#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 3.66 -0.01 2.03 2.01 -1.26 -5.07 115.64 117.00 2jmk s THR 2 Ca 0.00 -0.49 0.08 0.00 0.31 0.00 0.00 61.69 61.59 2jmk s THR 2 Cb 0.00 -2.50 -0.02 0.00 0.01 0.00 0.00 72.50 69.99 2jmk s THR 2 CO 0.00 0.59 -0.25 -0.22 -0.69 0.00 0.00 174.62 174.05 2jmk s LEU 3 N -0.68 2.06 0.11 4.42 2.96 -1.26 -1.33 118.68 124.96 2jmk s LEU 3 Ca 0.10 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.48 2jmk s LEU 3 Cb -0.11 -1.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.30 2jmk s LEU 3 CO 0.02 0.30 0.19 0.00 -1.32 0.00 0.00 176.35 175.53 2jmk s ALA 5 N -3.91 2.41 -0.23 0.00 0.00 0.98 -0.57 121.76 120.44 2jmk s ALA 5 Ca 0.10 -1.26 -0.16 0.00 0.00 0.00 0.00 51.96 50.63 2jmk s ALA 5 Cb 0.05 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 2jmk s ALA 5 CO -0.07 0.55 0.43 -1.64 0.00 0.00 0.00 175.76 175.03 2jmk s MET 6 N -1.42 4.13 -0.31 0.00 -1.94 -0.31 -1.45 119.30 118.00 2jmk s MET 6 Ca 0.13 0.22 -0.03 0.00 -1.71 0.00 0.00 55.69 54.29 2jmk s MET 6 Cb -0.10 -3.58 0.04 0.00 2.01 0.00 0.00 34.83 33.20 2jmk s MET 6 CO 0.04 -0.15 0.03 -0.47 -0.01 0.00 0.00 175.02 174.45 2jmk s TYR 7 N 1.68 3.25 -0.29 -0.03 6.14 0.54 -0.22 117.35 128.41 2jmk s TYR 7 Ca 0.19 -1.70 -0.14 0.00 0.64 0.00 0.00 57.07 56.06 2jmk s TYR 7 Cb -0.15 -2.16 -0.04 0.00 0.42 0.00 0.00 41.96 40.04 2jmk s TYR 7 CO 0.09 -0.77 0.31 1.21 0.64 0.00 0.00 175.55 177.02 2jmk s ASN 8 N 1.31 6.16 -0.08 4.32 3.84 0.49 -0.09 114.94 130.89 2jmk s ASN 8 Ca -0.04 0.06 0.01 0.00 0.21 0.00 0.00 52.86 53.11 2jmk s ASN 8 Cb -0.19 -2.18 0.02 0.00 -0.55 0.00 0.00 41.25 38.35 2jmk s ASN 8 CO 0.00 -0.17 -0.10 -0.51 -2.79 0.00 0.00 177.10 173.53 2jmk s ILE 9 N 1.95 1.03 -0.35 -5.21 2.07 -0.49 -0.08 121.20 120.11 2jmk s ILE 9 Ca 0.11 -0.38 -0.00 0.00 -1.41 0.00 0.00 60.65 58.97 2jmk s ILE 9 Cb -0.16 -0.98 0.12 0.00 0.13 0.00 0.00 42.46 41.56 2jmk s ILE 9 CO 0.11 0.34 0.17 -0.55 -1.91 0.00 0.00 174.94 173.10 2jmk s SER 10 N 0.98 3.63 1.01 4.50 0.15 0.18 -0.14 113.70 124.01 2jmk s SER 10 Ca -0.09 -2.00 -0.12 0.00 0.70 0.00 0.00 55.95 54.44 2jmk s SER 10 Cb -0.15 -0.75 0.19 0.00 -1.71 0.00 0.00 66.02 63.61 2jmk s SER 10 CO 0.00 -0.35 1.08 -0.32 1.20 0.00 0.00 173.24 174.85 2jmk s MET 11 N 1.19 0.33 -0.59 5.44 1.75 -1.26 -0.35 119.30 125.81 2jmk s MET 11 Ca 0.14 0.99 -0.31 0.00 -1.25 0.00 0.00 55.69 55.27 2jmk s MET 11 Cb -0.20 -1.69 -0.13 0.00 2.84 0.00 0.00 34.83 35.65 2jmk s MET 11 CO -0.13 -2.92 2.42 0.00 -0.65 0.00 0.00 175.02 173.73 2jmk n ALA 12 N -4.38 0.75 -3.03 4.11 0.00 -1.26 -1.29 120.51 115.41 2jmk n ALA 12 Ca 0.07 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.93 2jmk n ALA 12 Cb 0.54 -2.71 0.06 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 6.34 -0.23 0.00 0.00 0.00 -1.26 -4.94 105.19 105.09 2jmk n GLY 13 Ca 0.47 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2jmk n GLY 13 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jmk n SER 14 N -2.62 0.39 -1.31 1.61 2.88 -0.42 -5.14 113.62 109.01 2jmk n SER 14 Ca -0.19 -1.17 0.16 0.00 -1.33 0.00 0.00 58.87 56.33 2jmk n SER 14 Cb 0.62 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.00 2jmk n SER 14 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2jmk n HIS 15 N -0.09 -3.52 -2.20 0.66 -0.00 -1.26 -4.74 115.22 104.07 2jmk n HIS 15 Ca 0.00 1.94 -0.42 0.00 -0.00 0.00 0.00 57.72 59.24 2jmk n HIS 15 Cb 0.40 -3.20 -0.03 0.00 -0.00 0.00 0.00 29.99 27.16 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 -4.12 4.32 -0.22 -0.41 0.04 -1.26 -4.33 135.00 129.02 2jmk s PRO 16 Ca 0.00 2.03 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 2jmk s PRO 16 Cb 0.00 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 31.24 2jmk s PRO 16 CO 0.00 -0.45 -0.09 0.99 0.04 0.00 0.00 177.00 177.50 2jmk s THR 17 N 1.33 2.86 -0.53 1.26 2.01 0.80 -4.96 115.64 118.42 2jmk s THR 17 Ca 0.64 -0.81 -0.24 0.00 0.31 0.00 0.00 61.69 61.59 2jmk s THR 17 Cb -0.35 -2.34 0.04 0.00 0.01 0.00 0.00 72.50 69.85 2jmk s THR 17 CO 0.30 0.36 0.90 -0.89 -0.69 0.00 0.00 174.62 174.60 2jmk s THR 18 N 1.37 4.46 -0.30 -0.82 2.01 -1.26 -1.40 115.64 119.70 2jmk s THR 18 Ca 0.03 0.30 -0.07 0.00 0.31 0.00 0.00 61.69 62.26 2jmk s THR 18 Cb -0.15 -4.48 0.01 0.00 0.01 0.00 0.00 72.50 67.89 2jmk s THR 18 CO -0.06 -1.01 0.09 -0.63 -0.69 0.00 0.00 174.62 172.31 2jmk s ILE 19 N 3.76 3.99 -0.18 1.82 1.01 0.88 -4.97 121.20 127.51 2jmk s ILE 19 Ca 0.30 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 60.02 2jmk s ILE 19 Cb -0.13 -3.07 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 2jmk s ILE 19 CO 0.20 0.06 0.67 0.00 0.00 0.00 0.00 174.94 175.87 2jmk s VAL 21 N 1.89 2.00 0.72 0.00 1.01 -0.53 -3.88 120.40 121.61 2jmk s VAL 21 Ca 0.31 -1.53 -0.14 0.00 0.00 0.00 0.00 61.98 60.62 2jmk s VAL 21 Cb -0.16 -1.76 0.03 0.00 0.00 0.00 0.00 36.38 34.49 2jmk s VAL 21 CO 0.11 0.13 1.14 -0.69 0.00 0.00 0.00 175.10 175.79 2jmk s VAL 22 N -0.99 2.90 -0.16 2.92 1.01 -1.26 -0.01 120.40 124.81 2jmk s VAL 22 Ca 0.10 0.40 0.25 0.00 0.00 0.00 0.00 61.98 62.73 2jmk s VAL 22 Cb -0.10 -2.88 0.26 0.00 0.00 0.00 0.00 36.38 33.66 2jmk s VAL 22 CO 0.04 -0.28 1.76 0.00 0.00 0.00 0.00 175.10 176.62 2jmk h MET 23 N -0.38 0.00 -0.09 2.72 -0.00 -1.27 0.33 114.93 116.24 2jmk h MET 23 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.24 2jmk h MET 23 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.86 2jmk h MET 23 CO 0.51 0.00 0.00 -3.47 -0.00 0.00 0.00 176.91 173.95 2jmk n ASP 24 N -2.38 2.16 -0.00 -0.10 2.03 -1.26 -4.47 116.55 112.53 2jmk n ASP 24 Ca -0.01 -1.59 0.01 0.00 0.52 0.00 0.00 54.79 53.72 2jmk n ASP 24 Cb 0.10 -0.05 -0.01 0.00 -0.72 0.00 0.00 41.12 40.43 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 0.61 2.27 -0.31 -0.67 3.00 -0.04 -4.66 116.66 116.87 2jmk n ARG 25 Ca 0.08 -0.01 0.27 0.00 -0.00 0.00 0.00 57.85 58.18 2jmk n ARG 25 Cb 0.31 -0.87 0.59 0.00 0.00 0.00 0.00 32.46 32.50 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 0.42 0.34 -0.14 -0.00 -0.67 -0.24 116.94 116.65 2jmk h PHE 26 Ca 0.00 0.01 -0.02 0.00 -0.00 0.00 0.00 57.97 57.97 2jmk h PHE 26 Cb 0.05 -0.12 0.00 0.00 -0.00 0.00 0.00 35.95 35.89 2jmk h PHE 26 CO 0.00 0.04 -0.16 1.25 -0.00 0.00 0.00 178.31 179.44 2jmk h LEU 27 N 0.25 -0.38 -0.86 2.10 7.12 -1.85 -1.58 115.31 120.11 2jmk h LEU 27 Ca 0.57 -0.16 0.07 0.00 0.13 0.00 0.00 57.88 58.49 2jmk h LEU 27 Cb 1.73 0.10 -0.07 0.00 -0.53 0.00 0.00 40.66 41.89 2jmk h LEU 27 CO -0.19 -0.02 0.53 -0.08 -0.13 0.00 0.00 178.44 178.55 2jmk h GLU 28 N -0.80 0.91 -0.11 1.25 4.57 -1.48 -0.80 114.58 118.13 2jmk h GLU 28 Ca -0.05 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2jmk h GLU 28 Cb 0.52 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 2jmk h GLU 28 CO 0.08 0.60 0.06 0.66 -1.18 0.00 0.00 179.01 179.23 2jmk h SER 29 N 0.93 0.14 -0.76 1.04 4.64 -1.09 -1.41 113.55 117.04 2jmk h SER 29 Ca 0.39 -0.08 0.01 0.00 -0.47 0.00 0.00 61.79 61.64 2jmk h SER 29 Cb 0.24 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.25 2jmk h SER 29 CO -0.20 0.18 0.50 0.15 -0.87 0.00 0.00 176.83 176.59 2jmk h PHE 30 N 0.08 0.94 -0.01 4.77 3.04 -0.76 0.11 116.94 125.12 2jmk h PHE 30 Ca 0.04 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.01 2jmk h PHE 30 Cb 0.07 -0.32 -0.00 0.00 2.56 0.00 0.00 35.95 38.26 2jmk h PHE 30 CO -0.04 0.58 0.00 1.03 -2.02 0.00 0.00 178.31 177.86 2jmk h SER 31 N 1.01 0.01 0.34 0.41 0.87 -0.93 -1.36 113.55 113.90 2jmk h SER 31 Ca 0.28 -0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.75 2jmk h SER 31 Cb -0.09 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 2jmk h SER 31 CO -0.07 0.03 -0.33 -0.33 -0.53 0.00 0.00 176.83 175.60 2jmk h GLU 32 N -0.01 0.00 -0.23 2.24 4.39 -1.00 -2.97 114.58 117.00 2jmk h GLU 32 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 2jmk h GLU 32 Cb 0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2jmk h GLU 32 CO -0.00 0.33 0.00 1.25 -1.16 0.00 0.00 179.01 179.43 2jmk h LEU 33 N 0.00 0.39 -2.53 1.33 7.12 -0.30 -1.19 115.31 120.13 2jmk h LEU 33 Ca -0.00 -0.31 0.01 0.00 0.13 0.00 0.00 57.88 57.71 2jmk h LEU 33 Cb 0.58 -0.11 -0.00 0.00 -0.53 0.00 0.00 40.66 40.61 2jmk h LEU 33 CO 0.04 0.61 0.13 0.22 -0.13 0.00 0.00 178.44 179.31 2jmk h TYR 34 N 0.17 0.00 0.00 1.25 3.20 -1.10 0.18 116.97 120.68 2jmk h TYR 34 Ca 0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2jmk h TYR 34 Cb 0.40 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2jmk h TYR 34 CO 0.03 0.00 -0.37 -0.44 -1.64 0.00 0.00 178.16 175.74 2jmk h ASP 35 N 0.00 0.00 -0.80 -2.11 5.19 -1.45 -3.37 116.42 113.88 2jmk h ASP 35 Ca 0.02 0.00 0.12 0.00 -0.62 0.00 0.00 57.03 56.55 2jmk h ASP 35 Cb 0.28 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.73 2jmk h ASP 35 CO -0.00 0.64 0.52 -0.29 -3.12 0.00 0.00 179.24 176.99 2jmk h ILE 36 N -0.91 0.87 -0.55 0.35 2.10 -1.05 0.25 117.51 118.58 2jmk h ILE 36 Ca 0.00 -0.21 0.16 0.00 1.08 0.00 0.00 64.86 65.89 2jmk h ILE 36 Cb 0.37 0.20 -0.02 0.00 -1.09 0.00 0.00 36.82 36.28 2jmk h ILE 36 CO 0.00 0.11 0.44 -0.29 -1.08 0.00 0.00 178.15 177.33 2jmk h ILE 37 N 0.62 0.59 -0.14 2.19 6.09 -0.83 0.16 117.51 126.20 2jmk h ILE 37 Ca 0.38 0.00 -0.16 0.00 -1.37 0.00 0.00 64.86 63.71 2jmk h ILE 37 Cb 0.63 0.68 -0.01 0.00 0.47 0.00 0.00 36.82 38.60 2jmk h ILE 37 CO -0.15 0.00 -0.59 -0.78 -3.07 0.00 0.00 178.15 173.56 2jmk h ASP 38 N 0.00 0.52 -3.65 2.19 3.58 -1.10 -3.45 116.42 114.51 2jmk h ASP 38 Ca 0.26 -0.29 -0.29 0.00 0.42 0.00 0.00 57.03 57.13 2jmk h ASP 38 Cb 1.13 -0.15 0.10 0.00 1.72 0.00 0.00 39.33 42.13 2jmk h ASP 38 CO -0.00 0.99 0.22 -0.62 -2.88 0.00 0.00 179.24 176.95 2jmk n GLU 39 N -3.92 -0.58 -1.07 0.28 -0.58 0.57 -5.03 120.64 110.31 2jmk n GLU 39 Ca -0.03 -1.48 0.05 0.00 -0.42 0.00 0.00 57.16 55.28 2jmk n GLU 39 Cb 0.62 -0.77 0.10 0.00 -0.57 0.00 0.00 31.44 30.82 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 -3.39 1.30 -4.59 1.62 3.02 -1.26 -5.00 115.26 106.95 2jmk n ASN 40 Ca 0.11 -2.82 -0.42 0.00 -0.03 0.00 0.00 54.58 51.42 2jmk n ASN 40 Cb 0.38 -0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 2jmk n ASN 40 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2jmk s ASP 41 N -2.51 5.89 -0.14 6.41 1.01 -1.26 -4.87 116.67 121.20 2jmk s ASP 41 Ca 0.35 1.13 -0.13 0.00 0.71 0.00 0.00 52.55 54.60 2jmk s ASP 41 Cb 0.37 -2.53 -0.11 0.00 1.01 0.00 0.00 42.92 41.67 2jmk s ASP 41 CO -0.12 -1.74 0.16 0.74 0.21 0.00 0.00 175.17 174.43 2jmk h THR 42 N 6.76 0.59 -0.14 -1.27 2.02 -2.00 -3.13 112.91 115.75 2jmk h THR 42 Ca -0.32 -1.55 0.04 0.00 0.77 0.00 0.00 66.41 65.35 2jmk h THR 42 Cb 1.16 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 2jmk h THR 42 CO 1.06 0.20 0.16 -0.78 0.37 0.00 0.00 175.52 176.53 2jmk h ASP 43 N -1.00 0.00 1.62 4.18 3.58 -2.04 0.20 116.42 122.96 2jmk h ASP 43 Ca -0.08 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 2jmk h ASP 43 Cb 0.64 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.69 2jmk h ASP 43 CO -0.05 0.00 -0.38 0.58 -2.88 0.00 0.00 179.24 176.51 2jmk h VAL 44 N 0.00 0.05 -0.22 2.25 2.07 -1.97 -3.35 116.25 115.08 2jmk h VAL 44 Ca 0.06 -1.08 0.06 0.00 0.82 0.00 0.00 66.70 66.56 2jmk h VAL 44 Cb 0.39 1.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.96 2jmk h VAL 44 CO -0.00 0.03 -0.18 -0.03 0.02 0.00 0.00 177.57 177.41 2jmk h MET 45 N 0.00 -0.17 -0.98 1.57 1.85 -0.52 -0.99 114.93 115.70 2jmk h MET 45 Ca -0.00 0.01 0.09 0.00 -0.61 0.00 0.00 59.70 59.19 2jmk h MET 45 Cb 1.03 0.04 -0.07 0.00 0.43 0.00 0.00 31.60 33.03 2jmk h MET 45 CO 0.00 -0.11 0.62 0.00 -0.40 0.00 0.00 176.91 177.02 2jmk h MET 46 N -0.17 1.03 -0.68 0.39 -0.00 -1.69 -0.55 114.93 113.25 2jmk h MET 46 Ca 0.13 -0.06 -0.01 0.00 -0.00 0.00 0.00 59.70 59.76 2jmk h MET 46 Cb 0.37 -0.23 -0.03 0.00 -0.00 0.00 0.00 31.60 31.71 2jmk h MET 46 CO -0.33 0.68 0.38 0.22 -0.00 0.00 0.00 176.91 177.86 2jmk h ASP 47 N 1.06 0.85 -0.08 -0.10 3.58 -1.41 -1.10 116.42 119.22 2jmk h ASP 47 Ca 0.45 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.80 2jmk h ASP 47 Cb 0.31 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.14 2jmk h ASP 47 CO -0.21 0.69 -0.00 0.15 -2.88 0.00 0.00 179.24 176.98 2jmk h PHE 48 N 0.93 0.16 -0.43 0.28 3.57 -0.23 0.25 116.94 121.47 2jmk h PHE 48 Ca 0.24 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.77 2jmk h PHE 48 Cb 0.03 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 2jmk h PHE 48 CO -0.01 0.42 0.15 0.82 -2.23 0.00 0.00 178.31 177.47 2jmk h ILE 49 N -0.15 0.87 0.00 1.41 2.04 -0.99 -0.86 117.51 119.82 2jmk h ILE 49 Ca 0.02 -0.11 -0.11 0.00 1.00 0.00 0.00 64.86 65.67 2jmk h ILE 49 Cb 0.36 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2jmk h ILE 49 CO 0.00 0.06 -0.50 -1.28 0.00 0.00 0.00 178.15 176.43 2jmk h SER 50 N 0.32 0.00 -0.14 1.72 0.87 -1.17 0.25 113.55 115.40 2jmk h SER 50 Ca 0.20 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 2jmk h SER 50 Cb 0.19 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.14 2jmk h SER 50 CO -0.20 0.50 0.01 -0.09 -0.53 0.00 0.00 176.83 176.52 2jmk h ARG 51 N 0.00 0.23 0.00 2.24 9.65 0.50 -3.37 114.38 123.64 2jmk h ARG 51 Ca -0.01 -0.07 -0.08 0.00 -1.10 0.00 0.00 59.98 58.73 2jmk h ARG 51 Cb 1.08 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.62 2jmk h ARG 51 CO 0.07 0.44 -0.66 0.74 2.80 0.00 0.00 179.97 183.35 2jmk h PHE 52 N -0.01 0.00 -4.13 2.20 0.04 -1.21 -3.47 116.94 110.35 2jmk h PHE 52 Ca 0.04 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.33 2jmk h PHE 52 Cb 0.32 0.00 0.04 0.00 2.20 0.00 0.00 35.95 38.51 2jmk h PHE 52 CO 0.02 0.59 0.38 0.00 -0.60 0.00 0.00 178.31 178.71 2jmk s ALA 53 N -2.54 2.82 0.01 2.45 0.00 0.87 -4.86 121.76 120.52 2jmk s ALA 53 Ca -0.18 0.50 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 2jmk s ALA 53 Cb 0.03 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 2jmk s ALA 53 CO 0.36 -0.52 0.13 0.50 0.00 0.00 0.00 175.76 176.22 2jmk s ARG 54 N -3.64 3.20 -1.14 0.00 3.52 -1.26 -4.32 118.95 115.31 2jmk s ARG 54 Ca 0.65 -0.46 -0.09 0.00 -0.13 0.00 0.00 55.73 55.70 2jmk s ARG 54 Cb -0.16 -2.93 0.26 0.00 -1.56 0.00 0.00 34.95 30.56 2jmk s ARG 54 CO 0.28 0.64 1.28 0.25 -0.81 0.00 0.00 175.30 176.93 2jmk n THR 55 N 0.89 4.63 -3.87 4.11 -2.24 -1.26 -4.96 114.28 111.58 2jmk n THR 55 Ca -0.11 -5.30 -0.08 0.00 -2.27 0.00 0.00 64.05 56.29 2jmk n THR 55 Cb 0.52 -2.47 -0.03 0.00 -2.10 0.00 0.00 70.33 66.25 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 1.08 -0.22 0.67 3.42 1.01 -1.26 -5.16 116.67 116.22 2jmk s ASP 56 Ca 0.34 -0.67 -0.17 0.00 0.71 0.00 0.00 52.55 52.76 2jmk s ASP 56 Cb -0.05 0.66 0.00 0.00 1.01 0.00 0.00 42.92 44.54 2jmk s ASP 56 CO -0.03 -1.23 1.23 -1.61 0.21 0.00 0.00 175.17 173.74 2jmk s GLU 57 N -3.94 2.48 -0.31 8.23 8.01 -1.26 -5.01 118.70 126.91 2jmk s GLU 57 Ca 0.14 1.87 -0.02 0.00 0.01 0.00 0.00 54.97 56.97 2jmk s GLU 57 Cb -0.04 -1.86 0.05 0.00 -4.31 0.00 0.00 34.13 27.97 2jmk s GLU 57 CO 0.06 -1.60 0.01 0.42 0.01 0.00 0.00 175.26 174.16 2jmk s ILE 58 N -1.71 3.03 0.75 -1.63 1.01 -1.26 -5.11 121.20 116.30 2jmk s ILE 58 Ca 0.78 -1.40 -0.11 0.00 0.00 0.00 0.00 60.65 59.92 2jmk s ILE 58 Cb -0.32 -2.76 0.04 0.00 0.01 0.00 0.00 42.46 39.43 2jmk s ILE 58 CO 0.40 -0.14 1.08 -0.04 0.00 0.00 0.00 174.94 176.25 2jmk s MET 59 N 1.25 2.42 0.34 2.79 -1.94 -1.26 -4.96 119.30 117.95 2jmk s MET 59 Ca -0.04 1.05 0.13 0.00 -1.71 0.00 0.00 55.69 55.12 2jmk s MET 59 Cb -0.20 -1.92 0.60 0.00 2.01 0.00 0.00 34.83 35.32 2jmk s MET 59 CO -0.01 -1.49 1.74 -1.00 -0.01 0.00 0.00 175.02 174.25 2jmk h PRO 60 N -1.01 0.00 -0.83 2.03 0.13 -2.02 -3.02 132.00 127.28 2jmk h PRO 60 Ca -0.44 0.00 0.24 0.00 -0.87 0.00 0.00 66.00 64.93 2jmk h PRO 60 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 2jmk h PRO 60 CO 0.54 0.46 0.60 0.93 -0.23 0.00 0.00 178.00 180.29 2jmk h GLU 61 N 0.00 0.00 -6.37 0.86 4.39 -1.94 -3.40 114.58 108.12 2jmk h GLU 61 Ca -0.00 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.15 2jmk h GLU 61 Cb 0.84 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2jmk h GLU 61 CO 0.06 0.00 0.90 -0.51 -1.16 0.00 0.00 179.01 178.30 2jmk s ASP 62 N -5.72 6.78 0.05 1.42 1.11 -1.14 -4.20 116.67 114.97 2jmk s ASP 62 Ca -0.05 2.19 0.02 0.00 0.18 0.00 0.00 52.55 54.89 2jmk s ASP 62 Cb 0.21 -2.56 -0.04 0.00 1.07 0.00 0.00 42.92 41.60 2jmk s ASP 62 CO 0.76 -0.78 0.07 -0.75 1.18 0.00 0.00 175.17 175.65 2jmk s LYS 63 N 2.66 2.90 0.16 8.23 2.20 -0.44 -4.95 119.74 130.49 2jmk s LYS 63 Ca 0.66 -0.64 -0.26 0.00 -0.36 0.00 0.00 55.97 55.38 2jmk s LYS 63 Cb -0.33 -2.74 -0.08 0.00 -1.51 0.00 0.00 37.83 33.17 2jmk s LYS 63 CO 0.27 0.59 0.80 0.99 -0.36 0.00 0.00 175.35 177.65 2jmk s THR 64 N -1.30 4.39 -0.97 3.43 2.01 -1.26 -1.00 115.64 120.93 2jmk s THR 64 Ca 0.26 1.75 0.11 0.00 0.31 0.00 0.00 61.69 64.13 2jmk s THR 64 Cb -0.12 -4.16 -0.02 0.00 0.01 0.00 0.00 72.50 68.21 2jmk s THR 64 CO 0.18 0.49 0.65 0.55 -0.69 0.00 0.00 174.62 175.81 2jmk n VAL 65 N 1.79 0.00 0.00 3.82 3.14 0.26 -4.88 118.33 122.46 2jmk n VAL 65 Ca -0.05 -0.36 0.00 0.00 -2.96 0.00 0.00 64.34 60.97 2jmk n VAL 65 Cb 0.49 1.12 0.00 0.00 -1.06 0.00 0.00 33.84 34.38 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 0.99 3.04 3.05 7.55 0.00 -1.26 -0.98 105.19 117.57 2jmk n GLY 66 Ca 0.04 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 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 2.33 -0.15 1.61 0.08 0.47 -1.16 117.98 119.16 2jmk s PHE 67 Ca 0.00 -1.32 -0.08 0.00 0.12 0.00 0.00 56.93 55.65 2jmk s PHE 67 Cb 0.00 -1.68 -0.04 0.00 -0.57 0.00 0.00 43.02 40.73 2jmk s PHE 67 CO 0.00 -0.70 0.12 0.08 -0.10 0.00 0.00 175.22 174.63 2jmk s VAL 68 N 1.40 5.36 -0.22 -0.44 1.01 0.69 -0.10 120.40 128.10 2jmk s VAL 68 Ca 0.04 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.20 2jmk s VAL 68 Cb -0.13 -3.37 0.04 0.00 0.00 0.00 0.00 36.38 32.92 2jmk s VAL 68 CO -0.11 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 174.71 2jmk s VAL 69 N -0.50 2.04 -0.24 2.92 1.01 0.91 -0.38 120.40 126.16 2jmk s VAL 69 Ca 0.12 -1.24 0.01 0.00 0.00 0.00 0.00 61.98 60.87 2jmk s VAL 69 Cb -0.12 -2.01 0.06 0.00 0.00 0.00 0.00 36.38 34.32 2jmk s VAL 69 CO 0.02 0.25 -0.06 -0.69 0.00 0.00 0.00 175.10 174.62 2jmk s VAL 70 N 1.23 1.58 -0.28 2.92 1.01 0.88 -1.43 120.40 126.31 2jmk s VAL 70 Ca -0.02 -1.26 -0.01 0.00 0.00 0.00 0.00 61.98 60.69 2jmk s VAL 70 Cb -0.16 -1.84 0.04 0.00 0.00 0.00 0.00 36.38 34.42 2jmk s VAL 70 CO -0.09 -0.10 -0.04 0.20 0.00 0.00 0.00 175.10 175.06 2jmk s ASN 71 N 1.37 4.61 0.07 3.32 0.01 -0.54 -0.64 114.94 123.13 2jmk s ASN 71 Ca -0.06 -1.16 -0.10 0.00 -0.71 0.00 0.00 52.86 50.84 2jmk s ASN 71 Cb -0.19 -1.67 -0.26 0.00 0.41 0.00 0.00 41.25 39.54 2jmk s ASN 71 CO -0.06 -0.20 1.14 0.00 -1.51 0.00 0.00 177.10 176.46 2jmk h ALA 72 N 7.96 0.07 -0.34 0.60 0.00 -0.97 0.35 119.26 126.93 2jmk h ALA 72 Ca -0.25 -0.81 0.07 0.00 0.00 0.00 0.00 54.91 53.93 2jmk h ALA 72 Cb 1.07 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.86 2jmk h ALA 72 CO 0.54 0.79 -0.15 0.22 0.00 0.00 0.00 179.25 180.65 2jmk h ASP 73 N 0.19 -0.52 0.02 0.00 3.58 -1.78 -2.12 116.42 115.79 2jmk h ASP 73 Ca -0.16 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.41 2jmk h ASP 73 Cb 1.91 0.29 0.00 0.00 1.72 0.00 0.00 39.33 43.25 2jmk h ASP 73 CO 0.22 -0.19 -0.47 0.29 -2.88 0.00 0.00 179.24 176.21 2jmk n LYS 74 N -5.33 1.11 -3.55 0.28 5.02 -1.25 -4.98 118.16 109.46 2jmk n LYS 74 Ca 0.01 -0.89 -0.21 0.00 -2.02 0.00 0.00 58.31 55.20 2jmk n LYS 74 Cb 0.25 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 33.86 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 -0.17 -7.33 -4.04 1.97 5.02 0.92 -4.99 118.16 109.55 2jmk n LYS 75 Ca 0.09 0.82 -0.35 0.00 -2.02 0.00 0.00 58.31 56.86 2jmk n LYS 75 Cb 0.45 -5.85 -0.09 0.00 -0.02 0.00 0.00 35.03 29.52 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 -6.94 3.93 -0.23 -0.35 1.43 0.49 -4.63 118.68 112.39 2jmk s LEU 76 Ca 0.35 0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.67 2jmk s LEU 76 Cb -0.16 -1.97 0.05 0.00 0.03 0.00 0.00 46.19 44.15 2jmk s LEU 76 CO 0.74 0.28 -0.11 -0.04 0.23 0.00 0.00 176.35 177.45 2jmk s MET 77 N -0.25 2.12 -0.25 1.70 -1.94 -0.58 -1.47 119.30 118.63 2jmk s MET 77 Ca 0.08 -1.06 -0.04 0.00 -1.71 0.00 0.00 55.69 52.97 2jmk s MET 77 Cb -0.12 -2.64 0.10 0.00 2.01 0.00 0.00 34.83 34.17 2jmk s MET 77 CO 0.01 -0.49 0.17 -1.12 -0.01 0.00 0.00 175.02 173.58 2jmk s SER 78 N 1.27 2.60 -0.09 3.03 0.01 -0.51 -0.12 113.70 119.89 2jmk s SER 78 Ca -0.04 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 56.34 2jmk s SER 78 Cb -0.18 -0.06 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 2jmk s SER 78 CO -0.07 -0.39 -0.08 0.68 0.41 0.00 0.00 173.24 173.79 2jmk s VAL 79 N 2.19 3.59 -0.41 3.43 -7.23 -0.48 -0.06 120.40 121.44 2jmk s VAL 79 Ca 0.07 -0.51 0.03 0.00 -1.81 0.00 0.00 61.98 59.76 2jmk s VAL 79 Cb -0.16 -2.48 0.11 0.00 0.56 0.00 0.00 36.38 34.42 2jmk s VAL 79 CO -0.26 0.57 0.14 -0.94 -0.31 0.00 0.00 175.10 174.30 2jmk s SER 80 N -0.50 4.71 -0.09 4.85 1.04 0.86 -0.53 113.70 124.04 2jmk s SER 80 Ca 0.07 -2.41 -0.11 0.00 0.48 0.00 0.00 55.95 53.98 2jmk s SER 80 Cb -0.12 -1.66 -0.05 0.00 0.10 0.00 0.00 66.02 64.29 2jmk s SER 80 CO 0.02 -0.35 0.25 -0.36 0.98 0.00 0.00 173.24 173.78 2jmk s PHE 81 N 0.56 3.61 0.34 5.02 0.40 -1.24 -0.40 117.98 126.26 2jmk s PHE 81 Ca 0.13 0.68 -0.05 0.00 -0.60 0.00 0.00 56.93 57.09 2jmk s PHE 81 Cb -0.21 -2.14 0.08 0.00 0.51 0.00 0.00 43.02 41.25 2jmk s PHE 81 CO -0.05 0.59 0.46 0.45 0.70 0.00 0.00 175.22 177.37 2jmk n SER 82 N 2.30 0.07 -4.49 1.36 2.88 -0.15 -3.54 113.62 112.05 2jmk n SER 82 Ca -0.16 -1.19 -0.46 0.00 -1.33 0.00 0.00 58.87 55.73 2jmk n SER 82 Cb 0.53 -0.35 -0.07 0.00 -0.75 0.00 0.00 64.21 63.58 2jmk n SER 82 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2jmk n ASP 83 N -3.27 2.12 -4.29 -3.46 2.03 -1.26 -4.83 116.55 103.59 2jmk n ASP 83 Ca 0.06 0.18 -0.29 0.00 0.52 0.00 0.00 54.79 55.26 2jmk n ASP 83 Cb 0.20 -1.33 -0.07 0.00 -0.72 0.00 0.00 41.12 39.20 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 8.56 0.68 0.57 5.18 -4.36 -1.26 -5.14 121.20 125.43 2jmk s ILE 84 Ca 1.09 -2.00 -0.18 0.00 -0.26 0.00 0.00 60.65 59.30 2jmk s ILE 84 Cb -0.70 -2.19 -0.05 0.00 1.25 0.00 0.00 42.46 40.78 2jmk s ILE 84 CO 0.43 0.00 1.11 -1.81 0.24 0.00 0.00 174.94 174.91 2jmk s ASP 85 N -3.73 5.63 0.15 4.36 1.01 -1.26 -4.89 116.67 117.95 2jmk s ASP 85 Ca 0.15 2.09 -0.13 0.00 0.71 0.00 0.00 52.55 55.36 2jmk s ASP 85 Cb 0.01 -2.57 0.03 0.00 1.01 0.00 0.00 42.92 41.41 2jmk s ASP 85 CO 0.10 -1.28 1.66 1.05 0.21 0.00 0.00 175.17 176.92 2jmk h GLU 86 N 0.90 0.82 -0.06 8.23 4.11 -1.99 -0.18 114.58 126.40 2jmk h GLU 86 Ca -0.49 -0.19 -0.00 0.00 0.07 0.00 0.00 59.36 58.74 2jmk h GLU 86 Cb 1.25 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 2jmk h GLU 86 CO 0.56 0.77 0.02 -0.97 0.07 0.00 0.00 179.01 179.47 2jmk h ASN 87 N 0.71 0.09 -0.53 3.06 -1.24 -2.00 -2.27 115.58 113.40 2jmk h ASN 87 Ca 0.16 -0.20 -0.01 0.00 0.71 0.00 0.00 56.30 56.97 2jmk h ASN 87 Cb 0.32 -0.02 -0.03 0.00 0.73 0.00 0.00 38.32 39.32 2jmk h ASN 87 CO -0.00 0.26 0.31 -0.03 -1.29 0.00 0.00 177.43 176.68 2jmk h MET 88 N -0.09 0.72 -0.84 6.67 4.05 -1.94 -2.37 114.93 121.14 2jmk h MET 88 Ca 0.02 -0.07 0.08 0.00 -0.28 0.00 0.00 59.70 59.45 2jmk h MET 88 Cb 0.20 -0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 30.80 2jmk h MET 88 CO -0.00 0.54 0.55 -0.22 0.23 0.00 0.00 176.91 178.01 2jmk h LYS 89 N 0.70 0.83 0.27 0.39 3.11 -0.94 -1.43 116.57 119.51 2jmk h LYS 89 Ca 0.19 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.96 2jmk h LYS 89 Cb 0.01 -0.19 0.00 0.00 -1.00 0.00 0.00 32.23 31.06 2jmk h LYS 89 CO -0.03 0.55 -0.13 0.87 -2.81 0.00 0.00 179.45 177.90 2jmk h LYS 90 N 0.86 -0.35 0.37 1.90 1.57 -0.89 0.13 116.57 120.16 2jmk h LYS 90 Ca 0.38 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.18 2jmk h LYS 90 Cb 0.34 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 2jmk h LYS 90 CO -0.15 -0.15 -0.34 0.28 -0.57 0.00 0.00 179.45 178.52 2jmk h VAL 91 N -0.48 0.30 -0.86 0.50 2.07 -1.17 0.12 116.25 116.74 2jmk h VAL 91 Ca -0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.55 2jmk h VAL 91 Cb 0.36 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 2jmk h VAL 91 CO 0.06 0.00 0.56 0.40 0.02 0.00 0.00 177.57 178.61 2jmk h ILE 92 N -0.72 1.05 -0.39 4.57 2.04 -1.29 -0.33 117.51 122.42 2jmk h ILE 92 Ca -0.03 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.43 2jmk h ILE 92 Cb 0.64 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2jmk h ILE 92 CO -0.04 0.17 -0.05 0.50 0.00 0.00 0.00 178.15 178.72 2jmk h LYS 93 N 0.95 0.66 -0.01 2.37 3.64 -0.23 -0.64 116.57 123.31 2jmk h LYS 93 Ca 0.37 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2jmk h LYS 93 Cb 0.23 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2jmk h LYS 93 CO -0.14 0.72 -0.02 0.00 -2.27 0.00 0.00 179.45 177.74 2jmk h ALA 94 N 1.33 0.01 -0.86 5.00 0.00 0.28 0.14 119.26 125.16 2jmk h ALA 94 Ca 0.12 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2jmk h ALA 94 Cb 0.47 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2jmk h ALA 94 CO 0.02 -0.16 0.52 1.15 0.00 0.00 0.00 179.25 180.78 2jmk h THR 95 N -0.59 1.24 -0.06 0.00 2.02 -1.06 -0.16 112.91 114.31 2jmk h THR 95 Ca -0.00 -0.51 -0.24 0.00 0.77 0.00 0.00 66.41 66.43 2jmk h THR 95 Cb 0.65 0.02 0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2jmk h THR 95 CO 0.00 0.25 -0.91 0.00 0.37 0.00 0.00 175.52 175.23 2jmk h ALA 96 N 1.39 0.29 -0.12 6.16 0.00 -1.16 -3.21 119.26 122.61 2jmk h ALA 96 Ca 0.31 -0.66 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 2jmk h ALA 96 Cb -0.06 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2jmk h ALA 96 CO -0.06 0.72 -0.27 1.49 0.00 0.00 0.00 179.25 181.14 2jmk h GLU 97 N 0.39 0.22 -0.38 0.00 4.81 -0.59 -2.54 114.58 116.49 2jmk h GLU 97 Ca -0.09 -0.07 0.11 0.00 -0.13 0.00 0.00 59.36 59.18 2jmk h GLU 97 Cb 1.54 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.89 2jmk h GLU 97 CO 0.17 0.47 0.37 0.87 -0.73 0.00 0.00 179.01 180.16 2jmk h LYS 98 N 0.20 0.00 -0.13 1.92 1.79 -1.03 0.92 116.57 120.24 2jmk h LYS 98 Ca 0.03 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.54 2jmk h LYS 98 Cb 0.58 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.22 2jmk h LYS 98 CO 0.04 0.00 0.23 0.74 -1.08 0.00 0.00 179.45 179.38 2jmk h PHE 99 N 0.00 0.00 -1.11 -1.35 -1.00 -1.59 -1.55 116.94 110.34 2jmk h PHE 99 Ca 0.18 0.00 0.31 0.00 2.81 0.00 0.00 57.97 61.28 2jmk h PHE 99 Cb 0.91 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 40.42 2jmk h PHE 99 CO 0.00 0.00 0.78 -0.22 -1.61 0.00 0.00 178.31 177.26 2jmk h LYS 100 N 0.00 0.10 -0.98 1.51 3.64 -0.90 0.37 116.57 120.30 2jmk h LYS 100 Ca 0.06 -0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.60 2jmk h LYS 100 Cb 0.53 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.23 2jmk h LYS 100 CO -0.00 0.07 0.62 -0.91 -2.27 0.00 0.00 179.45 176.95 2jmk h ASN 101 N 0.11 0.79 0.00 4.20 2.35 -1.51 -2.51 115.58 119.00 2jmk h ASN 101 Ca 0.56 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 56.34 2jmk h ASN 101 Cb 2.00 -0.08 -0.09 0.00 0.05 0.00 0.00 38.32 40.20 2jmk h ASN 101 CO -0.09 0.35 -0.50 1.17 -1.65 0.00 0.00 177.43 176.71 2jmk n LYS 102 N -4.67 0.95 -2.78 0.81 3.00 0.82 -4.91 118.16 111.37 2jmk n LYS 102 Ca 0.21 -2.53 -0.02 0.00 -0.00 0.00 0.00 58.31 55.96 2jmk n LYS 102 Cb 0.49 -1.08 0.02 0.00 0.00 0.00 0.00 35.03 34.46 2jmk n LYS 102 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2jmk s GLY 103 N -2.58 -1.55 0.65 3.14 0.00 0.93 -4.96 107.32 102.95 2jmk s GLY 103 Ca 0.31 0.25 0.35 0.00 0.00 0.00 0.00 44.72 45.62 2jmk s GLY 103 CO -0.06 3.99 2.13 0.27 0.00 0.00 0.00 173.10 179.43 2jmk h PHE 104 N 5.00 0.00 -2.33 1.90 -5.15 -1.82 -3.14 116.94 111.40 2jmk h PHE 104 Ca 0.02 0.00 -0.79 0.00 -0.20 0.00 0.00 57.97 57.00 2jmk h PHE 104 Cb 1.16 0.00 -0.23 0.00 0.22 0.00 0.00 35.95 37.09 2jmk h PHE 104 CO 0.01 0.00 1.26 0.36 -2.00 0.00 0.00 178.31 177.94 2jmk n LYS 105 N -3.22 4.15 -5.22 6.09 0.00 -1.26 -4.97 118.16 113.73 2jmk n LYS 105 Ca -0.01 -4.16 -0.31 0.00 -0.00 0.00 0.00 58.31 53.83 2jmk n LYS 105 Cb 0.26 -2.67 -0.16 0.00 -0.00 0.00 0.00 35.03 32.46 2jmk n LYS 105 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2jmk s VAL 106 N -1.57 1.99 -0.02 0.58 0.11 -1.19 -1.53 120.40 118.78 2jmk s VAL 106 Ca 0.34 -1.03 -0.09 0.00 -2.93 0.00 0.00 61.98 58.28 2jmk s VAL 106 Cb 0.07 -1.69 0.01 0.00 -1.53 0.00 0.00 36.38 33.24 2jmk s VAL 106 CO 0.07 0.55 0.19 -0.70 -3.33 0.00 0.00 175.10 171.88 2jmk s GLU 107 N -0.12 0.46 0.00 1.54 2.56 0.83 -5.00 118.70 118.97 2jmk s GLU 107 Ca -0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 54.97 54.76 2jmk s GLU 107 Cb -0.14 0.20 -0.00 0.00 2.00 0.00 0.00 34.13 36.19 2jmk s GLU 107 CO 0.04 -0.10 0.00 0.95 -0.56 0.00 0.00 175.26 175.58 2jmk s THR 108 N -0.96 0.03 0.32 -1.70 -4.23 -1.26 -1.38 115.64 106.46 2jmk s THR 108 Ca -0.10 -0.23 0.05 0.00 -1.18 0.00 0.00 61.69 60.23 2jmk s THR 108 Cb -0.05 -0.09 -0.01 0.00 1.34 0.00 0.00 72.50 73.68 2jmk s THR 108 CO 0.02 -0.13 0.47 -0.62 -0.54 0.00 0.00 174.62 173.82 2jmk s ASP 109 N -0.37 6.06 0.00 3.99 2.15 0.31 -4.97 116.67 123.84 2jmk s ASP 109 Ca -0.04 -0.04 0.00 0.00 0.43 0.00 0.00 52.55 52.90 2jmk s ASP 109 Cb -0.03 -1.46 0.00 0.00 -0.30 0.00 0.00 42.92 41.14 2jmk s ASP 109 CO -0.00 -0.37 0.30 0.80 -0.17 0.00 0.00 175.17 175.74