#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 5.24 -0.15 3.17 2.01 -1.26 -4.99 115.64 119.67 2jmk s THR 2 Ca 0.00 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.02 2jmk s THR 2 Cb 0.00 -3.61 0.03 0.00 0.01 0.00 0.00 72.50 68.93 2jmk s THR 2 CO 0.00 0.17 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.22 2jmk s LEU 3 N -2.33 1.62 0.31 4.42 2.01 -1.26 -0.67 118.68 122.77 2jmk s LEU 3 Ca 0.36 -0.50 0.10 0.00 0.01 0.00 0.00 54.13 54.09 2jmk s LEU 3 Cb -0.13 -1.07 -0.05 0.00 0.01 0.00 0.00 46.19 44.95 2jmk s LEU 3 CO 0.22 -0.09 -0.04 0.00 1.01 0.00 0.00 176.35 177.45 2jmk s ALA 5 N -2.46 1.79 -0.22 0.00 0.00 0.90 -0.06 121.76 121.70 2jmk s ALA 5 Ca 0.33 -1.31 -0.06 0.00 0.00 0.00 0.00 51.96 50.92 2jmk s ALA 5 Cb -0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 2jmk s ALA 5 CO 0.19 0.28 0.02 -1.64 0.00 0.00 0.00 175.76 174.61 2jmk s MET 6 N -2.25 3.60 0.01 0.00 -1.94 -0.43 -1.50 119.30 116.79 2jmk s MET 6 Ca 0.09 -0.52 0.01 0.00 -1.71 0.00 0.00 55.69 53.56 2jmk s MET 6 Cb -0.08 -3.17 -0.04 0.00 2.01 0.00 0.00 34.83 33.55 2jmk s MET 6 CO 0.05 -0.10 0.05 -0.47 -0.01 0.00 0.00 175.02 174.54 2jmk s TYR 7 N 1.31 3.20 -0.39 -0.03 6.14 0.19 -1.10 117.35 126.68 2jmk s TYR 7 Ca 0.04 0.15 0.01 0.00 0.64 0.00 0.00 57.07 57.91 2jmk s TYR 7 Cb -0.15 -1.70 0.13 0.00 0.42 0.00 0.00 41.96 40.66 2jmk s TYR 7 CO 0.02 0.52 0.19 1.21 0.64 0.00 0.00 175.55 178.13 2jmk s ASN 8 N -1.78 3.65 -0.18 4.32 2.47 0.03 -0.05 114.94 123.40 2jmk s ASN 8 Ca 0.23 -2.27 -0.08 0.00 0.42 0.00 0.00 52.86 51.16 2jmk s ASN 8 Cb -0.12 -0.89 -0.04 0.00 -1.45 0.00 0.00 41.25 38.75 2jmk s ASN 8 CO 0.14 -0.32 0.08 -0.51 -3.72 0.00 0.00 177.10 172.77 2jmk s ILE 9 N 0.83 4.98 -0.38 -5.21 2.07 -0.18 -0.07 121.20 123.25 2jmk s ILE 9 Ca 0.15 0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.43 2jmk s ILE 9 Cb -0.22 -3.24 0.13 0.00 0.13 0.00 0.00 42.46 39.25 2jmk s ILE 9 CO -0.07 0.47 0.19 -0.44 -1.91 0.00 0.00 174.94 173.18 2jmk s SER 10 N 0.24 3.60 1.06 4.50 0.01 0.48 -0.09 113.70 123.51 2jmk s SER 10 Ca 0.05 -2.21 -0.17 0.00 1.31 0.00 0.00 55.95 54.94 2jmk s SER 10 Cb -0.12 -0.82 0.09 0.00 0.21 0.00 0.00 66.02 65.37 2jmk s SER 10 CO -0.00 -0.32 0.16 0.80 0.41 0.00 0.00 173.24 174.29 2jmk n MET 11 N 4.07 -1.18 -1.64 12.44 1.56 -1.26 -0.22 117.12 130.89 2jmk n MET 11 Ca 0.06 -0.32 -0.48 0.00 -0.27 0.00 0.00 57.70 56.70 2jmk n MET 11 Cb 0.37 -1.76 -0.05 0.00 2.15 0.00 0.00 33.22 33.93 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 -4.16 1.07 -3.14 -5.12 0.00 -1.26 -2.13 120.51 105.77 2jmk n ALA 12 Ca 0.03 0.16 -0.14 0.00 0.00 0.00 0.00 53.44 53.49 2jmk n ALA 12 Cb 0.59 -2.58 0.07 0.00 0.00 0.00 0.00 19.45 17.53 2jmk n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jmk n GLY 13 N 4.90 -0.47 3.38 0.00 0.00 -1.26 -4.88 105.19 106.86 2jmk n GLY 13 Ca 0.26 0.18 -0.13 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.86 -0.50 0.96 1.61 0.15 -0.91 -5.12 113.70 106.03 2jmk s SER 14 Ca 0.14 0.96 -0.13 0.00 0.70 0.00 0.00 55.95 57.62 2jmk s SER 14 Cb -0.02 0.97 0.04 0.00 -1.71 0.00 0.00 66.02 65.30 2jmk s SER 14 CO 0.63 -0.18 0.36 1.41 1.20 0.00 0.00 173.24 176.66 2jmk n HIS 15 N 2.76 -1.52 -2.19 3.44 8.25 -1.26 -4.37 115.22 120.33 2jmk n HIS 15 Ca -0.14 0.22 -0.42 0.00 -0.26 0.00 0.00 57.72 57.12 2jmk n HIS 15 Cb 0.57 -1.76 -0.03 0.00 1.12 0.00 0.00 29.99 29.88 2jmk n HIS 15 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2jmk s PRO 16 N -3.60 4.30 -0.30 -0.41 0.04 -1.26 -4.59 135.00 129.18 2jmk s PRO 16 Ca 0.56 2.03 -0.09 0.00 0.04 0.00 0.00 61.00 63.55 2jmk s PRO 16 Cb -0.20 -3.43 -0.00 0.00 0.04 0.00 0.00 34.50 30.90 2jmk s PRO 16 CO 0.68 -0.51 0.13 0.99 0.04 0.00 0.00 177.00 178.32 2jmk s THR 17 N 1.81 4.41 -0.53 1.26 2.01 0.87 -4.96 115.64 120.51 2jmk s THR 17 Ca 0.65 -0.47 -0.24 0.00 0.31 0.00 0.00 61.69 61.93 2jmk s THR 17 Cb -0.34 -3.24 0.04 0.00 0.01 0.00 0.00 72.50 68.97 2jmk s THR 17 CO 0.29 0.09 0.94 -0.89 -0.69 0.00 0.00 174.62 174.36 2jmk s THR 18 N 1.58 4.41 -0.35 -0.82 2.01 -1.26 -1.01 115.64 120.21 2jmk s THR 18 Ca 0.04 0.39 -0.07 0.00 0.31 0.00 0.00 61.69 62.36 2jmk s THR 18 Cb -0.17 -4.51 0.04 0.00 0.01 0.00 0.00 72.50 67.86 2jmk s THR 18 CO 0.05 -1.05 0.13 -0.63 -0.69 0.00 0.00 174.62 172.43 2jmk s ILE 19 N 3.90 3.96 -0.04 1.82 1.01 0.92 -4.93 121.20 127.84 2jmk s ILE 19 Ca 0.32 -1.06 -0.26 0.00 0.00 0.00 0.00 60.65 59.65 2jmk s ILE 19 Cb -0.12 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 2jmk s ILE 19 CO 0.21 -0.18 0.80 0.00 0.00 0.00 0.00 174.94 175.76 2jmk s VAL 21 N 0.84 -0.01 0.94 0.00 1.01 -0.56 -4.17 120.40 118.45 2jmk s VAL 21 Ca 0.42 0.04 -0.10 0.00 0.00 0.00 0.00 61.98 62.34 2jmk s VAL 21 Cb -0.19 -0.27 0.16 0.00 0.00 0.00 0.00 36.38 36.08 2jmk s VAL 21 CO 0.22 0.02 1.13 1.33 0.00 0.00 0.00 175.10 177.79 2jmk n VAL 22 N 3.27 0.00 0.60 2.92 0.24 -1.26 -0.07 118.33 124.03 2jmk n VAL 22 Ca -0.16 -0.03 0.12 0.00 -2.04 0.00 0.00 64.34 62.23 2jmk n VAL 22 Cb 0.57 -0.99 0.46 0.00 -1.47 0.00 0.00 33.84 32.40 2jmk n VAL 22 CO 0.00 0.00 0.00 1.15 -2.14 0.00 0.00 176.83 175.84 2jmk n MET 23 N -4.29 0.15 0.12 7.34 0.00 -0.28 -0.89 117.12 119.27 2jmk n MET 23 Ca 0.11 0.25 0.03 0.00 0.00 0.00 0.00 57.70 58.09 2jmk n MET 23 Cb 0.52 -1.72 0.01 0.00 0.00 0.00 0.00 33.22 32.03 2jmk n MET 23 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 2jmk h ASP 24 N 0.00 0.00 0.00 3.17 5.19 -1.90 -3.32 116.42 119.55 2jmk h ASP 24 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2jmk h ASP 24 Cb 0.49 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.00 2jmk h ASP 24 CO 0.00 0.45 -0.01 0.54 -3.12 0.00 0.00 179.24 177.11 2jmk n ARG 25 N -3.10 2.42 0.23 3.56 3.00 -1.10 -4.77 116.66 116.90 2jmk n ARG 25 Ca -0.01 -1.67 -0.14 0.00 -0.01 0.00 0.00 57.85 56.01 2jmk n ARG 25 Cb 0.74 -1.07 -0.08 0.00 0.00 0.00 0.00 32.46 32.04 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 0.00 -0.54 -0.79 -1.55 3.57 -1.12 -1.23 116.94 115.28 2jmk h PHE 26 Ca 0.00 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.58 2jmk h PHE 26 Cb 0.65 0.18 -0.07 0.00 2.79 0.00 0.00 35.95 39.50 2jmk h PHE 26 CO 0.00 -0.23 0.44 1.25 -2.23 0.00 0.00 178.31 177.55 2jmk h LEU 27 N -0.82 0.63 0.05 0.59 5.85 -1.86 -1.43 115.31 118.31 2jmk h LEU 27 Ca -0.06 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2jmk h LEU 27 Cb 0.55 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2jmk h LEU 27 CO 0.10 0.37 -0.02 -0.08 -0.34 0.00 0.00 178.44 178.46 2jmk h GLU 28 N 0.75 -0.06 -0.69 1.25 4.57 -1.86 -0.77 114.58 117.77 2jmk h GLU 28 Ca 0.38 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.65 2jmk h GLU 28 Cb 0.34 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.88 2jmk h GLU 28 CO -0.24 0.01 0.34 1.03 -1.18 0.00 0.00 179.01 178.97 2jmk h SER 29 N -0.12 0.45 -0.55 1.04 0.87 -0.67 -1.42 113.55 113.16 2jmk h SER 29 Ca -0.01 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 2jmk h SER 29 Cb 0.10 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 2jmk h SER 29 CO 0.01 0.27 0.17 0.15 -0.53 0.00 0.00 176.83 176.90 2jmk h PHE 30 N 0.59 0.88 -0.09 2.24 3.04 -1.05 0.24 116.94 122.80 2jmk h PHE 30 Ca 0.33 -0.09 0.02 0.00 3.98 0.00 0.00 57.97 62.22 2jmk h PHE 30 Cb 0.33 -0.26 -0.02 0.00 2.56 0.00 0.00 35.95 38.56 2jmk h PHE 30 CO -0.11 0.75 -0.06 1.03 -2.02 0.00 0.00 178.31 177.90 2jmk h SER 31 N 0.76 -0.19 -0.31 0.41 0.87 -0.25 -1.39 113.55 113.44 2jmk h SER 31 Ca 0.18 0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.61 2jmk h SER 31 Cb 0.28 0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.34 2jmk h SER 31 CO -0.01 -0.08 -0.45 -0.08 -0.53 0.00 0.00 176.83 175.68 2jmk h GLU 32 N -0.06 0.89 -0.87 2.24 4.81 -1.20 -3.13 114.58 117.25 2jmk h GLU 32 Ca 0.06 -0.50 0.12 0.00 -0.13 0.00 0.00 59.36 58.90 2jmk h GLU 32 Cb 0.15 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.48 2jmk h GLU 32 CO -0.13 1.15 0.49 1.25 -0.73 0.00 0.00 179.01 181.04 2jmk h LEU 33 N 0.71 0.67 -1.96 1.64 5.85 -0.21 0.28 115.31 122.29 2jmk h LEU 33 Ca 0.04 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2jmk h LEU 33 Cb 1.05 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 2jmk h LEU 33 CO 0.11 0.34 -0.04 0.22 -0.34 0.00 0.00 178.44 178.73 2jmk h TYR 34 N 0.77 0.00 0.00 1.25 3.20 -1.20 0.39 116.97 121.37 2jmk h TYR 34 Ca 0.44 0.00 -0.23 0.00 3.14 0.00 0.00 58.73 62.08 2jmk h TYR 34 Cb 0.50 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 2jmk h TYR 34 CO -0.06 0.04 -1.23 -0.44 -1.64 0.00 0.00 178.16 174.83 2jmk h ASP 35 N 0.00 0.00 0.38 -2.11 5.19 -0.48 -3.34 116.42 116.07 2jmk h ASP 35 Ca -0.00 0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.10 2jmk h ASP 35 Cb 0.35 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.81 2jmk h ASP 35 CO 0.00 0.97 -1.83 0.00 -3.12 0.00 0.00 179.24 175.27 2jmk n ILE 36 N -3.23 1.61 0.33 0.35 3.06 -0.64 -3.98 119.36 116.85 2jmk n ILE 36 Ca -0.06 -0.78 0.21 0.00 -2.50 0.00 0.00 62.75 59.62 2jmk n ILE 36 Cb 0.97 -1.08 1.12 0.00 0.54 0.00 0.00 39.64 41.19 2jmk n ILE 36 CO 0.00 0.00 0.00 -0.29 -2.50 0.00 0.00 176.55 173.76 2jmk h ILE 37 N 0.01 0.11 0.00 9.51 6.09 -0.38 0.66 117.51 133.51 2jmk h ILE 37 Ca -0.34 0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 63.07 2jmk h ILE 37 Cb 2.04 0.97 -0.01 0.00 0.47 0.00 0.00 36.82 40.28 2jmk h ILE 37 CO 0.07 0.00 -0.39 -0.78 -3.07 0.00 0.00 178.15 173.98 2jmk h ASP 38 N 0.00 0.00 -3.93 2.19 1.82 -1.69 -3.45 116.42 111.35 2jmk h ASP 38 Ca 0.00 0.00 -0.44 0.00 -0.39 0.00 0.00 57.03 56.20 2jmk h ASP 38 Cb 0.08 0.00 0.17 0.00 0.68 0.00 0.00 39.33 40.26 2jmk h ASP 38 CO -0.00 0.39 0.42 -1.61 -1.61 0.00 0.00 179.24 176.83 2jmk s GLU 39 N -3.31 0.41 -0.01 0.28 2.02 0.22 -5.03 118.70 113.29 2jmk s GLU 39 Ca 0.02 -0.48 0.05 0.00 0.02 0.00 0.00 54.97 54.58 2jmk s GLU 39 Cb 0.09 -1.83 -0.07 0.00 0.10 0.00 0.00 34.13 32.43 2jmk s GLU 39 CO 0.70 -2.56 0.10 -1.71 0.02 0.00 0.00 175.26 171.80 2jmk n ASN 40 N -3.85 3.97 -4.50 -0.19 4.05 -1.26 -4.98 115.26 108.49 2jmk n ASN 40 Ca 0.16 0.00 -0.43 0.00 0.45 0.00 0.00 54.58 54.76 2jmk n ASN 40 Cb 0.59 1.18 -0.08 0.00 1.23 0.00 0.00 39.78 42.70 2jmk n ASN 40 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 2jmk n ASP 41 N -1.68 1.68 0.13 1.20 5.68 -1.26 -4.77 116.55 117.54 2jmk n ASP 41 Ca -0.01 0.02 0.08 0.00 -0.50 0.00 0.00 54.79 54.38 2jmk n ASP 41 Cb 0.14 -1.28 0.04 0.00 -1.14 0.00 0.00 41.12 38.88 2jmk n ASP 41 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 2jmk h THR 42 N 7.57 0.26 0.00 2.12 2.02 -1.99 -3.27 112.91 119.62 2jmk h THR 42 Ca -0.20 -1.42 0.00 0.00 0.77 0.00 0.00 66.41 65.56 2jmk h THR 42 Cb 1.30 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.64 2jmk h THR 42 CO 1.17 0.15 0.00 0.47 0.37 0.00 0.00 175.52 177.68 2jmk n ASP 43 N -2.95 0.52 0.07 4.18 9.92 -1.26 -1.74 116.55 125.28 2jmk n ASP 43 Ca -0.00 0.66 0.04 0.00 -0.53 0.00 0.00 54.79 54.95 2jmk n ASP 43 Cb 0.63 -0.76 -0.04 0.00 -0.64 0.00 0.00 41.12 40.32 2jmk n ASP 43 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2jmk h VAL 44 N 0.00 0.38 -0.22 2.53 2.07 -1.95 -3.37 116.25 115.68 2jmk h VAL 44 Ca 0.00 -1.71 0.06 0.00 0.82 0.00 0.00 66.70 65.87 2jmk h VAL 44 Cb 0.24 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 2jmk h VAL 44 CO 0.00 0.22 -0.17 0.24 0.02 0.00 0.00 177.57 177.88 2jmk h MET 45 N 0.00 -0.16 -0.56 1.57 2.86 -1.51 0.26 114.93 117.40 2jmk h MET 45 Ca -0.09 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.66 2jmk h MET 45 Cb 1.38 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.99 2jmk h MET 45 CO 0.03 -0.11 0.07 0.00 1.06 0.00 0.00 176.91 177.96 2jmk h MET 46 N -0.17 0.19 -0.40 1.72 -0.00 -1.73 0.28 114.93 114.83 2jmk h MET 46 Ca 0.13 -0.01 -0.10 0.00 -0.00 0.00 0.00 59.70 59.72 2jmk h MET 46 Cb 0.36 -0.04 -0.02 0.00 -0.00 0.00 0.00 31.60 31.90 2jmk h MET 46 CO -0.32 0.12 -0.15 -0.44 -0.00 0.00 0.00 176.91 176.12 2jmk h ASP 47 N 0.19 0.73 -0.58 -0.10 3.32 -1.55 -0.36 116.42 118.07 2jmk h ASP 47 Ca 0.29 -0.23 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 2jmk h ASP 47 Cb 0.43 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 2jmk h ASP 47 CO -0.41 0.89 -0.02 0.15 -1.72 0.00 0.00 179.24 178.13 2jmk h PHE 48 N 0.66 1.13 -0.12 4.55 3.04 0.11 0.25 116.94 126.56 2jmk h PHE 48 Ca 0.11 -0.20 -0.20 0.00 3.98 0.00 0.00 57.97 61.65 2jmk h PHE 48 Cb 0.62 -0.29 0.00 0.00 2.56 0.00 0.00 35.95 38.85 2jmk h PHE 48 CO 0.03 1.01 -0.75 0.82 -2.02 0.00 0.00 178.31 177.40 2jmk h ILE 49 N 0.92 1.33 0.00 1.41 2.04 -0.35 -0.97 117.51 121.88 2jmk h ILE 49 Ca 0.16 -2.05 -0.09 0.00 1.00 0.00 0.00 64.86 63.88 2jmk h ILE 49 Cb 0.57 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 2jmk h ILE 49 CO 0.03 0.63 -0.42 -1.28 0.00 0.00 0.00 178.15 177.12 2jmk h SER 50 N 0.41 0.00 0.09 1.72 0.87 -0.95 0.25 113.55 115.94 2jmk h SER 50 Ca -0.04 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.36 2jmk h SER 50 Cb 1.36 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.32 2jmk h SER 50 CO 0.14 0.42 -0.75 -0.09 -0.53 0.00 0.00 176.83 176.02 2jmk h ARG 51 N 0.00 0.18 0.00 2.24 2.43 -0.45 -3.40 114.38 115.38 2jmk h ARG 51 Ca -0.00 -0.31 -0.03 0.00 -0.81 0.00 0.00 59.98 58.83 2jmk h ARG 51 Cb 1.14 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.81 2jmk h ARG 51 CO 0.05 1.15 -0.15 0.74 -1.51 0.00 0.00 179.97 180.25 2jmk h PHE 52 N -0.58 0.00 -3.24 2.20 0.04 -1.25 -3.45 116.94 110.66 2jmk h PHE 52 Ca -0.15 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.04 2jmk h PHE 52 Cb 1.46 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.56 2jmk h PHE 52 CO 0.20 1.00 -0.09 0.00 -0.60 0.00 0.00 178.31 178.82 2jmk s ALA 53 N -2.26 3.54 -0.02 2.45 0.00 0.89 -4.82 121.76 121.54 2jmk s ALA 53 Ca -0.19 -0.07 0.04 0.00 0.00 0.00 0.00 51.96 51.73 2jmk s ALA 53 Cb -0.02 -2.63 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 2jmk s ALA 53 CO 0.64 0.23 0.04 -2.13 0.00 0.00 0.00 175.76 174.55 2jmk n ARG 54 N 2.59 2.00 -2.54 0.00 0.63 -1.26 -4.12 116.66 113.95 2jmk n ARG 54 Ca -0.09 -0.02 -0.12 0.00 -0.92 0.00 0.00 57.85 56.70 2jmk n ARG 54 Cb 0.51 -1.09 -0.00 0.00 0.45 0.00 0.00 32.46 32.33 2jmk n ARG 54 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2jmk n THR 55 N -1.92 -0.58 0.00 5.15 -2.24 -1.26 -4.74 114.28 108.69 2jmk n THR 55 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2jmk n THR 55 Cb 0.40 -1.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.03 2jmk n THR 55 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2jmk n ASP 56 N -1.83 4.68 -4.45 3.42 2.03 -1.26 -5.00 116.55 114.14 2jmk n ASP 56 Ca -0.12 0.00 -0.50 0.00 0.52 0.00 0.00 54.79 54.69 2jmk n ASP 56 Cb 0.59 0.40 -0.07 0.00 -0.72 0.00 0.00 41.12 41.32 2jmk n ASP 56 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2jmk n GLU 57 N -2.05 1.08 -2.36 -0.67 2.13 -1.26 -4.90 120.64 112.61 2jmk n GLU 57 Ca 0.00 0.28 -0.36 0.00 0.66 0.00 0.00 57.16 57.75 2jmk n GLU 57 Cb 0.49 -2.49 -0.01 0.00 0.27 0.00 0.00 31.44 29.69 2jmk n GLU 57 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 2jmk s ILE 58 N 7.53 3.36 -0.75 6.31 2.07 -1.26 -5.00 121.20 133.46 2jmk s ILE 58 Ca 1.10 0.92 0.03 0.00 -1.41 0.00 0.00 60.65 61.29 2jmk s ILE 58 Cb -0.83 -3.41 0.26 0.00 0.13 0.00 0.00 42.46 38.61 2jmk s ILE 58 CO 0.48 -0.12 0.91 0.80 -1.91 0.00 0.00 174.94 175.10 2jmk n MET 59 N -0.85 2.96 0.10 3.50 0.00 -1.26 -4.86 117.12 116.70 2jmk n MET 59 Ca 0.09 -4.64 -0.02 0.00 -0.00 0.00 0.00 57.70 53.13 2jmk n MET 59 Cb 0.50 -2.32 0.20 0.00 0.00 0.00 0.00 33.22 31.60 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 4.56 0.21 0.00 2.12 0.13 -2.01 -3.37 132.00 133.64 2jmk h PRO 60 Ca 0.20 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 65.19 2jmk h PRO 60 Cb 0.66 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.76 2jmk h PRO 60 CO 0.95 0.64 -0.19 0.39 -0.23 0.00 0.00 178.00 179.56 2jmk n GLU 61 N -3.98 0.00 -2.87 0.86 1.02 -1.26 -5.12 120.64 109.28 2jmk n GLU 61 Ca -0.02 -0.42 -0.23 0.00 -0.02 0.00 0.00 57.16 56.48 2jmk n GLU 61 Cb 0.52 -0.05 0.02 0.00 -0.02 0.00 0.00 31.44 31.90 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 -0.42 5.72 0.40 1.62 1.01 -1.26 -3.67 116.67 120.07 2jmk s ASP 62 Ca 0.01 0.27 0.04 0.00 0.71 0.00 0.00 52.55 53.59 2jmk s ASP 62 Cb 0.02 -1.44 -0.02 0.00 1.01 0.00 0.00 42.92 42.48 2jmk s ASP 62 CO -0.01 -0.81 0.15 -0.75 0.21 0.00 0.00 175.17 173.96 2jmk s LYS 63 N -4.63 1.92 -0.22 8.23 2.20 0.15 -4.95 119.74 122.45 2jmk s LYS 63 Ca 0.50 -2.17 -0.08 0.00 -0.36 0.00 0.00 55.97 53.86 2jmk s LYS 63 Cb -0.10 -0.51 -0.04 0.00 -1.51 0.00 0.00 37.83 35.67 2jmk s LYS 63 CO 0.39 -0.51 0.10 0.99 -0.36 0.00 0.00 175.35 175.96 2jmk s THR 64 N -3.23 4.86 -0.30 3.43 2.01 -1.26 -1.38 115.64 119.78 2jmk s THR 64 Ca 0.25 0.00 0.20 0.00 0.31 0.00 0.00 61.69 62.46 2jmk s THR 64 Cb 0.02 -3.24 0.16 0.00 0.01 0.00 0.00 72.50 69.45 2jmk s THR 64 CO 0.16 0.38 1.38 1.62 -0.69 0.00 0.00 174.62 177.47 2jmk h VAL 65 N 5.11 0.27 0.00 3.82 3.04 -0.78 -3.47 116.25 124.24 2jmk h VAL 65 Ca -0.37 -1.41 0.00 0.00 -1.01 0.00 0.00 66.70 63.91 2jmk h VAL 65 Cb 1.17 2.01 0.00 0.00 -2.01 0.00 0.00 31.29 32.46 2jmk h VAL 65 CO 0.65 0.15 0.00 0.61 -1.01 0.00 0.00 177.57 177.97 2jmk n GLY 66 N 1.18 -0.91 3.28 3.17 0.00 -1.25 -0.06 105.19 110.59 2jmk n GLY 66 Ca 0.01 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.83 0.04 -0.04 1.61 -0.71 0.85 -1.31 117.98 115.59 2jmk s PHE 67 Ca 0.00 -0.42 0.02 0.00 -1.04 0.00 0.00 56.93 55.49 2jmk s PHE 67 Cb 0.00 0.08 0.01 0.00 -1.21 0.00 0.00 43.02 41.90 2jmk s PHE 67 CO 0.00 -0.65 -0.09 0.08 -1.34 0.00 0.00 175.22 173.22 2jmk s VAL 68 N -3.86 0.87 -0.21 -2.49 1.01 -0.26 -0.89 120.40 114.57 2jmk s VAL 68 Ca 0.06 -0.36 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 2jmk s VAL 68 Cb 0.03 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2jmk s VAL 68 CO -0.09 0.28 0.08 -0.69 0.00 0.00 0.00 175.10 174.68 2jmk s VAL 69 N 0.51 4.66 -0.04 2.92 1.01 0.61 -0.79 120.40 129.28 2jmk s VAL 69 Ca -0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 2jmk s VAL 69 Cb -0.13 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 33.15 2jmk s VAL 69 CO 0.02 0.40 0.04 -0.69 0.00 0.00 0.00 175.10 174.87 2jmk s VAL 70 N 0.92 -0.03 -0.06 2.92 1.01 0.91 -0.65 120.40 125.42 2jmk s VAL 70 Ca 0.04 0.33 -0.02 0.00 0.00 0.00 0.00 61.98 62.33 2jmk s VAL 70 Cb -0.14 -0.18 0.03 0.00 0.00 0.00 0.00 36.38 36.09 2jmk s VAL 70 CO 0.03 0.17 0.04 0.21 0.00 0.00 0.00 175.10 175.54 2jmk s ASN 71 N 1.82 1.37 0.23 3.32 2.47 0.85 -0.39 114.94 124.61 2jmk s ASN 71 Ca 0.01 -0.02 0.15 0.00 0.42 0.00 0.00 52.86 53.42 2jmk s ASN 71 Cb -0.12 -0.25 0.01 0.00 -1.45 0.00 0.00 41.25 39.44 2jmk s ASN 71 CO -0.03 -0.24 1.32 0.00 -3.72 0.00 0.00 177.10 174.44 2jmk h ALA 72 N 8.40 0.65 0.18 1.71 0.00 -0.82 0.18 119.26 129.56 2jmk h ALA 72 Ca -0.15 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 2jmk h ALA 72 Cb 1.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2jmk h ALA 72 CO 0.20 0.71 -0.09 0.22 0.00 0.00 0.00 179.25 180.29 2jmk h ASP 73 N 0.00 -0.21 -0.32 0.00 1.82 -1.69 -3.22 116.42 112.80 2jmk h ASP 73 Ca -0.03 -0.25 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 2jmk h ASP 73 Cb 1.44 0.05 0.00 0.00 0.68 0.00 0.00 39.33 41.51 2jmk h ASP 73 CO 0.07 0.15 0.00 0.29 -1.61 0.00 0.00 179.24 178.14 2jmk n LYS 74 N -5.04 2.41 -3.61 0.28 5.02 -1.25 -4.90 118.16 111.05 2jmk n LYS 74 Ca -0.09 -2.11 -0.28 0.00 -2.02 0.00 0.00 58.31 53.81 2jmk n LYS 74 Cb 0.23 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.79 2jmk n LYS 74 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jmk n LYS 75 N 1.35 -1.66 -4.27 1.97 5.02 0.08 -4.98 118.16 115.67 2jmk n LYS 75 Ca 0.18 0.54 -0.33 0.00 -2.02 0.00 0.00 58.31 56.68 2jmk n LYS 75 Cb 0.58 -4.49 -0.16 0.00 -0.02 0.00 0.00 35.03 30.94 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 -6.31 2.36 -0.19 -0.35 1.43 0.42 -4.00 118.68 112.04 2jmk s LEU 76 Ca 0.43 -0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 52.97 2jmk s LEU 76 Cb -0.14 -1.54 0.06 0.00 0.03 0.00 0.00 46.19 44.60 2jmk s LEU 76 CO 0.84 0.03 0.01 -0.04 0.23 0.00 0.00 176.35 177.42 2jmk s MET 77 N 1.13 0.92 -0.20 1.70 -1.94 0.18 -0.11 119.30 120.98 2jmk s MET 77 Ca 0.01 -0.50 -0.04 0.00 -1.71 0.00 0.00 55.69 53.44 2jmk s MET 77 Cb -0.14 -2.11 0.08 0.00 2.01 0.00 0.00 34.83 34.66 2jmk s MET 77 CO -0.06 -0.59 0.14 -1.12 -0.01 0.00 0.00 175.02 173.38 2jmk s SER 78 N 1.76 2.20 -0.13 3.03 0.01 0.18 -0.09 113.70 120.66 2jmk s SER 78 Ca -0.01 -0.59 -0.09 0.00 1.31 0.00 0.00 55.95 56.56 2jmk s SER 78 Cb -0.17 -0.07 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 2jmk s SER 78 CO -0.07 -0.36 0.19 0.68 0.41 0.00 0.00 173.24 174.09 2jmk s VAL 79 N 2.19 5.40 -0.21 3.43 -7.23 -0.31 -0.28 120.40 123.39 2jmk s VAL 79 Ca 0.04 0.32 -0.04 0.00 -1.81 0.00 0.00 61.98 60.49 2jmk s VAL 79 Cb -0.16 -3.48 0.08 0.00 0.56 0.00 0.00 36.38 33.38 2jmk s VAL 79 CO -0.14 0.54 0.14 -0.44 -0.31 0.00 0.00 175.10 174.89 2jmk s SER 80 N -0.51 2.36 0.18 4.85 0.01 -0.07 -1.06 113.70 119.46 2jmk s SER 80 Ca 0.14 -0.69 0.05 0.00 1.31 0.00 0.00 55.95 56.76 2jmk s SER 80 Cb -0.12 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 2jmk s SER 80 CO 0.04 -0.37 -0.08 0.72 0.41 0.00 0.00 173.24 173.96 2jmk s PHE 81 N 2.18 1.39 1.16 2.43 -0.12 -1.24 -0.10 117.98 123.69 2jmk s PHE 81 Ca 0.05 -0.78 -0.17 0.00 -0.05 0.00 0.00 56.93 55.98 2jmk s PHE 81 Cb -0.16 -0.73 0.19 0.00 -0.63 0.00 0.00 43.02 41.69 2jmk s PHE 81 CO -0.17 0.08 0.37 0.45 -0.05 0.00 0.00 175.22 175.90 2jmk n SER 82 N -0.28 -2.31 -4.52 1.98 2.88 0.91 -4.71 113.62 107.58 2jmk n SER 82 Ca -0.09 -0.20 -0.45 0.00 -1.33 0.00 0.00 58.87 56.80 2jmk n SER 82 Cb 0.61 -1.04 -0.05 0.00 -0.75 0.00 0.00 64.21 62.98 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 -2.96 2.44 -3.91 -3.46 2.03 -1.26 -4.94 116.55 104.50 2jmk n ASP 83 Ca 0.02 0.16 -0.19 0.00 0.52 0.00 0.00 54.79 55.30 2jmk n ASP 83 Cb 0.59 -1.40 0.10 0.00 -0.72 0.00 0.00 41.12 39.69 2jmk n ASP 83 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2jmk n ILE 84 N 7.56 0.00 -1.87 5.18 -5.35 -1.26 -5.10 119.36 118.51 2jmk n ILE 84 Ca 0.38 -1.16 -0.30 0.00 -0.27 0.00 0.00 62.75 61.41 2jmk n ILE 84 Cb 0.35 -1.09 0.19 0.00 -1.74 0.00 0.00 39.64 37.34 2jmk n ILE 84 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2jmk s ASP 85 N -4.26 3.03 -0.06 7.28 2.15 -1.26 -4.94 116.67 118.62 2jmk s ASP 85 Ca 0.53 0.31 -0.09 0.00 0.43 0.00 0.00 52.55 53.73 2jmk s ASP 85 Cb -0.03 -0.39 -0.05 0.00 -0.30 0.00 0.00 42.92 42.15 2jmk s ASP 85 CO 0.35 -2.79 0.38 -0.33 -0.17 0.00 0.00 175.17 172.61 2jmk h GLU 86 N -1.68 -0.32 -0.51 4.34 4.39 -1.99 -2.75 114.58 116.06 2jmk h GLU 86 Ca -0.45 0.02 0.08 0.00 0.34 0.00 0.00 59.36 59.36 2jmk h GLU 86 Cb 1.24 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 29.90 2jmk h GLU 86 CO 0.39 -0.21 0.12 -0.97 -1.16 0.00 0.00 179.01 177.18 2jmk h ASN 87 N -1.08 0.04 -0.91 1.42 -0.73 -2.01 -0.87 115.58 111.44 2jmk h ASN 87 Ca -0.03 0.08 0.07 0.00 1.87 0.00 0.00 56.30 58.29 2jmk h ASN 87 Cb 0.25 0.11 -0.06 0.00 0.27 0.00 0.00 38.32 38.89 2jmk h ASN 87 CO 0.06 0.05 0.59 0.24 -0.37 0.00 0.00 177.43 178.00 2jmk h MET 88 N 0.26 1.00 -1.00 6.67 2.86 -1.97 -1.52 114.93 121.23 2jmk h MET 88 Ca 0.26 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 57.91 2jmk h MET 88 Cb 0.33 -0.23 -0.07 0.00 0.06 0.00 0.00 31.60 31.70 2jmk h MET 88 CO -0.32 0.66 0.65 -0.22 1.06 0.00 0.00 176.91 178.74 2jmk h LYS 89 N 1.03 1.11 0.50 1.72 3.64 -0.84 0.04 116.57 123.77 2jmk h LYS 89 Ca 0.40 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.68 2jmk h LYS 89 Cb 0.21 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2jmk h LYS 89 CO -0.15 0.74 -0.24 -0.22 -2.27 0.00 0.00 179.45 177.30 2jmk h LYS 90 N 1.15 -0.65 0.51 1.90 3.64 -1.03 0.16 116.57 122.24 2jmk h LYS 90 Ca 0.44 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.85 2jmk h LYS 90 Cb 0.22 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2jmk h LYS 90 CO -0.19 -0.42 -0.31 0.28 -2.27 0.00 0.00 179.45 176.54 2jmk h VAL 91 N -0.71 0.37 -0.82 2.00 2.07 -1.33 -0.53 116.25 117.30 2jmk h VAL 91 Ca -0.07 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.57 2jmk h VAL 91 Cb 0.53 0.37 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 2jmk h VAL 91 CO 0.11 0.00 0.44 0.40 0.02 0.00 0.00 177.57 178.54 2jmk h ILE 92 N -0.77 0.82 -0.73 4.57 2.04 -1.01 -0.33 117.51 122.10 2jmk h ILE 92 Ca -0.06 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 2jmk h ILE 92 Cb 0.63 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 2jmk h ILE 92 CO 0.07 0.13 0.35 0.50 0.00 0.00 0.00 178.15 179.20 2jmk h LYS 93 N 0.69 1.05 0.01 2.37 1.63 -0.40 0.03 116.57 121.95 2jmk h LYS 93 Ca 0.42 -0.15 -0.00 0.00 -0.85 0.00 0.00 60.65 60.07 2jmk h LYS 93 Cb 0.49 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.93 2jmk h LYS 93 CO -0.30 0.82 -0.01 0.00 -3.45 0.00 0.00 179.45 176.51 2jmk h ALA 94 N 1.17 -0.02 -0.10 5.00 0.00 0.21 0.16 119.26 125.68 2jmk h ALA 94 Ca 0.25 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2jmk h ALA 94 Cb 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jmk h ALA 94 CO -0.03 -0.40 0.06 1.15 0.00 0.00 0.00 179.25 180.03 2jmk h THR 95 N -0.23 1.06 -0.46 0.00 2.02 -0.99 0.24 112.91 114.55 2jmk h THR 95 Ca -0.00 -0.15 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 2jmk h THR 95 Cb 0.22 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 2jmk h THR 95 CO 0.00 0.05 0.07 0.00 0.37 0.00 0.00 175.52 176.01 2jmk h ALA 96 N 1.00 1.25 0.00 6.16 0.00 -0.98 -2.29 119.26 124.40 2jmk h ALA 96 Ca 0.04 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 2jmk h ALA 96 Cb 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2jmk h ALA 96 CO -0.01 0.51 -0.43 1.49 0.00 0.00 0.00 179.25 180.81 2jmk h GLU 97 N 0.69 0.00 0.00 0.00 4.81 -0.33 -3.07 114.58 116.67 2jmk h GLU 97 Ca 0.15 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.32 2jmk h GLU 97 Cb 0.33 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2jmk h GLU 97 CO 0.01 0.43 -0.30 -0.22 -0.73 0.00 0.00 179.01 178.20 2jmk h LYS 98 N 0.00 0.00 -0.08 1.92 1.63 0.06 -2.40 116.57 117.69 2jmk h LYS 98 Ca -0.00 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 2jmk h LYS 98 Cb 1.09 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.71 2jmk h LYS 98 CO 0.06 0.30 0.15 0.74 -3.45 0.00 0.00 179.45 177.24 2jmk h PHE 99 N 0.00 0.00 -1.06 1.91 0.04 -1.44 -1.74 116.94 114.65 2jmk h PHE 99 Ca -0.00 0.00 0.30 0.00 2.80 0.00 0.00 57.97 61.06 2jmk h PHE 99 Cb 0.55 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.65 2jmk h PHE 99 CO 0.00 0.00 0.74 -0.22 -0.60 0.00 0.00 178.31 178.23 2jmk h LYS 100 N 0.00 0.11 -0.96 1.51 3.11 -1.50 0.27 116.57 119.11 2jmk h LYS 100 Ca 0.04 -0.01 0.19 0.00 -2.81 0.00 0.00 60.65 58.06 2jmk h LYS 100 Cb 0.33 -0.03 -0.09 0.00 -1.00 0.00 0.00 32.23 31.45 2jmk h LYS 100 CO -0.00 0.07 0.61 -0.91 -2.81 0.00 0.00 179.45 176.41 2jmk h ASN 101 N 0.12 0.66 0.00 4.20 2.35 -1.55 -2.24 115.58 119.11 2jmk h ASN 101 Ca 0.53 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 56.31 2jmk h ASN 101 Cb 1.87 -0.05 -0.09 0.00 0.05 0.00 0.00 38.32 40.11 2jmk h ASN 101 CO -0.09 0.26 -0.49 0.29 -1.65 0.00 0.00 177.43 175.75 2jmk n LYS 102 N -4.64 0.93 -2.67 0.81 4.76 0.67 -4.91 118.16 113.10 2jmk n LYS 102 Ca 0.21 -2.50 -0.03 0.00 -2.87 0.00 0.00 58.31 53.12 2jmk n LYS 102 Cb 0.60 -1.07 0.03 0.00 -1.84 0.00 0.00 35.03 32.75 2jmk n LYS 102 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2jmk s GLY 103 N -2.55 -1.93 0.51 0.72 0.00 0.44 -4.87 107.32 99.63 2jmk s GLY 103 Ca 0.30 0.64 0.29 0.00 0.00 0.00 0.00 44.72 45.96 2jmk s GLY 103 CO -0.06 4.33 1.87 0.27 0.00 0.00 0.00 173.10 179.51 2jmk h PHE 104 N 4.22 0.12 -0.45 1.90 -0.00 -1.79 -3.29 116.94 117.65 2jmk h PHE 104 Ca -0.01 0.00 -0.50 0.00 -0.00 0.00 0.00 57.97 57.46 2jmk h PHE 104 Cb 1.17 -0.04 -0.03 0.00 -0.00 0.00 0.00 35.95 37.05 2jmk h PHE 104 CO -0.08 0.02 1.72 1.17 -0.00 0.00 0.00 178.31 181.14 2jmk n LYS 105 N -4.32 2.07 -4.80 6.09 4.81 -1.26 -4.91 118.16 115.84 2jmk n LYS 105 Ca 0.20 -2.57 -0.33 0.00 -0.87 0.00 0.00 58.31 54.74 2jmk n LYS 105 Cb 0.96 -3.50 -0.13 0.00 0.02 0.00 0.00 35.03 32.38 2jmk n LYS 105 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2jmk s VAL 106 N 7.74 3.23 -0.04 3.15 0.11 -1.24 -0.65 120.40 132.70 2jmk s VAL 106 Ca 0.61 -0.65 -0.13 0.00 -2.93 0.00 0.00 61.98 58.89 2jmk s VAL 106 Cb 0.04 -2.29 0.02 0.00 -1.53 0.00 0.00 36.38 32.62 2jmk s VAL 106 CO 0.10 0.58 0.28 -1.61 -3.33 0.00 0.00 175.10 171.13 2jmk s GLU 107 N -0.59 0.56 -0.10 1.54 0.41 0.87 -4.98 118.70 116.41 2jmk s GLU 107 Ca 0.09 -0.06 -0.05 0.00 -0.41 0.00 0.00 54.97 54.53 2jmk s GLU 107 Cb -0.11 0.25 0.04 0.00 -1.78 0.00 0.00 34.13 32.53 2jmk s GLU 107 CO 0.01 -0.14 0.23 0.95 -0.49 0.00 0.00 175.26 175.83 2jmk s THR 108 N -0.94 -0.04 -0.34 3.63 -4.23 -1.26 -1.16 115.64 111.31 2jmk s THR 108 Ca -0.10 0.13 -0.04 0.00 -1.18 0.00 0.00 61.69 60.49 2jmk s THR 108 Cb -0.05 -0.36 0.05 0.00 1.34 0.00 0.00 72.50 73.49 2jmk s THR 108 CO 0.03 0.05 0.09 -0.62 -0.54 0.00 0.00 174.62 173.63 2jmk s ASP 109 N 1.09 5.18 0.00 3.99 2.15 -0.22 -4.99 116.67 123.88 2jmk s ASP 109 Ca -0.08 -1.33 0.31 0.00 0.43 0.00 0.00 52.55 51.88 2jmk s ASP 109 Cb -0.09 -1.82 1.84 0.00 -0.30 0.00 0.00 42.92 42.55 2jmk s ASP 109 CO -0.07 -0.35 2.17 0.80 -0.17 0.00 0.00 175.17 177.55