#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 4.79 -0.39 2.03 2.01 -1.26 -4.97 115.64 117.85 2jmk s THR 2 Ca 0.00 0.93 -0.09 0.00 0.31 0.00 0.00 61.69 62.84 2jmk s THR 2 Cb 0.00 -3.76 0.05 0.00 0.01 0.00 0.00 72.50 68.81 2jmk s THR 2 CO 0.00 0.23 0.21 -0.76 -0.69 0.00 0.00 174.62 173.61 2jmk s LEU 3 N -1.97 4.84 0.30 4.42 1.43 -1.26 -0.46 118.68 125.98 2jmk s LEU 3 Ca 0.39 -1.28 0.08 0.00 -1.03 0.00 0.00 54.13 52.29 2jmk s LEU 3 Cb -0.15 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.06 2jmk s LEU 3 CO 0.19 -0.45 0.20 0.00 0.23 0.00 0.00 176.35 176.53 2jmk s ALA 5 N -2.26 1.94 -0.33 0.00 0.00 0.90 -0.45 121.76 121.57 2jmk s ALA 5 Ca 0.36 -1.47 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 2jmk s ALA 5 Cb -0.06 -0.16 0.05 0.00 0.00 0.00 0.00 23.12 22.94 2jmk s ALA 5 CO 0.25 0.21 0.08 -1.64 0.00 0.00 0.00 175.76 174.65 2jmk s MET 6 N -2.83 2.49 -0.43 0.00 -1.94 -0.16 -0.98 119.30 115.45 2jmk s MET 6 Ca 0.15 -1.29 -0.12 0.00 -1.71 0.00 0.00 55.69 52.72 2jmk s MET 6 Cb -0.05 -3.37 0.06 0.00 2.01 0.00 0.00 34.83 33.48 2jmk s MET 6 CO 0.06 -0.70 0.30 -0.47 -0.01 0.00 0.00 175.02 174.21 2jmk s TYR 7 N 1.32 3.28 -0.25 -0.03 6.14 0.85 -1.25 117.35 127.41 2jmk s TYR 7 Ca -0.02 -1.14 -0.16 0.00 0.64 0.00 0.00 57.07 56.39 2jmk s TYR 7 Cb -0.20 -2.90 -0.03 0.00 0.42 0.00 0.00 41.96 39.24 2jmk s TYR 7 CO 0.01 -0.77 0.43 1.21 0.64 0.00 0.00 175.55 177.06 2jmk s ASN 8 N 2.15 6.37 -0.07 4.32 2.47 0.51 -0.10 114.94 130.58 2jmk s ASN 8 Ca 0.03 0.44 0.01 0.00 0.42 0.00 0.00 52.86 53.76 2jmk s ASN 8 Cb -0.22 -2.24 0.02 0.00 -1.45 0.00 0.00 41.25 37.35 2jmk s ASN 8 CO 0.05 -0.19 -0.10 -0.51 -3.72 0.00 0.00 177.10 172.64 2jmk s ILE 9 N 1.93 1.00 -0.38 -5.21 2.07 -0.45 -0.09 121.20 120.07 2jmk s ILE 9 Ca 0.18 -0.36 0.01 0.00 -1.41 0.00 0.00 60.65 59.07 2jmk s ILE 9 Cb -0.15 -0.95 0.13 0.00 0.13 0.00 0.00 42.46 41.61 2jmk s ILE 9 CO 0.09 0.33 0.20 -0.94 -1.91 0.00 0.00 174.94 172.71 2jmk s SER 10 N 0.98 3.50 1.11 4.50 1.04 0.53 -0.10 113.70 125.26 2jmk s SER 10 Ca -0.09 -2.22 -0.18 0.00 0.48 0.00 0.00 55.95 53.94 2jmk s SER 10 Cb -0.15 -0.76 0.10 0.00 0.10 0.00 0.00 66.02 65.31 2jmk s SER 10 CO 0.00 -0.32 0.01 0.80 0.98 0.00 0.00 173.24 174.71 2jmk n MET 11 N 4.05 -1.48 -1.47 4.02 1.56 -1.26 -0.12 117.12 122.43 2jmk n MET 11 Ca 0.07 -0.41 -0.47 0.00 -0.27 0.00 0.00 57.70 56.61 2jmk n MET 11 Cb 0.37 -1.70 -0.07 0.00 2.15 0.00 0.00 33.22 33.97 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 -4.35 1.01 -2.61 -5.12 0.00 -1.26 -1.24 120.51 106.94 2jmk n ALA 12 Ca 0.01 -0.21 -0.07 0.00 0.00 0.00 0.00 53.44 53.17 2jmk n ALA 12 Cb 0.62 -2.63 0.04 0.00 0.00 0.00 0.00 19.45 17.48 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 6.44 0.12 3.09 0.00 0.00 -1.26 -4.88 105.19 108.70 2jmk n GLY 13 Ca 0.42 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 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 -3.54 -0.24 0.84 1.61 0.15 -0.38 -5.09 113.70 107.06 2jmk s SER 14 Ca 0.01 0.47 -0.14 0.00 0.70 0.00 0.00 55.95 56.99 2jmk s SER 14 Cb -0.01 0.43 -0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2jmk s SER 14 CO 0.30 -0.10 0.44 0.00 1.20 0.00 0.00 173.24 175.08 2jmk n HIS 15 N 3.35 -1.22 -2.06 3.44 -0.00 -1.26 -4.24 115.22 113.22 2jmk n HIS 15 Ca -0.17 0.28 -0.41 0.00 -0.00 0.00 0.00 57.72 57.43 2jmk n HIS 15 Cb 0.57 -1.84 -0.03 0.00 -0.00 0.00 0.00 29.99 28.69 2jmk n HIS 15 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2jmk s PRO 16 N -3.19 3.04 -0.22 -1.40 0.04 -1.26 -4.44 135.00 127.57 2jmk s PRO 16 Ca 0.61 0.98 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 2jmk s PRO 16 Cb -0.28 -4.26 0.01 0.00 0.04 0.00 0.00 34.50 30.01 2jmk s PRO 16 CO 0.63 -2.22 1.02 0.99 0.04 0.00 0.00 177.00 177.45 2jmk s THR 17 N 7.71 4.71 -0.53 1.26 2.01 0.86 -4.85 115.64 126.81 2jmk s THR 17 Ca 0.71 1.99 -0.24 0.00 0.31 0.00 0.00 61.69 64.46 2jmk s THR 17 Cb -0.17 -4.29 0.04 0.00 0.01 0.00 0.00 72.50 68.09 2jmk s THR 17 CO 0.27 -0.15 0.93 -0.89 -0.69 0.00 0.00 174.62 174.09 2jmk s THR 18 N 3.04 4.42 -0.39 -0.82 2.01 -1.26 -1.34 115.64 121.29 2jmk s THR 18 Ca 0.44 0.38 -0.05 0.00 0.31 0.00 0.00 61.69 62.77 2jmk s THR 18 Cb -0.15 -4.51 0.09 0.00 0.01 0.00 0.00 72.50 67.94 2jmk s THR 18 CO 0.07 -1.04 0.19 -0.63 -0.69 0.00 0.00 174.62 172.52 2jmk s ILE 19 N 3.87 3.56 -0.23 1.82 1.01 0.85 -4.96 121.20 127.12 2jmk s ILE 19 Ca 0.32 -1.70 -0.28 0.00 0.00 0.00 0.00 60.65 58.99 2jmk s ILE 19 Cb -0.12 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2jmk s ILE 19 CO 0.21 -0.52 0.97 0.00 0.00 0.00 0.00 174.94 175.60 2jmk s VAL 21 N 3.04 0.95 0.68 0.00 1.01 -0.15 -4.01 120.40 121.92 2jmk s VAL 21 Ca 0.41 -0.37 -0.17 0.00 0.00 0.00 0.00 61.98 61.85 2jmk s VAL 21 Cb -0.15 -0.89 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2jmk s VAL 21 CO 0.07 0.31 0.93 0.55 0.00 0.00 0.00 175.10 176.96 2jmk n VAL 22 N 3.86 3.11 -0.05 2.92 3.14 -1.26 -0.07 118.33 129.98 2jmk n VAL 22 Ca -0.24 -0.42 0.10 0.00 -2.96 0.00 0.00 64.34 60.82 2jmk n VAL 22 Cb 0.51 -1.09 0.49 0.00 -1.06 0.00 0.00 33.84 32.70 2jmk n VAL 22 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 2jmk h MET 23 N -0.01 0.41 0.00 1.45 4.05 -1.49 0.27 114.93 119.60 2jmk h MET 23 Ca -0.48 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 58.92 2jmk h MET 23 Cb 1.35 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 32.06 2jmk h MET 23 CO 0.48 0.27 0.00 -0.25 0.23 0.00 0.00 176.91 177.64 2jmk n ASP 24 N -4.47 0.00 -0.19 1.39 9.92 -1.26 -2.12 116.55 119.81 2jmk n ASP 24 Ca 0.08 0.44 0.07 0.00 -0.53 0.00 0.00 54.79 54.85 2jmk n ASP 24 Cb 0.29 -0.47 0.13 0.00 -0.64 0.00 0.00 41.12 40.42 2jmk n ASP 24 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2jmk n ARG 25 N -1.47 1.95 0.10 -1.24 1.74 0.90 -4.73 116.66 113.91 2jmk n ARG 25 Ca 0.04 -2.35 -0.13 0.00 -0.77 0.00 0.00 57.85 54.64 2jmk n ARG 25 Cb 0.18 -1.43 -0.08 0.00 -1.02 0.00 0.00 32.46 30.11 2jmk n ARG 25 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2jmk h PHE 26 N 0.33 -0.27 -0.03 -1.55 3.04 -1.03 -0.50 116.94 116.92 2jmk h PHE 26 Ca 0.00 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.97 2jmk h PHE 26 Cb 0.94 0.09 -0.04 0.00 2.56 0.00 0.00 35.95 39.50 2jmk h PHE 26 CO 0.08 0.09 -0.16 1.25 -2.02 0.00 0.00 178.31 177.55 2jmk h LEU 27 N -0.70 -0.46 -0.19 0.59 7.12 -1.85 -0.47 115.31 119.35 2jmk h LEU 27 Ca -0.03 0.07 0.01 0.00 0.13 0.00 0.00 57.88 58.07 2jmk h LEU 27 Cb 0.49 0.20 -0.02 0.00 -0.53 0.00 0.00 40.66 40.80 2jmk h LEU 27 CO 0.05 -0.21 0.09 -0.08 -0.13 0.00 0.00 178.44 178.15 2jmk h GLU 28 N -0.24 0.18 0.12 1.25 4.57 -1.88 0.22 114.58 118.81 2jmk h GLU 28 Ca 0.06 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.25 2jmk h GLU 28 Cb 0.33 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.83 2jmk h GLU 28 CO -0.17 0.12 -0.38 1.03 -1.18 0.00 0.00 179.01 178.43 2jmk h SER 29 N 0.19 -1.10 -0.74 1.04 0.87 -0.75 -0.64 113.55 112.42 2jmk h SER 29 Ca 0.08 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 2jmk h SER 29 Cb 0.03 0.41 -0.04 0.00 -0.44 0.00 0.00 62.40 62.36 2jmk h SER 29 CO -0.06 -0.46 0.43 0.15 -0.53 0.00 0.00 176.83 176.36 2jmk h PHE 30 N -0.61 1.00 -0.72 2.24 3.04 -0.96 0.25 116.94 121.17 2jmk h PHE 30 Ca 0.03 -0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.07 2jmk h PHE 30 Cb 0.64 -0.32 -0.08 0.00 2.56 0.00 0.00 35.95 38.75 2jmk h PHE 30 CO -0.33 0.69 0.35 1.03 -2.02 0.00 0.00 178.31 178.02 2jmk h SER 31 N 1.02 0.43 0.77 0.41 0.87 -0.02 0.15 113.55 117.18 2jmk h SER 31 Ca 0.26 0.07 -0.25 0.00 -1.23 0.00 0.00 61.79 60.64 2jmk h SER 31 Cb -0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2jmk h SER 31 CO -0.05 0.23 -1.16 -0.33 -0.53 0.00 0.00 176.83 175.00 2jmk h GLU 32 N 0.57 0.17 -0.36 2.24 4.39 -0.75 -3.32 114.58 117.52 2jmk h GLU 32 Ca 0.36 -0.30 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2jmk h GLU 32 Cb 0.42 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.17 2jmk h GLU 32 CO -0.30 1.14 0.24 1.25 -1.16 0.00 0.00 179.01 180.18 2jmk h LEU 33 N 0.05 0.41 -2.72 1.33 7.12 0.38 -0.14 115.31 121.74 2jmk h LEU 33 Ca -0.09 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 57.91 2jmk h LEU 33 Cb 1.90 -0.10 -0.00 0.00 -0.53 0.00 0.00 40.66 41.93 2jmk h LEU 33 CO 0.18 0.30 0.05 0.22 -0.13 0.00 0.00 178.44 179.05 2jmk h TYR 34 N 0.49 0.00 0.00 1.25 3.20 -1.10 0.22 116.97 121.03 2jmk h TYR 34 Ca 0.13 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2jmk h TYR 34 Cb -0.06 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.21 2jmk h TYR 34 CO -0.05 0.00 -0.33 -0.44 -1.64 0.00 0.00 178.16 175.69 2jmk h ASP 35 N 0.00 0.00 -0.88 -2.11 3.32 -1.34 -3.33 116.42 112.08 2jmk h ASP 35 Ca 0.01 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.13 2jmk h ASP 35 Cb 0.10 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.59 2jmk h ASP 35 CO -0.00 0.64 0.57 -0.29 -1.72 0.00 0.00 179.24 178.44 2jmk h ILE 36 N -0.94 1.02 -0.20 0.35 2.10 -0.93 -0.30 117.51 118.61 2jmk h ILE 36 Ca 0.00 -0.32 0.06 0.00 1.08 0.00 0.00 64.86 65.67 2jmk h ILE 36 Cb 0.33 -0.00 -0.01 0.00 -1.09 0.00 0.00 36.82 36.05 2jmk h ILE 36 CO 0.00 0.17 0.15 -0.29 -1.08 0.00 0.00 178.15 177.11 2jmk h ILE 37 N 0.94 0.80 0.00 2.19 6.09 -0.75 0.34 117.51 127.11 2jmk h ILE 37 Ca 0.39 0.00 -0.11 0.00 -1.37 0.00 0.00 64.86 63.77 2jmk h ILE 37 Cb 0.28 0.89 -0.02 0.00 0.47 0.00 0.00 36.82 38.45 2jmk h ILE 37 CO -0.15 0.00 -0.52 -0.78 -3.07 0.00 0.00 178.15 173.63 2jmk h ASP 38 N 0.00 0.00 -2.61 2.19 1.82 -1.16 -3.45 116.42 113.22 2jmk h ASP 38 Ca 0.09 0.00 -0.46 0.00 -0.39 0.00 0.00 57.03 56.28 2jmk h ASP 38 Cb 0.40 0.00 0.03 0.00 0.68 0.00 0.00 39.33 40.44 2jmk h ASP 38 CO -0.00 0.52 -0.13 -0.70 -1.61 0.00 0.00 179.24 177.32 2jmk s GLU 39 N -3.60 3.07 -0.52 0.28 2.56 0.11 -5.03 118.70 115.57 2jmk s GLU 39 Ca -0.01 -0.56 0.03 0.00 0.00 0.00 0.00 54.97 54.43 2jmk s GLU 39 Cb 0.12 -2.60 0.43 0.00 2.00 0.00 0.00 34.13 34.08 2jmk s GLU 39 CO 0.73 -0.22 1.51 -1.71 -0.56 0.00 0.00 175.26 175.01 2jmk n ASN 40 N -2.02 5.96 -4.50 -1.70 5.15 -1.26 -4.96 115.26 111.94 2jmk n ASN 40 Ca 0.01 -3.77 -0.43 0.00 -0.60 0.00 0.00 54.58 49.79 2jmk n ASN 40 Cb 0.58 -0.65 -0.05 0.00 -0.53 0.00 0.00 39.78 39.13 2jmk n ASN 40 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2jmk s ASP 41 N -2.73 6.31 0.07 1.20 1.01 -1.26 -4.88 116.67 116.39 2jmk s ASP 41 Ca 0.53 -0.51 0.11 0.00 0.71 0.00 0.00 52.55 53.40 2jmk s ASP 41 Cb 0.43 -2.37 -0.17 0.00 1.01 0.00 0.00 42.92 41.82 2jmk s ASP 41 CO -0.12 -1.04 1.02 0.74 0.21 0.00 0.00 175.17 175.98 2jmk h THR 42 N 5.95 1.13 -0.20 -1.27 2.02 -2.00 -3.08 112.91 115.47 2jmk h THR 42 Ca -0.26 -2.81 -0.15 0.00 0.77 0.00 0.00 66.41 63.95 2jmk h THR 42 Cb 1.08 2.53 -0.01 0.00 -1.74 0.00 0.00 68.15 70.01 2jmk h THR 42 CO 1.02 0.64 -0.51 -0.78 0.37 0.00 0.00 175.52 176.25 2jmk h ASP 43 N 0.00 0.60 1.46 4.18 3.58 -2.03 -3.03 116.42 121.18 2jmk h ASP 43 Ca -0.13 -0.31 -0.08 0.00 0.42 0.00 0.00 57.03 56.93 2jmk h ASP 43 Cb 1.78 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 42.65 2jmk h ASP 43 CO 0.09 1.01 -0.40 0.58 -2.88 0.00 0.00 179.24 177.64 2jmk h VAL 44 N 0.43 0.72 -0.21 2.25 2.07 -1.98 -3.32 116.25 116.21 2jmk h VAL 44 Ca 0.02 -1.91 0.05 0.00 0.82 0.00 0.00 66.70 65.68 2jmk h VAL 44 Cb 1.05 2.27 -0.06 0.00 -1.52 0.00 0.00 31.29 33.03 2jmk h VAL 44 CO 0.10 0.39 -0.17 0.24 0.02 0.00 0.00 177.57 178.15 2jmk h MET 45 N 0.00 -0.17 -0.03 1.57 2.86 -1.43 0.15 114.93 117.88 2jmk h MET 45 Ca -0.00 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.68 2jmk h MET 45 Cb 1.24 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.89 2jmk h MET 45 CO 0.05 -0.11 -0.26 1.98 1.06 0.00 0.00 176.91 179.63 2jmk h MET 46 N -0.18 -0.37 -0.64 1.72 -1.53 -1.65 0.88 114.93 113.17 2jmk h MET 46 Ca 0.12 0.02 0.05 0.00 -3.44 0.00 0.00 59.70 56.46 2jmk h MET 46 Cb 0.36 0.08 -0.04 0.00 -0.55 0.00 0.00 31.60 31.46 2jmk h MET 46 CO -0.32 -0.24 0.42 0.22 0.14 0.00 0.00 176.91 177.13 2jmk h ASP 47 N -0.38 0.59 -0.32 1.39 3.58 -1.60 -0.81 116.42 118.87 2jmk h ASP 47 Ca 0.07 -0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 2jmk h ASP 47 Cb 0.48 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 2jmk h ASP 47 CO -0.25 0.39 -0.06 0.15 -2.88 0.00 0.00 179.24 176.60 2jmk h PHE 48 N 0.68 0.67 -0.63 0.28 3.57 0.46 0.24 116.94 122.21 2jmk h PHE 48 Ca 0.27 -0.14 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2jmk h PHE 48 Cb 0.20 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 2jmk h PHE 48 CO -0.00 0.77 0.11 0.82 -2.23 0.00 0.00 178.31 177.78 2jmk h ILE 49 N 0.38 1.26 0.00 1.41 2.04 -0.18 -0.87 117.51 121.55 2jmk h ILE 49 Ca 0.08 -1.01 -0.11 0.00 1.00 0.00 0.00 64.86 64.82 2jmk h ILE 49 Cb 0.54 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 2jmk h ILE 49 CO 0.03 0.38 -0.54 -1.28 0.00 0.00 0.00 178.15 176.73 2jmk h SER 50 N 0.96 0.00 -0.08 1.72 0.87 -1.11 0.24 113.55 116.16 2jmk h SER 50 Ca 0.19 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.62 2jmk h SER 50 Cb 0.43 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.39 2jmk h SER 50 CO 0.01 0.54 -0.49 -0.09 -0.53 0.00 0.00 176.83 176.28 2jmk h ARG 51 N 0.00 0.47 0.00 2.24 2.43 -0.21 -3.38 114.38 115.92 2jmk h ARG 51 Ca -0.01 -0.40 -0.06 0.00 -0.81 0.00 0.00 59.98 58.70 2jmk h ARG 51 Cb 1.23 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.86 2jmk h ARG 51 CO 0.07 1.04 -0.52 0.74 -1.51 0.00 0.00 179.97 179.79 2jmk h PHE 52 N 0.03 0.00 -3.69 2.20 0.04 -1.20 -3.47 116.94 110.85 2jmk h PHE 52 Ca -0.04 0.00 -0.50 0.00 2.80 0.00 0.00 57.97 60.23 2jmk h PHE 52 Cb 1.14 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.27 2jmk h PHE 52 CO 0.12 0.58 0.15 0.00 -0.60 0.00 0.00 178.31 178.56 2jmk s ALA 53 N -2.50 3.33 0.47 2.45 0.00 0.86 -4.80 121.76 121.56 2jmk s ALA 53 Ca -0.16 0.18 0.08 0.00 0.00 0.00 0.00 51.96 52.06 2jmk s ALA 53 Cb 0.02 -2.87 0.02 0.00 0.00 0.00 0.00 23.12 20.29 2jmk s ALA 53 CO 0.35 0.30 0.51 1.03 0.00 0.00 0.00 175.76 177.95 2jmk s ARG 54 N -2.39 2.53 0.19 0.00 0.52 -1.26 -4.16 118.95 114.38 2jmk s ARG 54 Ca 0.49 -1.55 0.00 0.00 -0.52 0.00 0.00 55.73 54.15 2jmk s ARG 54 Cb -0.14 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.84 2jmk s ARG 54 CO 0.20 -0.40 0.00 0.25 0.02 0.00 0.00 175.30 175.36 2jmk n THR 55 N -1.79 0.19 -1.87 0.02 -2.24 -1.26 -4.93 114.28 102.40 2jmk n THR 55 Ca 0.06 0.06 -0.38 0.00 -2.27 0.00 0.00 64.05 61.53 2jmk n THR 55 Cb 0.61 -0.59 0.04 0.00 -2.10 0.00 0.00 70.33 68.29 2jmk n THR 55 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jmk s ASP 56 N -4.94 5.31 -1.10 3.42 2.15 -1.26 -3.49 116.67 116.76 2jmk s ASP 56 Ca 0.00 2.64 -0.17 0.00 0.43 0.00 0.00 52.55 55.46 2jmk s ASP 56 Cb 0.00 -2.63 -0.02 0.00 -0.30 0.00 0.00 42.92 39.97 2jmk s ASP 56 CO 0.00 -1.53 0.82 -0.62 -0.17 0.00 0.00 175.17 173.67 2jmk n GLU 57 N -1.11 -1.43 -2.10 4.34 1.02 -1.26 -4.91 120.64 115.18 2jmk n GLU 57 Ca 0.11 0.59 -0.37 0.00 -0.02 0.00 0.00 57.16 57.47 2jmk n GLU 57 Cb 0.46 -4.49 0.01 0.00 -0.02 0.00 0.00 31.44 27.40 2jmk n GLU 57 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2jmk s ILE 58 N -3.42 2.79 -0.75 -3.67 -1.16 -1.23 -4.99 121.20 108.78 2jmk s ILE 58 Ca 0.45 0.56 -0.06 0.00 -0.51 0.00 0.00 60.65 61.09 2jmk s ILE 58 Cb -0.14 -3.27 0.19 0.00 0.61 0.00 0.00 42.46 39.85 2jmk s ILE 58 CO 0.83 -0.04 0.61 0.00 -2.81 0.00 0.00 174.94 173.54 2jmk s MET 59 N -2.92 3.02 0.33 3.50 0.00 -1.26 -4.90 119.30 117.08 2jmk s MET 59 Ca 0.69 -2.69 0.13 0.00 0.00 0.00 0.00 55.69 53.82 2jmk s MET 59 Cb -0.31 -3.98 0.58 0.00 0.00 0.00 0.00 34.83 31.12 2jmk s MET 59 CO 0.37 -1.22 1.73 -1.00 0.00 0.00 0.00 175.02 174.90 2jmk h PRO 60 N 7.00 0.00 0.00 3.16 0.13 -2.03 -2.84 132.00 137.42 2jmk h PRO 60 Ca 0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 2jmk h PRO 60 Cb 0.95 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.07 2jmk h PRO 60 CO 0.76 0.47 -0.03 1.05 -0.23 0.00 0.00 178.00 180.01 2jmk h GLU 61 N 0.00 0.00 -6.67 0.86 4.11 -1.97 -3.44 114.58 107.47 2jmk h GLU 61 Ca -0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.36 58.97 2jmk h GLU 61 Cb 0.85 0.00 0.24 0.00 0.50 0.00 0.00 28.75 30.34 2jmk h GLU 61 CO 0.06 0.03 -1.10 -0.40 0.07 0.00 0.00 179.01 177.67 2jmk n ASP 62 N -3.60 -2.37 -4.28 3.06 5.75 -1.08 -4.65 116.55 109.38 2jmk n ASP 62 Ca -0.03 -0.12 -0.15 0.00 -0.01 0.00 0.00 54.79 54.48 2jmk n ASP 62 Cb 0.13 -0.95 -0.10 0.00 -1.03 0.00 0.00 41.12 39.17 2jmk n ASP 62 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2jmk s LYS 63 N -3.43 1.19 -0.09 0.11 2.20 0.40 -4.93 119.74 115.19 2jmk s LYS 63 Ca 0.56 -1.56 -0.29 0.00 -0.36 0.00 0.00 55.97 54.31 2jmk s LYS 63 Cb -0.11 -0.56 -0.02 0.00 -1.51 0.00 0.00 37.83 35.63 2jmk s LYS 63 CO 0.66 -0.03 0.98 0.99 -0.36 0.00 0.00 175.35 177.58 2jmk s THR 64 N -3.42 4.82 -0.11 3.43 2.01 -1.26 -0.13 115.64 120.98 2jmk s THR 64 Ca 0.23 1.99 0.03 0.00 0.31 0.00 0.00 61.69 64.25 2jmk s THR 64 Cb 0.04 -4.29 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 2jmk s THR 64 CO 0.05 0.04 0.11 0.55 -0.69 0.00 0.00 174.62 174.68 2jmk n VAL 65 N 4.41 0.00 0.00 3.82 3.14 0.41 -4.88 118.33 125.23 2jmk n VAL 65 Ca 0.08 -0.37 0.00 0.00 -2.96 0.00 0.00 64.34 61.08 2jmk n VAL 65 Cb 0.49 0.91 0.00 0.00 -1.06 0.00 0.00 33.84 34.18 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 1.28 2.18 3.03 7.55 0.00 -1.26 -0.28 105.19 117.68 2jmk n GLY 66 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.54 2jmk n GLY 66 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jmk s PHE 67 N -1.76 0.74 -0.13 1.61 -0.71 0.32 -0.99 117.98 117.06 2jmk s PHE 67 Ca 0.00 -0.23 -0.01 0.00 -1.04 0.00 0.00 56.93 55.65 2jmk s PHE 67 Cb 0.00 -0.46 0.03 0.00 -1.21 0.00 0.00 43.02 41.38 2jmk s PHE 67 CO 0.00 -0.02 -0.04 0.08 -1.34 0.00 0.00 175.22 173.90 2jmk s VAL 68 N -0.51 0.90 -0.33 -2.49 1.01 -0.38 -0.17 120.40 118.42 2jmk s VAL 68 Ca 0.00 -0.38 -0.16 0.00 0.00 0.00 0.00 61.98 61.44 2jmk s VAL 68 Cb -0.05 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 2jmk s VAL 68 CO 0.00 0.21 0.43 -0.69 0.00 0.00 0.00 175.10 175.05 2jmk s VAL 69 N 1.74 5.10 -0.22 2.92 1.01 0.88 -0.36 120.40 131.46 2jmk s VAL 69 Ca 0.03 0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.30 2jmk s VAL 69 Cb -0.14 -3.86 0.05 0.00 0.00 0.00 0.00 36.38 32.43 2jmk s VAL 69 CO -0.07 -0.10 -0.09 -0.69 0.00 0.00 0.00 175.10 174.15 2jmk s VAL 70 N 2.19 1.73 -0.22 2.92 1.01 0.88 -1.13 120.40 127.77 2jmk s VAL 70 Ca 0.15 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 60.93 2jmk s VAL 70 Cb -0.16 -1.86 0.05 0.00 0.00 0.00 0.00 36.38 34.41 2jmk s VAL 70 CO 0.12 0.05 -0.07 0.20 0.00 0.00 0.00 175.10 175.40 2jmk s ASN 71 N 1.33 3.65 0.07 3.32 0.01 -0.26 -0.35 114.94 122.72 2jmk s ASN 71 Ca -0.04 -1.06 -0.14 0.00 -0.71 0.00 0.00 52.86 50.91 2jmk s ASN 71 Cb -0.18 -1.18 -0.25 0.00 0.41 0.00 0.00 41.25 40.06 2jmk s ASN 71 CO -0.07 -0.21 1.16 0.00 -1.51 0.00 0.00 177.10 176.48 2jmk h ALA 72 N 7.97 0.09 0.25 0.60 0.00 -0.73 0.31 119.26 127.75 2jmk h ALA 72 Ca -0.21 -0.73 -0.01 0.00 0.00 0.00 0.00 54.91 53.96 2jmk h ALA 72 Cb 1.08 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jmk h ALA 72 CO 0.43 0.70 -0.12 0.22 0.00 0.00 0.00 179.25 180.47 2jmk h ASP 73 N 0.35 -0.29 1.26 0.00 3.58 -1.69 -2.87 116.42 116.76 2jmk h ASP 73 Ca -0.15 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.25 2jmk h ASP 73 Cb 1.77 0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.90 2jmk h ASP 73 CO 0.22 -0.14 -0.22 0.29 -2.88 0.00 0.00 179.24 176.51 2jmk n LYS 74 N -5.20 0.28 -3.07 0.28 4.01 -1.25 -4.92 118.16 108.27 2jmk n LYS 74 Ca -0.09 0.17 -0.13 0.00 -0.51 0.00 0.00 58.31 57.74 2jmk n LYS 74 Cb 0.18 -1.77 0.07 0.00 -0.51 0.00 0.00 35.03 33.00 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 -2.22 -3.96 -4.45 1.97 5.02 0.86 -5.03 118.16 110.35 2jmk n LYS 75 Ca 0.05 0.70 -0.30 0.00 -2.02 0.00 0.00 58.31 56.74 2jmk n LYS 75 Cb 0.43 -5.18 -0.17 0.00 -0.02 0.00 0.00 35.03 30.10 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 -5.32 1.89 -0.16 -0.35 1.43 0.17 -4.43 118.68 111.90 2jmk s LEU 76 Ca 0.16 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 2jmk s LEU 76 Cb -0.02 -1.26 0.02 0.00 0.03 0.00 0.00 46.19 44.96 2jmk s LEU 76 CO 0.60 0.03 -0.17 -0.04 0.23 0.00 0.00 176.35 177.00 2jmk s MET 77 N 1.01 2.67 -0.03 1.70 -1.94 0.60 -1.10 119.30 122.20 2jmk s MET 77 Ca -0.04 -0.70 -0.02 0.00 -1.71 0.00 0.00 55.69 53.22 2jmk s MET 77 Cb -0.15 -2.35 0.02 0.00 2.01 0.00 0.00 34.83 34.36 2jmk s MET 77 CO -0.04 -0.22 0.07 -1.12 -0.01 0.00 0.00 175.02 173.71 2jmk s SER 78 N 1.38 -0.03 -0.04 3.03 0.01 -0.29 -0.13 113.70 117.64 2jmk s SER 78 Ca 0.05 0.14 0.05 0.00 1.31 0.00 0.00 55.95 57.50 2jmk s SER 78 Cb -0.13 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.17 2jmk s SER 78 CO -0.12 -0.09 -0.17 0.68 0.41 0.00 0.00 173.24 173.95 2jmk s VAL 79 N 0.69 1.42 -0.33 3.43 -7.23 0.65 -0.09 120.40 118.95 2jmk s VAL 79 Ca -0.05 -0.72 -0.01 0.00 -1.81 0.00 0.00 61.98 59.38 2jmk s VAL 79 Cb -0.08 -1.21 0.11 0.00 0.56 0.00 0.00 36.38 35.76 2jmk s VAL 79 CO -0.03 0.41 0.15 -0.44 -0.31 0.00 0.00 175.10 174.88 2jmk s SER 80 N -0.06 3.62 -0.15 4.85 0.01 0.76 -0.13 113.70 122.60 2jmk s SER 80 Ca -0.01 -1.74 -0.08 0.00 1.31 0.00 0.00 55.95 55.42 2jmk s SER 80 Cb -0.10 -0.63 -0.04 0.00 0.21 0.00 0.00 66.02 65.46 2jmk s SER 80 CO 0.02 -0.39 0.14 -0.36 0.41 0.00 0.00 173.24 173.06 2jmk s PHE 81 N 1.53 3.52 -0.13 2.43 0.40 -1.24 -0.52 117.98 123.96 2jmk s PHE 81 Ca 0.12 0.45 0.03 0.00 -0.60 0.00 0.00 56.93 56.92 2jmk s PHE 81 Cb -0.19 -2.04 0.01 0.00 0.51 0.00 0.00 43.02 41.31 2jmk s PHE 81 CO -0.21 0.54 -0.22 0.45 0.70 0.00 0.00 175.22 176.48 2jmk s SER 82 N -0.43 3.05 -0.31 1.36 0.15 0.61 -4.72 113.70 113.42 2jmk s SER 82 Ca 0.12 -0.58 -0.05 0.00 0.70 0.00 0.00 55.95 56.13 2jmk s SER 82 Cb -0.12 -1.41 0.01 0.00 -1.71 0.00 0.00 66.02 62.79 2jmk s SER 82 CO 0.01 0.09 0.21 0.47 1.20 0.00 0.00 173.24 175.22 2jmk n ASP 83 N 3.98 -7.18 -3.01 5.45 8.00 -1.26 -4.76 116.55 117.77 2jmk n ASP 83 Ca -0.20 0.93 -0.18 0.00 0.71 0.00 0.00 54.79 56.06 2jmk n ASP 83 Cb 0.52 -4.76 -0.07 0.00 -0.02 0.00 0.00 41.12 36.79 2jmk n ASP 83 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2jmk n ILE 84 N 0.24 0.00 -2.79 0.53 -5.35 -1.26 -5.12 119.36 105.60 2jmk n ILE 84 Ca 0.04 -2.10 -0.22 0.00 -0.27 0.00 0.00 62.75 60.20 2jmk n ILE 84 Cb 0.16 1.01 0.02 0.00 -1.74 0.00 0.00 39.64 39.09 2jmk n ILE 84 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 2jmk s ASP 85 N -3.04 5.54 0.14 7.28 1.01 -1.26 -4.98 116.67 121.36 2jmk s ASP 85 Ca 0.32 0.15 -0.05 0.00 0.71 0.00 0.00 52.55 53.68 2jmk s ASP 85 Cb 0.02 -1.21 -0.07 0.00 1.01 0.00 0.00 42.92 42.67 2jmk s ASP 85 CO 0.23 -0.93 1.33 1.05 0.21 0.00 0.00 175.17 177.06 2jmk h GLU 86 N 0.22 0.46 0.00 8.23 4.11 -2.02 -2.13 114.58 123.44 2jmk h GLU 86 Ca -0.44 -0.45 -0.13 0.00 0.07 0.00 0.00 59.36 58.41 2jmk h GLU 86 Cb 1.27 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 2jmk h GLU 86 CO 0.55 1.09 -0.62 -0.97 0.07 0.00 0.00 179.01 179.14 2jmk h ASN 87 N 0.28 0.00 0.07 3.06 -0.73 -2.01 -3.20 115.58 113.06 2jmk h ASN 87 Ca -0.07 0.00 -0.28 0.00 1.87 0.00 0.00 56.30 57.83 2jmk h ASN 87 Cb 1.50 0.00 0.03 0.00 0.27 0.00 0.00 38.32 40.11 2jmk h ASN 87 CO 0.16 0.62 -1.13 -0.03 -0.37 0.00 0.00 177.43 176.68 2jmk h MET 88 N 0.00 0.63 0.00 6.67 4.05 -1.95 -3.19 114.93 121.14 2jmk h MET 88 Ca -0.01 -0.78 -0.02 0.00 -0.28 0.00 0.00 59.70 58.61 2jmk h MET 88 Cb 1.43 0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 32.47 2jmk h MET 88 CO 0.08 1.34 -0.10 1.57 0.23 0.00 0.00 176.91 180.04 2jmk h LYS 89 N 0.27 0.00 0.29 0.39 2.10 -1.45 -0.90 116.57 117.27 2jmk h LYS 89 Ca -0.16 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.47 2jmk h LYS 89 Cb 1.80 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.13 2jmk h LYS 89 CO 0.22 0.10 -0.14 -0.22 -2.00 0.00 0.00 179.45 177.41 2jmk h LYS 90 N 0.00 -0.37 -0.65 0.07 1.63 -1.55 -0.00 116.57 115.69 2jmk h LYS 90 Ca -0.00 0.03 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 2jmk h LYS 90 Cb 0.25 0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.93 2jmk h LYS 90 CO 0.01 -0.03 0.21 -0.24 -3.45 0.00 0.00 179.45 175.95 2jmk h VAL 91 N -0.89 1.24 -0.35 2.00 3.04 -1.52 -0.88 116.25 118.90 2jmk h VAL 91 Ca -0.04 -0.83 -0.09 0.00 -1.01 0.00 0.00 66.70 64.73 2jmk h VAL 91 Cb 0.51 0.52 -0.01 0.00 -2.01 0.00 0.00 31.29 30.30 2jmk h VAL 91 CO 0.06 0.32 -0.13 0.40 -1.01 0.00 0.00 177.57 177.21 2jmk h ILE 92 N 0.96 1.28 -0.59 3.17 2.04 -1.23 -0.82 117.51 122.33 2jmk h ILE 92 Ca 0.21 -1.23 -0.08 0.00 1.00 0.00 0.00 64.86 64.76 2jmk h ILE 92 Cb 0.27 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 2jmk h ILE 92 CO -0.01 0.40 0.03 0.50 0.00 0.00 0.00 178.15 179.08 2jmk h LYS 93 N 0.48 1.00 -0.10 2.37 3.64 -0.78 -1.03 116.57 122.15 2jmk h LYS 93 Ca 0.08 -0.29 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 2jmk h LYS 93 Cb 0.66 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2jmk h LYS 93 CO 0.04 0.96 -0.06 0.00 -2.27 0.00 0.00 179.45 178.13 2jmk h ALA 94 N 1.10 0.14 -0.77 5.00 0.00 -1.09 -0.33 119.26 123.31 2jmk h ALA 94 Ca 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2jmk h ALA 94 Cb 0.49 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2jmk h ALA 94 CO 0.02 -0.08 0.45 1.15 0.00 0.00 0.00 179.25 180.79 2jmk h THR 95 N -0.16 1.22 -0.38 0.00 2.02 -1.09 0.24 112.91 114.77 2jmk h THR 95 Ca 0.02 -0.52 -0.16 0.00 0.77 0.00 0.00 66.41 66.52 2jmk h THR 95 Cb 0.52 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2jmk h THR 95 CO 0.02 0.24 -0.38 0.00 0.37 0.00 0.00 175.52 175.77 2jmk h ALA 96 N 1.24 0.61 -0.07 6.16 0.00 -1.18 -3.03 119.26 122.98 2jmk h ALA 96 Ca 0.28 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 2jmk h ALA 96 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2jmk h ALA 96 CO -0.05 0.68 -0.39 0.93 0.00 0.00 0.00 179.25 180.42 2jmk h GLU 97 N 0.75 0.15 -0.39 0.00 4.39 -0.72 -2.72 114.58 116.03 2jmk h GLU 97 Ca 0.06 -0.07 0.11 0.00 0.34 0.00 0.00 59.36 59.81 2jmk h GLU 97 Cb 0.96 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.59 2jmk h GLU 97 CO 0.09 0.52 0.38 -0.22 -1.16 0.00 0.00 179.01 178.62 2jmk h LYS 98 N 0.13 0.00 -0.13 2.33 1.63 -0.83 0.10 116.57 119.80 2jmk h LYS 98 Ca 0.01 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.85 2jmk h LYS 98 Cb 0.74 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.37 2jmk h LYS 98 CO 0.06 0.00 0.22 0.74 -3.45 0.00 0.00 179.45 177.02 2jmk h PHE 99 N 0.00 0.00 -1.00 1.91 -1.00 -1.58 -1.37 116.94 113.89 2jmk h PHE 99 Ca 0.19 0.00 0.29 0.00 2.81 0.00 0.00 57.97 61.25 2jmk h PHE 99 Cb 0.94 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.46 2jmk h PHE 99 CO 0.00 0.00 0.71 -0.22 -1.61 0.00 0.00 178.31 177.19 2jmk h LYS 100 N 0.00 0.05 -0.92 1.51 3.64 -0.83 0.35 116.57 120.37 2jmk h LYS 100 Ca 0.06 -0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.57 2jmk h LYS 100 Cb 0.51 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.24 2jmk h LYS 100 CO -0.00 0.03 0.59 -0.91 -2.27 0.00 0.00 179.45 176.89 2jmk h ASN 101 N 0.05 0.74 0.00 4.20 2.35 -1.47 -2.61 115.58 118.84 2jmk h ASN 101 Ca 0.49 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 56.24 2jmk h ASN 101 Cb 1.85 -0.11 -0.08 0.00 0.05 0.00 0.00 38.32 40.03 2jmk h ASN 101 CO -0.04 0.39 -0.49 1.17 -1.65 0.00 0.00 177.43 176.81 2jmk n LYS 102 N -4.58 0.95 -2.66 0.81 4.81 0.70 -4.92 118.16 113.28 2jmk n LYS 102 Ca 0.18 -2.52 -0.01 0.00 -0.87 0.00 0.00 58.31 55.08 2jmk n LYS 102 Cb 0.42 -1.08 0.03 0.00 0.02 0.00 0.00 35.03 34.41 2jmk n LYS 102 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2jmk s GLY 103 N -2.57 -1.91 0.53 3.14 0.00 0.90 -5.01 107.32 102.40 2jmk s GLY 103 Ca 0.30 1.05 0.31 0.00 0.00 0.00 0.00 44.72 46.38 2jmk s GLY 103 CO -0.06 4.45 1.88 0.27 0.00 0.00 0.00 173.10 179.64 2jmk h PHE 104 N 4.39 0.05 -0.57 1.90 -0.00 -1.79 -3.27 116.94 117.66 2jmk h PHE 104 Ca -0.03 0.00 -0.33 0.00 -0.00 0.00 0.00 57.97 57.61 2jmk h PHE 104 Cb 1.20 -0.01 -0.04 0.00 -0.00 0.00 0.00 35.95 37.09 2jmk h PHE 104 CO -0.13 0.01 0.99 0.21 -0.00 0.00 0.00 178.31 179.38 2jmk s LYS 105 N -5.01 2.56 -0.09 6.09 2.36 -1.26 -4.89 119.74 119.49 2jmk s LYS 105 Ca -0.05 -0.89 0.02 0.00 -2.55 0.00 0.00 55.97 52.50 2jmk s LYS 105 Cb 0.22 -5.19 0.01 0.00 -1.05 0.00 0.00 37.83 31.82 2jmk s LYS 105 CO 0.78 -3.72 -0.15 0.08 1.55 0.00 0.00 175.35 173.89 2jmk s VAL 106 N 10.49 1.40 0.03 4.02 1.01 -1.25 -0.29 120.40 135.82 2jmk s VAL 106 Ca 0.68 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2jmk s VAL 106 Cb -0.03 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 2jmk s VAL 106 CO 0.08 0.42 -0.10 -1.61 0.00 0.00 0.00 175.10 173.89 2jmk s GLU 107 N 0.87 0.65 0.01 2.72 2.02 0.82 -4.99 118.70 120.81 2jmk s GLU 107 Ca -0.09 -0.65 0.01 0.00 0.02 0.00 0.00 54.97 54.25 2jmk s GLU 107 Cb -0.15 -0.56 -0.01 0.00 0.10 0.00 0.00 34.13 33.50 2jmk s GLU 107 CO 0.01 0.13 -0.04 0.95 0.02 0.00 0.00 175.26 176.33 2jmk s THR 108 N -0.94 0.22 -0.15 3.63 -4.23 -1.26 -0.25 115.64 112.66 2jmk s THR 108 Ca -0.03 -0.56 -0.01 0.00 -1.18 0.00 0.00 61.69 59.90 2jmk s THR 108 Cb -0.08 -0.28 -0.01 0.00 1.34 0.00 0.00 72.50 73.48 2jmk s THR 108 CO 0.01 -0.22 -0.12 -0.62 -0.54 0.00 0.00 174.62 173.13 2jmk s ASP 109 N -0.83 4.02 0.00 3.99 2.15 0.82 -4.94 116.67 121.87 2jmk s ASP 109 Ca -0.07 -0.36 0.30 0.00 0.43 0.00 0.00 52.55 52.86 2jmk s ASP 109 Cb -0.06 -1.63 1.58 0.00 -0.30 0.00 0.00 42.92 42.51 2jmk s ASP 109 CO -0.00 0.12 2.04 0.80 -0.17 0.00 0.00 175.17 177.96