#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksm s ALA 74 N 0.00 -2.33 -0.34 4.61 0.00 -1.26 -5.05 121.76 117.40 2ksm s ALA 74 Ca 0.00 1.88 0.16 0.00 0.00 0.00 0.00 51.96 54.00 2ksm s ALA 74 Cb 0.00 -2.15 0.44 0.00 0.00 0.00 0.00 23.12 21.41 2ksm s ALA 74 CO 0.00 -1.29 1.10 0.43 0.00 0.00 0.00 175.76 176.00 2ksm n SER 75 N 5.43 0.38 0.44 0.00 7.64 -1.26 -4.98 113.62 121.27 2ksm n SER 75 Ca -0.03 -2.58 -0.17 0.00 1.01 0.00 0.00 58.87 57.10 2ksm n SER 75 Cb 0.51 -0.04 -0.08 0.00 -1.01 0.00 0.00 64.21 63.59 2ksm n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ksm h ALA 76 N 2.63 -1.30 -6.50 -0.43 0.00 -2.09 -3.47 119.26 108.10 2ksm h ALA 76 Ca -0.17 -0.24 -0.38 0.00 0.00 0.00 0.00 54.91 54.13 2ksm h ALA 76 Cb 1.22 0.44 0.02 0.00 0.00 0.00 0.00 17.79 19.47 2ksm h ALA 76 CO 0.29 -1.22 -1.17 1.28 0.00 0.00 0.00 179.25 178.43 2ksm n LEU 77 N -5.00 -2.82 0.00 0.00 4.32 -1.26 -4.98 117.00 107.25 2ksm n LEU 77 Ca -0.14 -0.16 0.00 0.00 -0.02 0.00 0.00 56.01 55.69 2ksm n LEU 77 Cb 0.44 -1.72 0.00 0.00 -1.62 0.00 0.00 43.42 40.52 2ksm n LEU 77 CO 0.33 -0.14 0.00 -1.20 -1.22 0.00 0.00 177.39 175.16 2ksm n SER 78 N -0.31 0.00 -4.82 -1.43 7.64 -1.26 -5.09 113.62 108.35 2ksm n SER 78 Ca -0.09 -0.95 -0.37 0.00 1.01 0.00 0.00 58.87 58.48 2ksm n SER 78 Cb 0.67 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.81 2ksm n SER 78 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2ksm s LEU 79 N 0.00 4.40 -0.40 -3.43 1.02 -1.26 -5.02 118.68 113.98 2ksm s LEU 79 Ca 0.00 1.32 0.05 0.00 0.02 0.00 0.00 54.13 55.52 2ksm s LEU 79 Cb 0.00 -3.35 0.18 0.00 0.02 0.00 0.00 46.19 43.04 2ksm s LEU 79 CO 0.00 0.11 0.71 -0.94 0.02 0.00 0.00 176.35 176.25 2ksm s SER 80 N -1.53 -1.34 0.21 2.29 1.04 -1.26 -4.90 113.70 108.22 2ksm s SER 80 Ca 0.38 -0.76 0.07 0.00 0.48 0.00 0.00 55.95 56.13 2ksm s SER 80 Cb -0.17 1.71 -0.05 0.00 0.10 0.00 0.00 66.02 67.61 2ksm s SER 80 CO 0.21 -0.14 -0.13 -0.76 0.98 0.00 0.00 173.24 173.39 2ksm s LEU 81 N 1.78 2.54 0.01 2.42 1.02 -1.26 -4.41 118.68 120.79 2ksm s LEU 81 Ca 0.17 -1.04 0.02 0.00 0.02 0.00 0.00 54.13 53.30 2ksm s LEU 81 Cb -0.02 -0.65 -0.01 0.00 0.02 0.00 0.00 46.19 45.52 2ksm s LEU 81 CO -0.08 -0.20 -0.07 -0.22 0.02 0.00 0.00 176.35 175.80 2ksm s LEU 82 N -3.32 2.09 -0.05 1.79 2.96 -1.17 -4.05 118.68 116.91 2ksm s LEU 82 Ca 0.23 -0.25 -0.01 0.00 -0.22 0.00 0.00 54.13 53.88 2ksm s LEU 82 Cb -0.00 -0.30 0.03 0.00 0.50 0.00 0.00 46.19 46.41 2ksm s LEU 82 CO 0.07 0.00 0.00 -0.55 -1.32 0.00 0.00 176.35 174.55 2ksm s SER 83 N -0.59 1.18 -0.05 3.68 0.15 -1.02 -2.43 113.70 114.63 2ksm s SER 83 Ca -0.01 -0.06 -0.00 0.00 0.70 0.00 0.00 55.95 56.58 2ksm s SER 83 Cb -0.05 -0.36 0.03 0.00 -1.71 0.00 0.00 66.02 63.93 2ksm s SER 83 CO 0.00 -0.16 0.01 -0.63 1.20 0.00 0.00 173.24 173.66 2ksm s ILE 84 N 1.62 0.22 -0.05 6.45 1.01 -0.88 -2.15 121.20 127.42 2ksm s ILE 84 Ca -0.01 0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.84 2ksm s ILE 84 Cb -0.13 -0.35 -0.01 0.00 0.01 0.00 0.00 42.46 41.98 2ksm s ILE 84 CO -0.03 0.19 -0.23 -0.44 0.00 0.00 0.00 174.94 174.43 2ksm s SER 85 N 1.49 2.83 -0.17 3.58 0.01 -0.46 -2.21 113.70 118.77 2ksm s SER 85 Ca -0.03 -0.47 -0.03 0.00 1.31 0.00 0.00 55.95 56.73 2ksm s SER 85 Cb -0.13 -0.76 0.05 0.00 0.21 0.00 0.00 66.02 65.39 2ksm s SER 85 CO -0.03 0.22 0.04 -0.13 0.41 0.00 0.00 173.24 173.75 2ksm s ARG 86 N -0.13 0.54 -0.08 12.44 0.52 -1.09 -2.65 118.95 128.49 2ksm s ARG 86 Ca -0.03 -0.27 0.07 0.00 -0.52 0.00 0.00 55.73 54.98 2ksm s ARG 86 Cb -0.13 -1.86 -0.10 0.00 0.52 0.00 0.00 34.95 33.38 2ksm s ARG 86 CO 0.03 -0.59 0.03 0.45 0.02 0.00 0.00 175.30 175.25 2ksm n SER 87 N 5.11 2.93 0.00 0.23 2.88 -0.07 -2.20 113.62 122.49 2ksm n SER 87 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 2ksm n SER 87 Cb 0.48 0.71 0.00 0.00 -0.75 0.00 0.00 64.21 64.65 2ksm n SER 87 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ksm n GLY 88 N 2.48 3.32 0.00 0.46 0.00 -1.03 -4.30 105.19 106.12 2ksm n GLY 88 Ca -0.14 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2ksm n GLY 88 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ksm n ASN 89 N 0.00 0.00 -4.81 1.61 3.02 -1.26 -4.89 115.26 108.93 2ksm n ASN 89 Ca 0.00 0.33 -0.25 0.00 -0.03 0.00 0.00 54.58 54.63 2ksm n ASN 89 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 2ksm n ASN 89 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2ksm s THR 90 N -0.67 4.48 -0.03 3.41 -4.23 -1.26 -3.38 115.64 113.95 2ksm s THR 90 Ca 0.00 -1.17 0.06 0.00 -1.18 0.00 0.00 61.69 59.40 2ksm s THR 90 Cb 0.00 -3.32 -0.01 0.00 1.34 0.00 0.00 72.50 70.50 2ksm s THR 90 CO 0.00 -0.18 -0.23 -0.69 -0.54 0.00 0.00 174.62 172.98 2ksm s VAL 91 N -1.86 1.82 -0.22 2.29 1.01 -1.12 -4.16 120.40 118.16 2ksm s VAL 91 Ca 0.31 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2ksm s VAL 91 Cb -0.09 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.79 2ksm s VAL 91 CO 0.24 0.51 -0.15 -0.89 0.00 0.00 0.00 175.10 174.81 2ksm s THR 92 N -0.35 2.23 -0.08 3.92 2.01 -1.09 -2.06 115.64 120.22 2ksm s THR 92 Ca 0.03 -1.18 -0.01 0.00 0.31 0.00 0.00 61.69 60.84 2ksm s THR 92 Cb -0.11 -2.09 0.03 0.00 0.01 0.00 0.00 72.50 70.34 2ksm s THR 92 CO 0.01 0.30 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.45 2ksm s LEU 93 N 1.23 0.87 -0.08 4.42 1.02 -1.13 -1.36 118.68 123.66 2ksm s LEU 93 Ca -0.00 -0.17 -0.04 0.00 0.02 0.00 0.00 54.13 53.94 2ksm s LEU 93 Cb -0.16 -0.59 0.04 0.00 0.02 0.00 0.00 46.19 45.50 2ksm s LEU 93 CO -0.09 -0.15 0.18 0.27 0.02 0.00 0.00 176.35 176.58 2ksm s ILE 94 N 1.79 -0.04 0.00 -0.59 -4.36 -0.91 -1.19 121.20 115.89 2ksm s ILE 94 Ca 0.04 0.16 0.00 0.00 -0.26 0.00 0.00 60.65 60.59 2ksm s ILE 94 Cb -0.13 -0.29 0.00 0.00 1.25 0.00 0.00 42.46 43.30 2ksm s ILE 94 CO -0.06 0.07 0.00 0.61 0.24 0.00 0.00 174.94 175.80 2ksm n GLY 95 N 4.18 0.69 3.11 6.27 0.00 -1.23 -2.44 105.19 115.77 2ksm n GLY 95 Ca -0.26 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 2ksm n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ksm s ASP 96 N 1.75 2.73 0.18 1.61 1.11 -1.26 -2.56 116.67 120.24 2ksm s ASP 96 Ca 0.00 -0.50 0.05 0.00 0.18 0.00 0.00 52.55 52.28 2ksm s ASP 96 Cb 0.00 -1.24 -0.04 0.00 1.07 0.00 0.00 42.92 42.71 2ksm s ASP 96 CO 0.00 0.05 0.18 -0.36 1.18 0.00 0.00 175.17 176.22 2ksm s PHE 97 N 0.87 3.20 0.03 4.23 0.40 0.27 -4.91 117.98 122.08 2ksm s PHE 97 Ca -0.08 -0.02 -0.17 0.00 -0.60 0.00 0.00 56.93 56.07 2ksm s PHE 97 Cb -0.15 -1.52 -0.25 0.00 0.51 0.00 0.00 43.02 41.61 2ksm s PHE 97 CO -0.01 0.52 1.12 -1.00 0.70 0.00 0.00 175.22 176.54 2ksm h PRO 98 N 2.15 0.54 0.00 0.24 0.13 -1.82 0.31 132.00 133.56 2ksm h PRO 98 Ca -0.48 -0.62 -0.22 0.00 -0.87 0.00 0.00 66.00 63.80 2ksm h PRO 98 Cb 1.21 0.19 -0.06 0.00 0.13 0.00 0.00 31.00 32.47 2ksm h PRO 98 CO 0.63 1.24 -0.21 -0.25 -0.23 0.00 0.00 178.00 179.18 2ksm n ASP 99 N -4.02 0.01 -0.08 1.44 8.00 -1.26 -3.15 116.55 117.49 2ksm n ASP 99 Ca -0.11 -1.99 -0.14 0.00 0.71 0.00 0.00 54.79 53.26 2ksm n ASP 99 Cb 0.81 0.69 -0.14 0.00 -0.02 0.00 0.00 41.12 42.45 2ksm n ASP 99 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ksm n GLU 100 N -0.32 0.68 0.31 -1.24 1.02 -1.26 -4.16 120.64 115.67 2ksm n GLU 100 Ca 0.02 0.13 0.17 0.00 -0.02 0.00 0.00 57.16 57.46 2ksm n GLU 100 Cb 0.27 -1.59 1.00 0.00 -0.02 0.00 0.00 31.44 31.10 2ksm n GLU 100 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ksm h ALA 101 N 0.55 1.40 -0.32 0.62 0.00 -2.03 -0.60 119.26 118.88 2ksm h ALA 101 Ca -0.50 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.50 2ksm h ALA 101 Cb 2.07 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.85 2ksm h ALA 101 CO 0.01 -0.02 0.24 0.00 0.00 0.00 0.00 179.25 179.48 2ksm h ALA 102 N 1.98 2.28 -0.48 0.00 0.00 -2.00 0.02 119.26 121.06 2ksm h ALA 102 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2ksm h ALA 102 Cb 0.03 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2ksm h ALA 102 CO -0.00 -0.40 0.11 1.57 0.00 0.00 0.00 179.25 180.53 2ksm h LYS 103 N 0.00 0.73 -0.86 0.00 2.10 -1.35 -2.77 116.57 114.41 2ksm h LYS 103 Ca 0.15 -0.14 0.09 0.00 -2.00 0.00 0.00 60.65 58.75 2ksm h LYS 103 Cb 0.62 -0.11 -0.07 0.00 -0.90 0.00 0.00 32.23 31.77 2ksm h LYS 103 CO -0.00 0.67 0.52 0.00 -2.00 0.00 0.00 179.45 178.63 2ksm h ALA 104 N 1.41 1.23 -0.43 0.07 0.00 -1.14 1.24 119.26 121.65 2ksm h ALA 104 Ca 0.16 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2ksm h ALA 104 Cb 0.28 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2ksm h ALA 104 CO -0.00 0.18 -0.07 0.00 0.00 0.00 0.00 179.25 179.36 2ksm h ALA 105 N 1.45 1.08 0.09 0.00 0.00 -1.57 -1.89 119.26 118.42 2ksm h ALA 105 Ca 0.41 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 2ksm h ALA 105 Cb 0.32 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2ksm h ALA 105 CO -0.23 0.57 -0.69 1.25 0.00 0.00 0.00 179.25 180.16 2ksm h LEU 106 N 0.68 0.30 -0.43 0.00 6.46 -1.27 -3.35 115.31 117.70 2ksm h LEU 106 Ca 0.12 -0.93 0.09 0.00 -0.12 0.00 0.00 57.88 57.04 2ksm h LEU 106 Cb 0.52 -0.10 -0.09 0.00 -0.73 0.00 0.00 40.66 40.26 2ksm h LEU 106 CO 0.03 1.32 -0.18 0.24 -0.62 0.00 0.00 178.44 179.22 2ksm h MET 107 N -0.57 -0.09 0.00 1.25 2.86 0.15 0.69 114.93 119.22 2ksm h MET 107 Ca -0.13 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2ksm h MET 107 Cb 1.46 0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.14 2ksm h MET 107 CO 0.08 -0.06 0.61 1.79 1.06 0.00 0.00 176.91 180.39 2ksm h THR 108 N -0.10 0.00 0.19 2.22 1.35 -1.48 1.47 112.91 116.57 2ksm h THR 108 Ca 0.21 0.00 -0.32 0.00 -0.55 0.00 0.00 66.41 65.75 2ksm h THR 108 Cb 0.42 0.36 0.02 0.00 -1.73 0.00 0.00 68.15 67.22 2ksm h THR 108 CO -0.50 0.00 -1.47 0.00 -0.25 0.00 0.00 175.52 173.30 2ksm h ALA 109 N 0.75 0.01 -0.86 6.62 0.00 0.25 -3.30 119.26 122.75 2ksm h ALA 109 Ca 0.00 -0.95 0.02 0.00 0.00 0.00 0.00 54.91 53.98 2ksm h ALA 109 Cb 1.22 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.16 2ksm h ALA 109 CO 0.00 0.88 0.56 -0.07 0.00 0.00 0.00 179.25 180.63 2ksm h LEU 110 N 0.11 0.95 -0.50 0.00 3.38 0.22 -1.57 115.31 117.91 2ksm h LEU 110 Ca -0.24 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2ksm h LEU 110 Cb 2.09 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 42.61 2ksm h LEU 110 CO 0.23 0.67 0.86 -1.13 0.09 0.00 0.00 178.44 179.16 2ksm h ASN 111 N 1.12 0.00 0.57 -0.43 -0.73 -1.55 2.37 115.58 116.93 2ksm h ASN 111 Ca 0.33 0.00 -0.28 0.00 1.87 0.00 0.00 56.30 58.21 2ksm h ASN 111 Cb -0.06 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.50 2ksm h ASN 111 CO -0.08 0.00 -1.48 1.23 -0.37 0.00 0.00 177.43 176.72 2ksm h GLY 112 N 0.00 0.15 0.85 1.57 0.00 -1.49 -3.35 103.07 100.80 2ksm h GLY 112 Ca 0.03 -0.38 -0.20 0.00 0.00 0.00 0.00 47.33 46.77 2ksm h GLY 112 CO -0.00 0.33 -1.58 1.04 0.00 0.00 0.00 176.54 176.34 2ksm n LEU 113 N -3.33 0.74 -4.32 3.11 7.99 0.74 -4.90 117.00 117.04 2ksm n LEU 113 Ca -0.14 0.33 -0.55 0.00 -0.01 0.00 0.00 56.01 55.65 2ksm n LEU 113 Cb 1.02 0.12 -0.12 0.00 -0.11 0.00 0.00 43.42 44.34 2ksm n LEU 113 CO 0.48 0.21 1.84 -0.11 -1.51 0.00 0.00 177.39 178.29 2ksm n LEU 114 N -2.87 0.84 -4.61 2.23 7.94 0.22 -4.90 117.00 115.84 2ksm n LEU 114 Ca -0.13 0.54 -0.25 0.00 -1.11 0.00 0.00 56.01 55.07 2ksm n LEU 114 Cb 0.89 -0.95 -0.09 0.00 0.53 0.00 0.00 43.42 43.80 2ksm n LEU 114 CO 0.43 -0.77 -0.32 0.00 -1.11 0.00 0.00 177.39 175.62 2ksm s ALA 115 N 6.81 3.15 -0.22 1.96 0.00 -1.26 -5.00 121.76 127.20 2ksm s ALA 115 Ca 1.22 -1.94 -0.29 0.00 0.00 0.00 0.00 51.96 50.94 2ksm s ALA 115 Cb -1.36 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.37 2ksm s ALA 115 CO 0.60 0.10 1.50 -1.25 0.00 0.00 0.00 175.76 176.71 2ksm s PRO 116 N -3.69 3.92 0.00 0.00 0.04 -1.26 -2.37 135.00 131.64 2ksm s PRO 116 Ca 0.34 1.62 0.00 0.00 0.04 0.00 0.00 61.00 63.00 2ksm s PRO 116 Cb -0.01 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.57 2ksm s PRO 116 CO 0.19 -1.13 0.00 0.41 0.04 0.00 0.00 177.00 176.50 2ksm n GLY 117 N 4.39 0.70 3.75 0.56 0.00 -1.26 -5.04 105.19 108.29 2ksm n GLY 117 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2ksm n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ksm s VAL 118 N -2.14 3.84 -0.08 1.61 0.11 -1.00 -5.04 120.40 117.71 2ksm s VAL 118 Ca 0.00 1.71 -0.05 0.00 -2.93 0.00 0.00 61.98 60.71 2ksm s VAL 118 Cb 0.00 -4.09 -0.04 0.00 -1.53 0.00 0.00 36.38 30.72 2ksm s VAL 118 CO 0.00 0.35 0.11 0.20 -3.33 0.00 0.00 175.10 172.43 2ksm s ASN 119 N -0.54 6.09 -0.03 3.54 0.01 -1.22 -4.92 114.94 117.87 2ksm s ASN 119 Ca 0.46 0.35 0.04 0.00 -0.71 0.00 0.00 52.86 53.00 2ksm s ASN 119 Cb -0.29 -1.90 -0.01 0.00 0.41 0.00 0.00 41.25 39.47 2ksm s ASN 119 CO 0.36 0.37 -0.14 -0.69 -1.51 0.00 0.00 177.10 175.48 2ksm s VAL 120 N -1.07 1.18 -0.44 1.60 1.01 -1.26 -2.80 120.40 118.62 2ksm s VAL 120 Ca 0.18 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2ksm s VAL 120 Cb -0.12 -1.01 0.16 0.00 0.00 0.00 0.00 36.38 35.41 2ksm s VAL 120 CO 0.07 0.34 0.32 -0.63 0.00 0.00 0.00 175.10 175.21 2ksm s ILE 121 N -0.10 0.74 -0.20 2.22 1.01 -0.87 -4.96 121.20 119.03 2ksm s ILE 121 Ca 0.01 -2.67 -0.02 0.00 0.00 0.00 0.00 60.65 57.97 2ksm s ILE 121 Cb -0.08 -1.51 -0.00 0.00 0.01 0.00 0.00 42.46 40.87 2ksm s ILE 121 CO 0.01 -1.12 -0.09 1.51 0.00 0.00 0.00 174.94 175.24 2ksm s ASP 122 N 0.09 3.97 -0.27 3.58 1.47 -1.26 -2.82 116.67 121.44 2ksm s ASP 122 Ca 0.27 -0.46 0.00 0.00 1.18 0.00 0.00 52.55 53.55 2ksm s ASP 122 Cb -0.05 -1.66 0.08 0.00 -0.34 0.00 0.00 42.92 40.94 2ksm s ASP 122 CO -0.13 -0.00 0.02 -1.10 0.68 0.00 0.00 175.17 174.63 2ksm s GLN 123 N 1.35 1.20 0.01 2.11 1.11 -0.33 -5.00 119.66 120.12 2ksm s GLN 123 Ca 0.04 -1.09 0.07 0.00 0.01 0.00 0.00 55.36 54.39 2ksm s GLN 123 Cb -0.14 -2.45 -0.02 0.00 -1.01 0.00 0.00 33.01 29.39 2ksm s GLN 123 CO -0.05 -0.78 -0.21 0.42 0.01 0.00 0.00 175.29 174.68 2ksm s ILE 124 N 1.44 1.68 0.08 1.08 1.01 -1.26 -3.48 121.20 121.75 2ksm s ILE 124 Ca 0.02 -1.04 0.02 0.00 0.00 0.00 0.00 60.65 59.65 2ksm s ILE 124 Cb -0.18 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.83 2ksm s ILE 124 CO -0.12 0.36 0.15 -1.00 0.00 0.00 0.00 174.94 174.32 2ksm s HIS 125 N -0.63 3.34 0.16 3.97 3.76 -1.06 -4.87 115.29 119.97 2ksm s HIS 125 Ca 0.08 0.15 -0.16 0.00 -0.15 0.00 0.00 55.06 54.98 2ksm s HIS 125 Cb -0.08 -1.68 -0.07 0.00 1.11 0.00 0.00 32.58 31.86 2ksm s HIS 125 CO 0.00 0.55 0.59 0.08 -0.85 0.00 0.00 174.74 175.11 2ksm s VAL 126 N -1.47 4.79 0.10 -0.90 1.01 -1.26 0.97 120.40 123.65 2ksm s VAL 126 Ca 0.32 0.94 -0.09 0.00 0.00 0.00 0.00 61.98 63.14 2ksm s VAL 126 Cb -0.12 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2ksm s VAL 126 CO 0.25 0.25 0.22 -1.81 0.00 0.00 0.00 175.10 174.01 2ksm s ASP 127 N -1.68 0.08 0.00 3.32 1.11 0.11 -4.89 116.67 114.72 2ksm s ASP 127 Ca 0.38 -0.64 0.00 0.00 0.18 0.00 0.00 52.55 52.48 2ksm s ASP 127 Cb -0.15 0.36 0.00 0.00 1.07 0.00 0.00 42.92 44.20 2ksm s ASP 127 CO 0.19 -0.76 0.68 -2.65 1.18 0.00 0.00 175.17 173.82 2ksm n PRO 128 N -0.09 0.00 -2.51 8.23 -0.02 -1.26 -4.22 135.00 135.13 2ksm n PRO 128 Ca -0.14 0.68 -0.04 0.00 -2.02 0.00 0.00 63.50 61.98 2ksm n PRO 128 Cb 0.63 -1.17 0.04 0.00 -0.02 0.00 0.00 33.50 32.98 2ksm n PRO 128 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2ksm n VAL 129 N -1.75 0.00 -1.54 -1.45 3.14 -1.26 -4.76 118.33 110.70 2ksm n VAL 129 Ca 0.00 -0.84 -0.39 0.00 -2.96 0.00 0.00 64.34 60.15 2ksm n VAL 129 Cb 0.00 0.74 0.04 0.00 -1.06 0.00 0.00 33.84 33.55 2ksm n VAL 129 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 2ksm n VAL 130 N -0.60 2.82 -2.03 1.55 0.24 -1.26 -4.78 118.33 114.27 2ksm n VAL 130 Ca -0.16 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.33 2ksm n VAL 130 Cb 0.71 -0.92 -0.04 0.00 -1.47 0.00 0.00 33.84 32.12 2ksm n VAL 130 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2ksm s ARG 131 N -2.30 2.55 0.38 7.34 0.52 -1.26 -4.88 118.95 121.29 2ksm s ARG 131 Ca 0.70 0.07 0.04 0.00 -0.52 0.00 0.00 55.73 56.03 2ksm s ARG 131 Cb -0.46 -4.81 -0.03 0.00 0.52 0.00 0.00 34.95 30.18 2ksm s ARG 131 CO 0.52 -3.17 0.16 -1.54 0.02 0.00 0.00 175.30 171.29 2ksm s SER 132 N 8.18 2.41 0.01 0.23 1.04 -1.26 -4.61 113.70 119.69 2ksm s SER 132 Ca 0.70 -1.67 -0.30 0.00 0.48 0.00 0.00 55.95 55.15 2ksm s SER 132 Cb -0.09 0.50 -0.05 0.00 0.10 0.00 0.00 66.02 66.48 2ksm s SER 132 CO 0.08 -0.95 1.20 -0.22 0.98 0.00 0.00 173.24 174.32 2ksm s LEU 133 N -3.53 4.33 -0.31 2.42 2.96 -1.26 -4.99 118.68 118.30 2ksm s LEU 133 Ca 0.29 1.92 -0.24 0.00 -0.22 0.00 0.00 54.13 55.87 2ksm s LEU 133 Cb 0.03 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.15 2ksm s LEU 133 CO 0.17 -0.51 0.83 1.51 -1.32 0.00 0.00 176.35 177.03 2ksm s ASP 134 N 1.26 6.69 0.00 3.68 -4.77 -1.26 -4.91 116.67 117.36 2ksm s ASP 134 Ca 0.57 0.69 0.25 0.00 -3.30 0.00 0.00 52.55 50.76 2ksm s ASP 134 Cb -0.27 -2.42 0.61 0.00 -1.09 0.00 0.00 42.92 39.74 2ksm s ASP 134 CO 0.26 -0.66 1.49 2.22 0.70 0.00 0.00 175.17 179.19 2ksm n PHE 135 N 6.31 0.12 -0.19 2.11 1.16 -1.26 -4.41 117.46 121.30 2ksm n PHE 135 Ca 0.05 -0.06 0.28 0.00 -1.87 0.00 0.00 57.45 55.84 2ksm n PHE 135 Cb 0.48 0.00 0.47 0.00 -1.61 0.00 0.00 39.48 38.82 2ksm n PHE 135 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 2ksm h SER 136 N 3.45 0.00 -0.35 5.98 0.02 -1.91 2.33 113.55 123.08 2ksm h SER 136 Ca 0.00 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.69 2ksm h SER 136 Cb 0.74 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.06 2ksm h SER 136 CO 0.00 0.00 -0.68 -1.20 -1.14 0.00 0.00 176.83 173.81 2ksm n SER 137 N -3.30 3.13 0.19 3.07 7.64 -1.26 -4.63 113.62 118.46 2ksm n SER 137 Ca 0.22 -3.71 0.12 0.00 1.01 0.00 0.00 58.87 56.51 2ksm n SER 137 Cb 1.45 -0.43 0.13 0.00 -1.01 0.00 0.00 64.21 64.35 2ksm n SER 137 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ksm h ALA 138 N 1.58 0.88 0.31 -0.43 0.00 0.37 -3.26 119.26 118.72 2ksm h ALA 138 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2ksm h ALA 138 Cb 1.28 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2ksm h ALA 138 CO 0.35 0.00 -0.35 0.93 0.00 0.00 0.00 179.25 180.18 2ksm h GLU 139 N 0.00 -0.64 -1.01 0.00 4.39 -1.76 1.99 114.58 117.55 2ksm h GLU 139 Ca 0.00 0.04 0.23 0.00 0.34 0.00 0.00 59.36 59.97 2ksm h GLU 139 Cb 1.00 0.15 -0.11 0.00 -0.10 0.00 0.00 28.75 29.68 2ksm h GLU 139 CO 0.00 -0.43 0.61 -1.00 -1.16 0.00 0.00 179.01 177.03 2ksm h PRO 140 N -0.66 0.60 0.12 2.33 0.13 -1.94 0.81 132.00 133.39 2ksm h PRO 140 Ca -0.04 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 2ksm h PRO 140 Cb 0.59 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.58 2ksm h PRO 140 CO -0.06 0.40 -0.06 0.28 -0.23 0.00 0.00 178.00 178.33 2ksm h VAL 141 N 0.62 0.00 -1.04 1.56 2.07 -1.26 -2.10 116.25 116.10 2ksm h VAL 141 Ca 0.61 -0.18 0.27 0.00 0.82 0.00 0.00 66.70 68.23 2ksm h VAL 141 Cb 1.14 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.80 2ksm h VAL 141 CO -0.42 0.00 0.64 -0.26 0.02 0.00 0.00 177.57 177.56 2ksm h PHE 142 N -0.34 0.83 -0.15 1.57 -1.00 0.33 1.35 116.94 119.53 2ksm h PHE 142 Ca -0.02 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.74 2ksm h PHE 142 Cb 0.12 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 2ksm h PHE 142 CO 0.06 0.02 -0.15 1.79 -1.61 0.00 0.00 178.31 178.42 2ksm h THR 143 N 0.45 1.19 0.00 -1.55 1.35 0.58 0.80 112.91 115.73 2ksm h THR 143 Ca 0.64 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2ksm h THR 143 Cb 1.47 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 2ksm h THR 143 CO -0.41 0.27 0.00 0.00 -0.25 0.00 0.00 175.52 175.13 2ksm h ALA 144 N 1.61 1.00 -0.30 6.62 0.00 0.25 -2.79 119.26 125.66 2ksm h ALA 144 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2ksm h ALA 144 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2ksm h ALA 144 CO 0.03 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.15 2ksm n SER 145 N -2.95 2.78 -0.06 0.00 3.41 -0.43 -4.36 113.62 112.02 2ksm n SER 145 Ca 0.02 -1.93 -0.08 0.00 -0.26 0.00 0.00 58.87 56.61 2ksm n SER 145 Cb 0.35 -0.20 -0.02 0.00 -0.26 0.00 0.00 64.21 64.09 2ksm n SER 145 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2ksm h VAL 146 N 2.01 0.92 0.00 -3.33 2.07 -0.61 -2.00 116.25 115.31 2ksm h VAL 146 Ca 0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2ksm h VAL 146 Cb 0.69 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2ksm h VAL 146 CO 0.00 0.03 0.00 -0.81 0.02 0.00 0.00 177.57 176.81 2ksm n PRO 147 N -5.05 0.39 -3.46 1.57 -0.04 -1.26 -3.99 135.00 123.16 2ksm n PRO 147 Ca -0.02 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.16 2ksm n PRO 147 Cb 0.09 -1.18 -0.11 0.00 -0.04 0.00 0.00 33.50 32.26 2ksm n PRO 147 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2ksm s ILE 148 N -1.09 0.41 -1.98 0.52 1.01 -0.75 -4.97 121.20 114.34 2ksm s ILE 148 Ca 0.00 -2.31 0.00 0.00 0.00 0.00 0.00 60.65 58.34 2ksm s ILE 148 Cb 0.00 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.17 2ksm s ILE 148 CO 0.00 -1.10 0.85 -0.81 0.00 0.00 0.00 174.94 173.88 2ksm n PRO 149 N 3.36 0.86 -0.92 2.79 -0.04 -1.26 -2.98 135.00 136.82 2ksm n PRO 149 Ca 0.21 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.68 2ksm n PRO 149 Cb 0.42 -1.01 0.16 0.00 -0.04 0.00 0.00 33.50 33.04 2ksm n PRO 149 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ksm n ASP 150 N -0.49 2.18 -4.94 3.54 8.00 -1.08 -0.89 116.55 122.86 2ksm n ASP 150 Ca 0.00 -3.73 -0.26 0.00 0.71 0.00 0.00 54.79 51.51 2ksm n ASP 150 Cb 0.00 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.59 2ksm n ASP 150 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2ksm s PHE 151 N -3.09 3.46 -0.03 1.24 2.19 -0.94 -3.63 117.98 117.18 2ksm s PHE 151 Ca 0.40 0.11 0.06 0.00 0.33 0.00 0.00 56.93 57.82 2ksm s PHE 151 Cb 0.38 -1.65 -0.01 0.00 -1.31 0.00 0.00 43.02 40.42 2ksm s PHE 151 CO -0.06 0.51 -0.22 0.20 1.83 0.00 0.00 175.22 177.49 2ksm s GLY 152 N -3.24 1.12 -0.12 13.12 0.00 -0.48 -2.69 107.32 115.02 2ksm s GLY 152 Ca 0.34 -0.93 -0.00 0.00 0.00 0.00 0.00 44.72 44.13 2ksm s GLY 152 CO 0.28 -0.66 -0.10 -2.27 0.00 0.00 0.00 173.10 170.35 2ksm s LEU 153 N -0.30 1.38 -0.03 0.66 1.98 -0.94 -3.16 118.68 118.27 2ksm s LEU 153 Ca 0.02 -0.37 0.01 0.00 -2.89 0.00 0.00 54.13 50.90 2ksm s LEU 153 Cb -0.11 -0.96 0.02 0.00 0.66 0.00 0.00 46.19 45.80 2ksm s LEU 153 CO 0.01 -0.09 -0.01 -0.54 -1.89 0.00 0.00 176.35 173.83 2ksm s LYS 154 N 1.59 0.39 -0.07 1.98 -0.14 -1.07 -2.06 119.74 120.35 2ksm s LYS 154 Ca 0.04 0.01 0.03 0.00 -1.36 0.00 0.00 55.97 54.70 2ksm s LYS 154 Cb -0.13 -0.50 -0.02 0.00 -1.68 0.00 0.00 37.83 35.50 2ksm s LYS 154 CO -0.09 -0.09 -0.17 0.08 -0.76 0.00 0.00 175.35 174.32 2ksm s VAL 155 N 0.80 2.75 0.00 3.17 1.01 -1.02 -0.42 120.40 126.69 2ksm s VAL 155 Ca -0.08 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2ksm s VAL 155 Cb -0.12 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.19 2ksm s VAL 155 CO -0.01 0.57 0.00 1.21 0.00 0.00 0.00 175.10 176.87 2ksm n GLU 156 N 2.80 3.79 0.05 2.72 4.07 0.73 -3.05 120.64 131.75 2ksm n GLU 156 Ca -0.17 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 56.91 2ksm n GLU 156 Cb 0.52 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.89 2ksm n GLU 156 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2ksm h ARG 157 N 0.00 -0.13 0.00 5.31 3.08 -1.98 -3.41 114.38 117.25 2ksm h ARG 157 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ksm h ARG 157 Cb 0.00 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2ksm h ARG 157 CO 0.00 -0.09 -0.01 -0.40 -1.07 0.00 0.00 179.97 178.41 2ksm n ASP 158 N -2.66 1.99 -4.48 7.04 5.75 -1.26 -4.93 116.55 118.00 2ksm n ASP 158 Ca -0.02 -2.21 -0.23 0.00 -0.01 0.00 0.00 54.79 52.32 2ksm n ASP 158 Cb 0.05 -0.10 -0.10 0.00 -1.03 0.00 0.00 41.12 39.94 2ksm n ASP 158 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2ksm s THR 159 N -1.38 1.93 -0.04 2.12 -4.23 -1.26 -4.37 115.64 108.41 2ksm s THR 159 Ca 0.07 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 2ksm s THR 159 Cb 0.06 -2.52 0.03 0.00 1.34 0.00 0.00 72.50 71.41 2ksm s THR 159 CO 0.01 -0.26 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.13 2ksm s VAL 160 N -2.82 0.26 -0.03 2.29 1.01 0.13 -0.19 120.40 121.05 2ksm s VAL 160 Ca 0.31 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.36 2ksm s VAL 160 Cb 0.03 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 2ksm s VAL 160 CO 0.14 0.18 -0.03 0.42 0.00 0.00 0.00 175.10 175.80 2ksm s THR 161 N 1.19 3.93 -0.14 3.92 -4.23 0.44 -1.68 115.64 119.07 2ksm s THR 161 Ca -0.07 -0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 59.86 2ksm s THR 161 Cb -0.13 -2.69 0.04 0.00 1.34 0.00 0.00 72.50 71.05 2ksm s THR 161 CO -0.02 0.47 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.73 2ksm s LEU 162 N -1.24 1.28 -0.06 4.79 1.02 -0.31 -2.60 118.68 121.56 2ksm s LEU 162 Ca 0.16 -0.50 -0.02 0.00 0.02 0.00 0.00 54.13 53.79 2ksm s LEU 162 Cb -0.11 -0.78 0.04 0.00 0.02 0.00 0.00 46.19 45.36 2ksm s LEU 162 CO 0.06 -0.18 0.12 0.42 0.02 0.00 0.00 176.35 176.79 2ksm s THR 163 N 1.74 -0.06 -0.14 5.49 -4.23 -1.19 0.16 115.64 117.42 2ksm s THR 163 Ca 0.02 0.20 -0.23 0.00 -1.18 0.00 0.00 61.69 60.50 2ksm s THR 163 Cb -0.14 -0.21 0.06 0.00 1.34 0.00 0.00 72.50 73.54 2ksm s THR 163 CO -0.07 0.08 0.58 -0.83 -0.54 0.00 0.00 174.62 173.84 2ksm s GLY 164 N 1.20 -0.45 -0.24 3.99 0.00 -1.26 -1.38 107.32 109.18 2ksm s GLY 164 Ca -0.09 1.36 -0.29 0.00 0.00 0.00 0.00 44.72 45.71 2ksm s GLY 164 CO -0.05 1.09 1.56 -0.51 0.00 0.00 0.00 173.10 175.19 2ksm s THR 165 N -0.42 3.77 -0.64 0.90 -4.23 -1.24 -3.91 115.64 109.86 2ksm s THR 165 Ca -0.06 0.86 0.01 0.00 -1.18 0.00 0.00 61.69 61.33 2ksm s THR 165 Cb -0.03 -3.79 0.16 0.00 1.34 0.00 0.00 72.50 70.18 2ksm s THR 165 CO 0.04 -0.33 0.43 0.00 -0.54 0.00 0.00 174.62 174.22 2ksm s ALA 166 N 5.08 3.62 -0.94 3.99 0.00 -1.26 -4.90 121.76 127.34 2ksm s ALA 166 Ca 0.69 -3.46 0.00 0.00 0.00 0.00 0.00 51.96 49.18 2ksm s ALA 166 Cb -0.23 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.48 2ksm s ALA 166 CO 0.28 -2.08 0.48 -2.30 0.00 0.00 0.00 175.76 172.14 2ksm n PRO 167 N 2.89 0.00 0.00 0.00 -0.02 -1.26 -0.10 135.00 136.51 2ksm n PRO 167 Ca 0.11 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 2ksm n PRO 167 Cb 0.35 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 2ksm n PRO 167 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2ksm n SER 168 N -0.98 1.78 0.00 2.55 3.41 -1.26 -5.05 113.62 114.07 2ksm n SER 168 Ca 0.00 -0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2ksm n SER 168 Cb 0.08 0.55 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 2ksm n SER 168 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ksm n SER 169 N -0.73 0.00 -0.02 4.04 3.41 0.85 -4.41 113.62 116.77 2ksm n SER 169 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 2ksm n SER 169 Cb 0.00 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.43 2ksm n SER 169 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2ksm h GLU 170 N 0.00 0.42 -1.48 4.33 4.39 -1.97 -1.59 114.58 118.68 2ksm h GLU 170 Ca 0.00 -0.03 0.44 0.00 0.34 0.00 0.00 59.36 60.11 2ksm h GLU 170 Cb 0.00 -0.09 -0.08 0.00 -0.10 0.00 0.00 28.75 28.48 2ksm h GLU 170 CO 0.00 0.28 1.04 1.25 -1.16 0.00 0.00 179.01 180.42 2ksm h HIS 171 N 0.43 0.14 0.00 4.33 2.76 -1.92 1.98 115.15 122.88 2ksm h HIS 171 Ca 0.20 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.32 2ksm h HIS 171 Cb 0.27 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2ksm h HIS 171 CO -0.00 -0.03 -0.41 -0.22 -1.30 0.00 0.00 177.93 175.97 2ksm h LYS 172 N 0.05 0.00 -0.06 5.26 3.11 -1.67 -3.37 116.57 119.89 2ksm h LYS 172 Ca 0.75 0.00 0.02 0.00 -2.81 0.00 0.00 60.65 58.61 2ksm h LYS 172 Cb 2.80 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 33.98 2ksm h LYS 172 CO -0.10 0.26 -0.43 0.22 -2.81 0.00 0.00 179.45 176.59 2ksm h ASP 173 N 0.00 -1.35 -1.12 4.20 3.58 0.31 0.34 116.42 122.38 2ksm h ASP 173 Ca -0.01 0.16 0.31 0.00 0.42 0.00 0.00 57.03 57.91 2ksm h ASP 173 Cb 1.23 0.52 -0.06 0.00 1.72 0.00 0.00 39.33 42.73 2ksm h ASP 173 CO 0.03 -0.40 0.78 0.00 -2.88 0.00 0.00 179.24 176.77 2ksm h ALA 174 N -0.59 2.81 -0.36 -0.78 0.00 -1.72 0.36 119.26 118.99 2ksm h ALA 174 Ca 0.02 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2ksm h ALA 174 Cb 0.55 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2ksm h ALA 174 CO -0.32 -1.17 -0.35 0.28 0.00 0.00 0.00 179.25 177.69 2ksm h VAL 175 N 0.12 1.28 -0.23 0.00 2.07 -1.15 -3.04 116.25 115.30 2ksm h VAL 175 Ca 0.57 -1.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.56 2ksm h VAL 175 Cb 1.98 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 2ksm h VAL 175 CO -0.11 0.50 0.08 0.50 0.02 0.00 0.00 177.57 178.56 2ksm h LYS 176 N 0.68 0.35 -1.00 1.57 3.64 0.60 -0.78 116.57 121.63 2ksm h LYS 176 Ca 0.07 -0.07 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 2ksm h LYS 176 Cb 0.90 -0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.59 2ksm h LYS 176 CO 0.08 0.42 0.63 0.00 -2.27 0.00 0.00 179.45 178.31 2ksm h ARG 177 N 0.20 0.99 -0.14 1.90 3.08 -1.48 0.45 114.38 119.38 2ksm h ARG 177 Ca 0.07 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 59.94 2ksm h ARG 177 Cb 0.21 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2ksm h ARG 177 CO -0.00 0.65 -0.41 0.00 -1.07 0.00 0.00 179.97 179.14 2ksm h ALA 178 N 1.52 0.24 0.53 0.04 0.00 -1.39 -2.92 119.26 117.28 2ksm h ALA 178 Ca 0.49 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2ksm h ALA 178 Cb 0.44 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.20 2ksm h ALA 178 CO -0.25 0.35 -0.26 0.00 0.00 0.00 0.00 179.25 179.09 2ksm h ALA 179 N 0.53 -0.72 -0.76 0.00 0.00 -0.42 -2.80 119.26 115.09 2ksm h ALA 179 Ca -0.01 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 54.87 2ksm h ALA 179 Cb 1.03 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 18.95 2ksm h ALA 179 CO 0.09 -0.73 -0.11 1.79 0.00 0.00 0.00 179.25 180.29 2ksm h THR 180 N -1.06 0.27 -0.04 0.00 1.35 -0.26 1.03 112.91 114.20 2ksm h THR 180 Ca -0.07 -0.01 0.01 0.00 -0.55 0.00 0.00 66.41 65.79 2ksm h THR 180 Cb 0.62 0.23 -0.00 0.00 -1.73 0.00 0.00 68.15 67.27 2ksm h THR 180 CO 0.12 0.01 0.03 0.28 -0.25 0.00 0.00 175.52 175.71 2ksm h SER 181 N 0.04 0.00 0.78 5.36 0.02 -1.53 -1.91 113.55 116.30 2ksm h SER 181 Ca 0.39 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 61.09 2ksm h SER 181 Cb 0.64 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2ksm h SER 181 CO -0.74 0.00 -1.18 0.74 -1.14 0.00 0.00 176.83 174.51 2ksm h THR 182 N 0.00 1.53 -2.23 -2.27 2.02 0.13 -3.40 112.91 108.70 2ksm h THR 182 Ca 0.02 -3.19 -0.58 0.00 0.77 0.00 0.00 66.41 63.43 2ksm h THR 182 Cb 0.09 2.86 -0.39 0.00 -1.74 0.00 0.00 68.15 68.96 2ksm h THR 182 CO -0.00 0.90 -0.97 0.79 0.37 0.00 0.00 175.52 176.61 2ksm n TRP 183 N -3.42 0.07 0.11 3.16 8.01 -0.41 -4.96 117.44 120.01 2ksm n TRP 183 Ca -0.06 -3.58 -0.19 0.00 -1.31 0.00 0.00 57.50 52.36 2ksm n TRP 183 Cb 0.99 -0.17 -0.15 0.00 -2.01 0.00 0.00 31.31 29.98 2ksm n TRP 183 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2ksm h PRO 184 N 4.70 0.36 -0.01 -0.99 0.13 -1.63 -3.28 132.00 131.29 2ksm h PRO 184 Ca 0.16 -0.61 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2ksm h PRO 184 Cb 0.86 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2ksm h PRO 184 CO 0.48 1.28 0.00 -0.25 -0.23 0.00 0.00 178.00 179.28 2ksm n ASP 185 N -3.58 0.10 -2.18 1.44 8.00 -1.26 -4.79 116.55 114.28 2ksm n ASP 185 Ca -0.13 -1.31 -0.01 0.00 0.71 0.00 0.00 54.79 54.04 2ksm n ASP 185 Cb 1.06 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 42.15 2ksm n ASP 185 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2ksm n MET 186 N -0.78 1.16 -4.13 -1.24 2.81 -1.24 -5.11 117.12 108.59 2ksm n MET 186 Ca 0.17 -0.20 -0.34 0.00 -1.81 0.00 0.00 57.70 55.52 2ksm n MET 186 Cb 0.10 -0.00 -0.15 0.00 -0.71 0.00 0.00 33.22 32.46 2ksm n MET 186 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2ksm s LYS 187 N -2.15 3.20 -0.17 0.03 2.20 -1.26 -5.03 119.74 116.56 2ksm s LYS 187 Ca 0.03 -0.73 0.01 0.00 -0.36 0.00 0.00 55.97 54.93 2ksm s LYS 187 Cb -0.00 -2.76 0.02 0.00 -1.51 0.00 0.00 37.83 33.57 2ksm s LYS 187 CO 0.02 -0.15 -0.20 0.42 -0.36 0.00 0.00 175.35 175.08 2ksm s ILE 188 N 1.25 2.02 -0.36 5.43 1.01 -1.25 0.20 121.20 129.50 2ksm s ILE 188 Ca 0.03 -0.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 2ksm s ILE 188 Cb -0.14 -1.82 0.09 0.00 0.01 0.00 0.00 42.46 40.60 2ksm s ILE 188 CO -0.06 0.53 0.10 0.68 0.00 0.00 0.00 174.94 176.19 2ksm s VAL 189 N 1.25 2.93 -0.73 2.92 -7.23 -0.68 -5.00 120.40 113.85 2ksm s VAL 189 Ca 0.03 -1.91 -0.22 0.00 -1.81 0.00 0.00 61.98 58.07 2ksm s VAL 189 Cb -0.13 -2.93 0.08 0.00 0.56 0.00 0.00 36.38 33.95 2ksm s VAL 189 CO -0.11 -0.48 1.04 0.20 -0.31 0.00 0.00 175.10 175.44 2ksm s ASN 190 N 1.43 6.28 -0.62 4.85 0.01 -1.26 -1.16 114.94 124.46 2ksm s ASN 190 Ca 0.04 -1.19 0.02 0.00 -0.71 0.00 0.00 52.86 51.02 2ksm s ASN 190 Cb -0.21 -2.43 0.16 0.00 0.41 0.00 0.00 41.25 39.17 2ksm s ASN 190 CO -0.04 -1.40 0.41 0.20 -1.51 0.00 0.00 177.10 174.76 2ksm s ASN 191 N 3.74 4.83 0.12 -1.22 0.01 0.12 -4.99 114.94 117.57 2ksm s ASN 191 Ca 0.26 -3.20 -0.07 0.00 -0.71 0.00 0.00 52.86 49.14 2ksm s ASN 191 Cb -0.13 -1.73 -0.06 0.00 0.41 0.00 0.00 41.25 39.74 2ksm s ASN 191 CO 0.06 -0.24 0.40 0.27 -1.51 0.00 0.00 177.10 176.07 2ksm s ILE 192 N -0.55 5.13 -0.05 0.60 -4.36 -1.26 -4.40 121.20 116.30 2ksm s ILE 192 Ca 0.19 0.22 -0.01 0.00 -0.26 0.00 0.00 60.65 60.79 2ksm s ILE 192 Cb -0.19 -3.63 0.03 0.00 1.25 0.00 0.00 42.46 39.93 2ksm s ILE 192 CO -0.05 0.13 0.03 -1.61 0.24 0.00 0.00 174.94 173.68 2ksm s GLU 193 N -2.37 0.19 -0.22 0.37 8.01 -1.25 -4.96 118.70 118.46 2ksm s GLU 193 Ca 0.38 0.26 -0.29 0.00 0.01 0.00 0.00 54.97 55.33 2ksm s GLU 193 Cb -0.13 -0.65 -0.01 0.00 -4.31 0.00 0.00 34.13 29.03 2ksm s GLU 193 CO 0.22 -0.30 1.32 0.14 0.01 0.00 0.00 175.26 176.64 2ksm s VAL 194 N 1.96 4.16 -0.06 2.63 -7.23 -1.26 -4.49 120.40 116.12 2ksm s VAL 194 Ca 0.03 1.37 -0.30 0.00 -1.81 0.00 0.00 61.98 61.27 2ksm s VAL 194 Cb -0.12 -4.02 -0.03 0.00 0.56 0.00 0.00 36.38 32.77 2ksm s VAL 194 CO -0.04 -0.27 1.16 0.42 -0.31 0.00 0.00 175.10 176.07 2ksm s THR 195 N 3.97 4.35 0.00 5.32 -4.23 -1.26 -4.53 115.64 119.25 2ksm s THR 195 Ca 0.57 1.66 0.00 0.00 -1.18 0.00 0.00 61.69 62.74 2ksm s THR 195 Cb -0.20 -4.07 0.00 0.00 1.34 0.00 0.00 72.50 69.57 2ksm s THR 195 CO 0.19 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.89 2ksm n GLY 196 N 3.31 -1.56 3.53 3.99 0.00 -1.26 -5.04 105.19 108.15 2ksm n GLY 196 Ca 0.10 0.56 -0.45 0.00 0.00 0.00 0.00 46.02 46.24 2ksm n GLY 196 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ksm n GLN 197 N 0.00 0.93 -1.08 1.61 1.13 -1.26 -4.91 117.38 113.79 2ksm n GLN 197 Ca 0.00 0.33 -0.31 0.00 -1.94 0.00 0.00 57.00 55.08 2ksm n GLN 197 Cb 0.00 -1.62 0.12 0.00 0.11 0.00 0.00 30.24 28.85 2ksm n GLN 197 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ksm s ALA 198 N -1.13 1.90 0.75 -1.58 0.00 -1.26 -5.01 121.76 115.44 2ksm s ALA 198 Ca 0.61 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.77 2ksm s ALA 198 Cb -0.72 -3.31 0.04 0.00 0.00 0.00 0.00 23.12 19.13 2ksm s ALA 198 CO 0.59 -2.15 1.08 -1.25 0.00 0.00 0.00 175.76 174.03 2ksm s PRO 199 N -4.83 2.43 0.09 0.00 0.04 -1.26 -4.93 135.00 126.54 2ksm s PRO 199 Ca 0.63 1.02 -0.35 0.00 0.04 0.00 0.00 61.00 62.33 2ksm s PRO 199 Cb -0.19 -1.93 -0.18 0.00 0.04 0.00 0.00 34.50 32.24 2ksm s PRO 199 CO 0.57 -1.48 0.92 -2.30 0.04 0.00 0.00 177.00 174.75 2ksm n PRO 200 N -3.39 0.19 -3.23 0.56 -0.02 -1.26 -4.93 135.00 122.91 2ksm n PRO 200 Ca 0.08 0.07 -0.24 0.00 -2.02 0.00 0.00 63.50 61.39 2ksm n PRO 200 Cb 0.54 -1.41 -0.06 0.00 -0.02 0.00 0.00 33.50 32.54 2ksm n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ksm n GLY 201 N 1.75 3.84 0.24 -1.23 0.00 -1.26 -4.97 105.19 103.57 2ksm n GLY 201 Ca 0.19 -2.07 -0.01 0.00 0.00 0.00 0.00 46.02 44.13 2ksm n GLY 201 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ksm h PRO 202 N 3.79 0.54 -0.01 1.61 0.11 -2.05 -3.56 132.00 132.44 2ksm h PRO 202 Ca 0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2ksm h PRO 202 Cb 0.79 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.78 2ksm h PRO 202 CO 0.61 0.36 0.00 -0.35 -0.21 0.00 0.00 178.00 178.42