 -1.00 -0.01 0.00 0.00 175.02 175.88 2jmk h PRO 60 N 1.36 0.95 -0.54 2.03 0.13 -2.05 -3.01 132.00 130.87 2jmk h PRO 60 Ca -0.49 -0.50 0.16 0.00 -0.87 0.00 0.00 66.00 64.30 2jmk h PRO 60 Cb 1.24 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 2jmk h PRO 60 CO 0.60 1.16 0.44 0.93 -0.23 0.00 0.00 178.00 180.90 2jmk h GLU 61 N 0.77 0.00 -6.00 0.86 5.08 -1.99 -3.41 114.58 109.90 2jmk h GLU 61 Ca 0.06 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.76 2jmk h GLU 61 Cb 0.99 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2jmk h GLU 61 CO 0.10 0.00 1.41 -0.25 -1.00 0.00 0.00 179.01 179.27 2jmk n ASP 62 N -4.11 2.29 -4.88 1.42 9.92 -1.14 -4.33 116.55 115.72 2jmk n ASP 62 Ca 0.10 0.41 -0.35 0.00 -0.53 0.00 0.00 54.79 54.42 2jmk n ASP 62 Cb 0.66 -1.30 -0.05 0.00 -0.64 0.00 0.00 41.12 39.79 2jmk n ASP 62 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2jmk s LYS 63 N 6.13 3.54 0.61 -1.24 2.36 0.34 -4.93 119.74 126.55 2jmk s LYS 63 Ca 1.08 -0.10 -0.17 0.00 -2.55 0.00 0.00 55.97 54.23 2jmk s LYS 63 Cb -0.80 -3.12 -0.03 0.00 -1.05 0.00 0.00 37.83 32.83 2jmk s LYS 63 CO 0.48 0.69 1.14 0.99 1.55 0.00 0.00 175.35 180.20 2jmk s THR 64 N -1.22 3.05 -0.03 3.43 2.01 -1.26 -1.26 115.64 120.35 2jmk s THR 64 Ca 0.24 0.58 0.04 0.00 0.31 0.00 0.00 61.69 62.86 2jmk s THR 64 Cb -0.13 -3.16 -0.06 0.00 0.01 0.00 0.00 72.50 69.16 2jmk s THR 64 CO 0.13 -0.21 0.05 0.55 -0.69 0.00 0.00 174.62 174.45 2jmk n VAL 65 N -1.86 0.21 0.00 3.82 3.14 0.87 -4.67 118.33 119.84 2jmk n VAL 65 Ca 0.12 -0.17 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 2jmk n VAL 65 Cb 0.51 -0.45 0.00 0.00 -1.06 0.00 0.00 33.84 32.84 2jmk n VAL 65 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2jmk n GLY 66 N 2.54 1.86 3.33 7.55 0.00 -1.26 -0.93 105.19 118.28 2jmk n GLY 66 Ca -0.05 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.09 2jmk n GLY 66 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jmk s PHE 67 N -2.00 2.44 -0.14 1.61 0.40 0.85 -1.36 117.98 119.78 2jmk s PHE 67 Ca 0.00 -0.47 -0.01 0.00 -0.60 0.00 0.00 56.93 55.85 2jmk s PHE 67 Cb 0.00 -1.56 0.04 0.00 0.51 0.00 0.00 43.02 42.01 2jmk s PHE 67 CO 0.00 -0.05 -0.03 0.08 0.70 0.00 0.00 175.22 175.92 2jmk s VAL 68 N -0.48 0.88 -0.13 -0.44 1.01 -0.22 -0.89 120.40 120.12 2jmk s VAL 68 Ca 0.06 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.48 2jmk s VAL 68 Cb -0.11 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2jmk s VAL 68 CO 0.01 0.15 0.31 -0.69 0.00 0.00 0.00 175.10 174.87 2jmk s VAL 69 N 1.74 5.27 -0.19 2.92 1.01 0.67 -1.15 120.40 130.67 2jmk s VAL 69 Ca 0.02 0.59 -0.04 0.00 0.00 0.00 0.00 61.98 62.55 2jmk s VAL 69 Cb -0.14 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.68 2jmk s VAL 69 CO -0.07 0.43 0.18 -0.69 0.00 0.00 0.00 175.10 174.94 2jmk s VAL 70 N 0.14 -0.25 -0.19 2.92 1.01 0.86 -0.97 120.40 123.93 2jmk s VAL 70 Ca 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 2jmk s VAL 70 Cb -0.14 -0.65 0.05 0.00 0.00 0.00 0.00 36.38 35.65 2jmk s VAL 70 CO 0.06 -0.24 -0.03 0.54 0.00 0.00 0.00 175.10 175.43 2jmk s ASN 71 N 2.26 3.09 0.19 3.32 2.20 -0.50 -0.65 114.94 124.85 2jmk s ASN 71 Ca 0.05 -0.82 0.04 0.00 -0.94 0.00 0.00 52.86 51.19 2jmk s ASN 71 Cb -0.16 -0.91 0.10 0.00 -2.00 0.00 0.00 41.25 38.28 2jmk s ASN 71 CO -0.11 -0.22 1.45 0.00 -2.94 0.00 0.00 177.10 175.28 2jmk h ALA 72 N 8.10 0.66 -0.37 3.54 0.00 -1.18 0.20 119.26 130.20 2jmk h ALA 72 Ca -0.21 -0.66 0.08 0.00 0.00 0.00 0.00 54.91 54.12 2jmk h ALA 72 Cb 1.10 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 2jmk h ALA 72 CO 0.39 0.85 -0.13 0.38 0.00 0.00 0.00 179.25 180.74 2jmk h ASP 73 N 0.12 -0.46 0.11 0.00 2.03 -1.79 -2.21 116.42 114.22 2jmk h ASP 73 Ca -0.03 0.13 0.00 0.00 -0.73 0.00 0.00 57.03 56.40 2jmk h ASP 73 Cb 1.35 0.27 0.00 0.00 -0.83 0.00 0.00 39.33 40.13 2jmk h ASP 73 CO 0.12 -0.16 -0.83 0.29 -1.03 0.00 0.00 179.24 177.62 2jmk n LYS 74 N -5.32 0.13 -3.10 4.15 4.01 -1.23 -4.96 118.16 111.82 2jmk n LYS 74 Ca 0.02 -0.10 -0.13 0.00 -0.51 0.00 0.00 58.31 57.58 2jmk n LYS 74 Cb 0.24 -1.50 0.07 0.00 -0.51 0.00 0.00 35.03 33.33 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 -1.35 -4.31 -4.73 1.97 5.02 0.53 -5.01 118.16 110.29 2jmk n LYS 75 Ca 0.05 0.70 -0.24 0.00 -2.02 0.00 0.00 58.31 56.80 2jmk n LYS 75 Cb 0.34 -5.20 -0.16 0.00 -0.02 0.00 0.00 35.03 30.00 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 -5.38 1.91 -0.03 -0.35 1.43 -0.26 -4.02 118.68 111.98 2jmk s LEU 76 Ca 0.12 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 2jmk s LEU 76 Cb -0.02 -0.85 0.02 0.00 0.03 0.00 0.00 46.19 45.37 2jmk s LEU 76 CO 0.60 0.14 -0.04 -0.32 0.23 0.00 0.00 176.35 176.97 2jmk s MET 77 N -0.01 0.65 -0.22 1.70 1.75 0.23 -1.41 119.30 121.99 2jmk s MET 77 Ca -0.02 -0.09 -0.04 0.00 -1.25 0.00 0.00 55.69 54.30 2jmk s MET 77 Cb -0.10 -0.69 0.08 0.00 2.84 0.00 0.00 34.83 36.97 2jmk s MET 77 CO 0.01 -0.05 0.14 -1.12 -0.65 0.00 0.00 175.02 173.35 2jmk s SER 78 N 0.73 2.39 -0.17 1.11 0.01 -0.14 -0.57 113.70 117.06 2jmk s SER 78 Ca -0.09 -0.71 -0.07 0.00 1.31 0.00 0.00 55.95 56.39 2jmk s SER 78 Cb -0.12 -0.08 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 2jmk s SER 78 CO -0.00 -0.37 0.05 0.68 0.41 0.00 0.00 173.24 174.01 2jmk s VAL 79 N 2.19 4.73 -0.27 3.43 -7.23 0.84 -0.24 120.40 123.85 2jmk s VAL 79 Ca 0.05 -0.06 -0.01 0.00 -1.81 0.00 0.00 61.98 60.16 2jmk s VAL 79 Cb -0.16 -3.11 0.14 0.00 0.56 0.00 0.00 36.38 33.81 2jmk s VAL 79 CO -0.18 0.49 0.36 -0.55 -0.31 0.00 0.00 175.10 174.90 2jmk s SER 80 N 0.16 0.72 0.36 4.85 0.15 -0.07 -0.56 113.70 119.31 2jmk s SER 80 Ca 0.04 -0.25 0.04 0.00 0.70 0.00 0.00 55.95 56.47 2jmk s SER 80 Cb -0.12 0.91 -0.04 0.00 -1.71 0.00 0.00 66.02 65.06 2jmk s SER 80 CO 0.01 -0.34 0.12 0.72 1.20 0.00 0.00 173.24 174.95 2jmk s PHE 81 N 2.49 1.76 0.48 3.44 -0.71 -1.25 -0.11 117.98 124.08 2jmk s PHE 81 Ca 0.10 -1.24 -0.22 0.00 -1.04 0.00 0.00 56.93 54.54 2jmk s PHE 81 Cb -0.14 -1.09 -0.10 0.00 -1.21 0.00 0.00 43.02 40.48 2jmk s PHE 81 CO -0.25 -0.30 0.81 0.45 -1.34 0.00 0.00 175.22 174.60 2jmk n SER 82 N -1.05 0.28 -4.57 1.98 2.88 -0.11 -4.77 113.62 108.26 2jmk n SER 82 Ca -0.03 0.91 -0.31 0.00 -1.33 0.00 0.00 58.87 58.11 2jmk n SER 82 Cb 0.65 -1.27 -0.05 0.00 -0.75 0.00 0.00 64.21 62.79 2jmk n SER 82 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2jmk s ASP 83 N -0.96 5.47 0.85 -3.46 1.11 -1.26 -4.94 116.67 113.48 2jmk s ASP 83 Ca 0.67 -1.19 -0.05 0.00 0.18 0.00 0.00 52.55 52.16 2jmk s ASP 83 Cb -0.52 -2.57 0.08 0.00 1.07 0.00 0.00 42.92 40.98 2jmk s ASP 83 CO 0.55 -2.50 0.52 2.30 1.18 0.00 0.00 175.17 177.21 2jmk n ILE 84 N 7.58 0.00 -1.24 0.77 -5.35 -1.26 -5.01 119.36 114.84 2jmk n ILE 84 Ca 0.41 -0.49 -0.36 0.00 -0.27 0.00 0.00 62.75 62.03 2jmk n ILE 84 Cb 0.47 -1.60 0.07 0.00 -1.74 0.00 0.00 39.64 36.85 2jmk n ILE 84 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2jmk n ASP 85 N -3.24 -1.32 -0.10 7.28 8.00 -1.26 -4.79 116.55 121.12 2jmk n ASP 85 Ca 0.07 0.58 -0.14 0.00 0.71 0.00 0.00 54.79 56.02 2jmk n ASP 85 Cb 0.25 -1.20 -0.04 0.00 -0.02 0.00 0.00 41.12 40.10 2jmk n ASP 85 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2jmk h GLU 86 N -0.40 0.79 -0.91 -1.24 -0.00 -1.99 -2.18 114.58 108.66 2jmk h GLU 86 Ca -0.45 -0.44 0.17 0.00 -0.00 0.00 0.00 59.36 58.63 2jmk h GLU 86 Cb 1.35 0.03 -0.10 0.00 -0.00 0.00 0.00 28.75 30.02 2jmk h GLU 86 CO 0.42 1.07 0.49 -0.91 -0.00 0.00 0.00 179.01 180.08 2jmk h ASN 87 N 0.56 0.60 0.50 3.06 2.35 -2.01 -0.07 115.58 120.57 2jmk h ASN 87 Ca 0.04 0.10 -0.23 0.00 -0.55 0.00 0.00 56.30 55.66 2jmk h ASN 87 Cb 0.95 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.32 2jmk h ASN 87 CO 0.09 0.23 -1.00 -0.03 -1.65 0.00 0.00 177.43 175.07 2jmk h MET 88 N 0.66 0.30 -0.40 0.81 4.05 -1.91 -3.29 114.93 115.15 2jmk h MET 88 Ca 0.51 -0.37 0.04 0.00 -0.28 0.00 0.00 59.70 59.61 2jmk h MET 88 Cb 0.76 0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 31.63 2jmk h MET 88 CO -0.38 1.08 0.16 0.87 0.23 0.00 0.00 176.91 178.87 2jmk h LYS 89 N 0.15 0.32 -0.90 0.39 1.57 -0.38 -1.31 116.57 116.40 2jmk h LYS 89 Ca -0.08 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.78 2jmk h LYS 89 Cb 1.66 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 33.82 2jmk h LYS 89 CO 0.16 0.21 0.54 -0.22 -0.57 0.00 0.00 179.45 179.57 2jmk h LYS 90 N 0.33 0.87 0.45 3.15 1.63 -1.34 0.25 116.57 121.90 2jmk h LYS 90 Ca 0.18 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.90 2jmk h LYS 90 Cb 0.14 -0.20 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 2jmk h LYS 90 CO -0.17 0.57 -0.22 0.28 -3.45 0.00 0.00 179.45 176.47 2jmk h VAL 91 N 0.89 0.50 -0.96 2.00 2.07 -1.44 -0.08 116.25 119.23 2jmk h VAL 91 Ca 0.43 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 67.63 2jmk h VAL 91 Cb 0.39 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 2jmk h VAL 91 CO -0.25 0.06 0.62 0.40 0.02 0.00 0.00 177.57 178.42 2jmk h ILE 92 N -0.84 1.10 -0.63 4.57 2.04 -0.94 -1.12 117.51 121.69 2jmk h ILE 92 Ca -0.06 -0.39 -0.09 0.00 1.00 0.00 0.00 64.86 65.31 2jmk h ILE 92 Cb 0.56 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 2jmk h ILE 92 CO 0.10 0.21 0.03 0.50 0.00 0.00 0.00 178.15 178.99 2jmk h LYS 93 N 1.14 1.08 0.02 2.37 1.63 -0.47 -0.83 116.57 121.52 2jmk h LYS 93 Ca 0.41 -0.33 -0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2jmk h LYS 93 Cb 0.12 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.64 2jmk h LYS 93 CO -0.16 1.04 -0.01 0.00 -3.45 0.00 0.00 179.45 176.87 2jmk h ALA 94 N 1.01 -0.02 -0.26 5.00 0.00 -0.22 0.24 119.26 125.00 2jmk h ALA 94 Ca 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2jmk h ALA 94 Cb 0.53 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2jmk h ALA 94 CO 0.03 -0.43 0.13 1.15 0.00 0.00 0.00 179.25 180.12 2jmk h THR 95 N -0.18 1.15 -0.08 0.00 2.02 -1.19 0.26 112.91 114.89 2jmk h THR 95 Ca -0.00 -0.42 -0.07 0.00 0.77 0.00 0.00 66.41 66.69 2jmk h THR 95 Cb 0.17 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2jmk h THR 95 CO 0.00 0.15 -0.26 0.00 0.37 0.00 0.00 175.52 175.78 2jmk h ALA 96 N 0.99 1.41 -0.03 6.16 0.00 -1.10 -2.73 119.26 123.96 2jmk h ALA 96 Ca 0.09 -0.28 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 2jmk h ALA 96 Cb 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2jmk h ALA 96 CO -0.01 0.42 -0.83 1.49 0.00 0.00 0.00 179.25 180.32 2jmk h GLU 97 N 0.13 0.32 -0.15 0.00 4.81 -0.14 -3.12 114.58 116.42 2jmk h GLU 97 Ca 0.02 -0.31 0.04 0.00 -0.13 0.00 0.00 59.36 58.99 2jmk h GLU 97 Cb 0.54 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 2jmk h GLU 97 CO 0.04 0.98 0.13 -0.22 -0.73 0.00 0.00 179.01 179.21 2jmk h LYS 98 N 0.20 0.00 -0.06 1.92 1.63 -0.63 -0.56 116.57 119.07 2jmk h LYS 98 Ca -0.05 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.77 2jmk h LYS 98 Cb 1.43 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 33.06 2jmk h LYS 98 CO 0.14 0.00 0.22 0.74 -3.45 0.00 0.00 179.45 177.10 2jmk h PHE 99 N 0.00 0.00 -1.28 1.91 -1.00 -1.54 -1.82 116.94 113.21 2jmk h PHE 99 Ca 0.07 0.00 0.37 0.00 2.81 0.00 0.00 57.97 61.22 2jmk h PHE 99 Cb 0.32 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.83 2jmk h PHE 99 CO 0.00 0.00 0.92 -0.22 -1.61 0.00 0.00 178.31 177.40 2jmk h LYS 100 N 0.00 0.01 -0.98 1.51 1.63 -1.19 0.32 116.57 117.87 2jmk h LYS 100 Ca 0.03 -0.00 0.22 0.00 -0.85 0.00 0.00 60.65 60.05 2jmk h LYS 100 Cb 0.47 -0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 32.01 2jmk h LYS 100 CO -0.00 0.00 0.62 -2.95 -3.45 0.00 0.00 179.45 173.68 2jmk h ASN 101 N 0.01 0.57 0.00 4.20 7.08 -1.57 -2.03 115.58 123.83 2jmk h ASN 101 Ca 0.61 0.08 -0.04 0.00 -3.08 0.00 0.00 56.30 53.87 2jmk h ASN 101 Cb 2.44 -0.02 -0.08 0.00 -2.08 0.00 0.00 38.32 38.57 2jmk h ASN 101 CO -0.01 0.19 -0.47 0.29 -2.08 0.00 0.00 177.43 175.34 2jmk n LYS 102 N -4.64 0.85 -2.68 4.14 4.76 0.98 -4.91 118.16 116.66 2jmk n LYS 102 Ca 0.23 -2.37 -0.03 0.00 -2.87 0.00 0.00 58.31 53.26 2jmk n LYS 102 Cb 0.70 -1.02 0.03 0.00 -1.84 0.00 0.00 35.03 32.90 2jmk n LYS 102 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jmk n GLY 103 N -0.65 -1.59 0.46 0.72 0.00 -0.27 -4.76 105.19 99.09 2jmk n GLY 103 Ca 0.12 1.19 0.28 0.00 0.00 0.00 0.00 46.02 47.61 2jmk n GLY 103 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2jmk h PHE 104 N 4.20 0.01 -0.99 1.61 -0.00 -1.75 -3.32 116.94 116.70 2jmk h PHE 104 Ca -0.01 0.00 -0.52 0.00 -0.00 0.00 0.00 57.97 57.43 2jmk h PHE 104 Cb 1.16 -0.00 -0.09 0.00 -0.00 0.00 0.00 35.95 37.03 2jmk h PHE 104 CO -0.06 0.00 1.34 0.21 -0.00 0.00 0.00 178.31 179.80 2jmk s LYS 105 N -4.98 3.34 -0.07 6.09 2.36 -1.26 -4.94 119.74 120.28 2jmk s LYS 105 Ca -0.05 -0.97 0.03 0.00 -2.55 0.00 0.00 55.97 52.43 2jmk s LYS 105 Cb 0.21 -5.30 0.01 0.00 -1.05 0.00 0.00 37.83 31.71 2jmk s LYS 105 CO 0.77 -2.53 -0.15 0.08 1.55 0.00 0.00 175.35 175.07 2jmk s VAL 106 N 6.30 1.34 -0.02 4.02 1.01 -1.25 -0.60 120.40 131.19 2jmk s VAL 106 Ca 0.53 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2jmk s VAL 106 Cb -0.01 -1.20 -0.00 0.00 0.00 0.00 0.00 36.38 35.17 2jmk s VAL 106 CO -0.06 0.40 -0.10 -0.70 0.00 0.00 0.00 175.10 174.64 2jmk s GLU 107 N 0.52 0.92 -0.02 2.72 -6.30 0.26 -5.00 118.70 111.79 2jmk s GLU 107 Ca -0.14 -0.33 0.02 0.00 -2.50 0.00 0.00 54.97 52.02 2jmk s GLU 107 Cb -0.16 -0.87 0.01 0.00 0.00 0.00 0.00 34.13 33.11 2jmk s GLU 107 CO 0.05 0.15 -0.06 0.95 0.02 0.00 0.00 175.26 176.37 2jmk s THR 108 N 0.03 0.58 -0.23 -1.70 -4.23 -1.26 -0.11 115.64 108.72 2jmk s THR 108 Ca -0.00 -0.24 -0.03 0.00 -1.18 0.00 0.00 61.69 60.24 2jmk s THR 108 Cb -0.07 -0.54 0.00 0.00 1.34 0.00 0.00 72.50 73.24 2jmk s THR 108 CO 0.00 0.20 -0.06 -1.81 -0.54 0.00 0.00 174.62 172.41 2jmk s ASP 109 N 0.32 4.21 0.00 3.99 1.11 0.28 -4.98 116.67 121.58 2jmk s ASP 109 Ca -0.04 -0.56 0.07 0.00 0.18 0.00 0.00 52.55 52.19 2jmk s ASP 109 Cb -0.08 -1.70 0.05 0.00 1.07 0.00 0.00 42.92 42.26 2jmk s ASP 109 CO 0.00 -0.06 0.71 1.15 1.18 0.00 0.00 175.17 178.16