#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k60 s SER -4 N 0.00 -0.25 0.27 1.61 0.15 -1.26 -4.76 113.70 109.47 2k60 s SER -4 Ca 0.00 0.25 0.12 0.00 0.70 0.00 0.00 55.95 57.02 2k60 s SER -4 Cb 0.00 0.21 0.34 0.00 -1.71 0.00 0.00 66.02 64.86 2k60 s SER -4 CO 0.00 -0.25 1.59 -0.74 1.20 0.00 0.00 173.24 175.04 2k60 h HIS -3 N 2.35 0.00 0.00 3.44 2.76 -2.01 -2.96 115.15 118.73 2k60 h HIS -3 Ca -0.15 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.02 2k60 h HIS -3 Cb 1.17 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.13 2k60 h HIS -3 CO 0.26 0.61 0.00 0.00 -1.30 0.00 0.00 177.93 177.50 2k60 h MET -2 N 0.00 0.00 -2.67 5.26 -0.00 -2.00 -3.26 114.93 112.27 2k60 h MET -2 Ca -0.01 0.00 -0.61 0.00 -0.00 0.00 0.00 59.70 59.08 2k60 h MET -2 Cb 1.15 0.00 -0.42 0.00 -0.00 0.00 0.00 31.60 32.33 2k60 h MET -2 CO 0.08 0.00 -0.57 0.00 -0.00 0.00 0.00 176.91 176.42 2k60 n ALA -1 N -2.06 3.74 -1.69 -3.00 0.00 -1.12 -4.91 120.51 111.47 2k60 n ALA -1 Ca 0.01 -4.65 0.00 0.00 0.00 0.00 0.00 53.44 48.80 2k60 n ALA -1 Cb 0.34 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2k60 n ALA -1 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k60 n SER 0 N 1.43 0.00 -0.47 0.00 2.88 -1.23 -4.23 113.62 112.01 2k60 n SER 0 Ca 0.25 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.84 2k60 n SER 0 Cb 0.38 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.81 2k60 n SER 0 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2k60 n SER 58 N 0.00 -2.63 0.00 -3.46 2.88 -1.26 -4.50 113.62 104.65 2k60 n SER 58 Ca 0.00 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2k60 n SER 58 Cb 0.00 -1.57 0.00 0.00 -0.75 0.00 0.00 64.21 61.89 2k60 n SER 58 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2k60 n GLU 59 N -2.88 0.29 -3.87 -1.46 1.02 -1.26 -5.01 120.64 107.47 2k60 n GLU 59 Ca -0.02 -0.53 -0.09 0.00 -0.02 0.00 0.00 57.16 56.50 2k60 n GLU 59 Cb 0.22 -0.56 -0.07 0.00 -0.02 0.00 0.00 31.44 31.01 2k60 n GLU 59 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k60 s ASP 60 N -0.10 0.12 -1.08 1.62 1.11 -1.26 -4.56 116.67 112.51 2k60 s ASP 60 Ca 0.00 -0.68 -0.17 0.00 0.18 0.00 0.00 52.55 51.89 2k60 s ASP 60 Cb 0.00 0.34 0.14 0.00 1.07 0.00 0.00 42.92 44.47 2k60 s ASP 60 CO 0.00 -0.74 1.33 -0.70 1.18 0.00 0.00 175.17 176.24 2k60 s GLU 61 N -3.87 3.85 -0.14 8.23 2.12 -1.26 -4.54 118.70 123.08 2k60 s GLU 61 Ca 0.06 -2.11 -0.27 0.00 0.36 0.00 0.00 54.97 53.01 2k60 s GLU 61 Cb 0.05 -5.05 -0.26 0.00 0.26 0.00 0.00 34.13 29.13 2k60 s GLU 61 CO -0.10 -1.83 0.69 0.87 -0.54 0.00 0.00 175.26 174.35 2k60 h LYS 62 N 8.05 0.03 -6.36 4.30 1.79 -1.99 -3.45 116.57 118.93 2k60 h LYS 62 Ca 0.25 -0.06 -0.61 0.00 -2.18 0.00 0.00 60.65 58.05 2k60 h LYS 62 Cb 0.95 0.02 -0.24 0.00 -1.58 0.00 0.00 32.23 31.38 2k60 h LYS 62 CO 1.21 1.03 -0.85 -0.51 -1.08 0.00 0.00 179.45 179.25 2k60 s LEU 63 N -8.12 2.25 0.27 2.94 2.01 -1.26 -5.03 118.68 111.74 2k60 s LEU 63 Ca -0.20 -0.64 0.04 0.00 0.01 0.00 0.00 54.13 53.35 2k60 s LEU 63 Cb -0.01 -1.03 0.39 0.00 0.01 0.00 0.00 46.19 45.55 2k60 s LEU 63 CO 0.69 0.14 1.67 0.28 1.01 0.00 0.00 176.35 180.14 2k60 h SER 64 N 4.36 0.34 -0.29 2.29 0.02 -1.94 -3.19 113.55 115.13 2k60 h SER 64 Ca -0.46 -0.14 0.04 0.00 -0.84 0.00 0.00 61.79 60.39 2k60 h SER 64 Cb 1.17 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.57 2k60 h SER 64 CO 0.41 0.72 0.04 0.15 -1.14 0.00 0.00 176.83 177.01 2k60 h PHE 65 N 0.27 0.06 -0.57 3.45 3.57 -1.98 0.25 116.94 121.99 2k60 h PHE 65 Ca 0.02 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 2k60 h PHE 65 Cb 0.85 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 2k60 h PHE 65 CO 0.02 -0.00 0.06 1.05 -2.23 0.00 0.00 178.31 177.20 2k60 h GLU 66 N 0.14 0.94 -0.13 1.11 4.11 -1.93 0.30 114.58 119.12 2k60 h GLU 66 Ca 0.14 -0.25 -0.02 0.00 0.07 0.00 0.00 59.36 59.30 2k60 h GLU 66 Cb 0.16 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 2k60 h GLU 66 CO -0.20 0.90 0.01 0.00 0.07 0.00 0.00 179.01 179.78 2k60 h ALA 67 N 1.18 0.17 0.09 1.06 0.00 -1.42 -0.59 119.26 119.75 2k60 h ALA 67 Ca 0.17 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2k60 h ALA 67 Cb 0.44 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2k60 h ALA 67 CO 0.02 -0.14 -0.29 0.28 0.00 0.00 0.00 179.25 179.11 2k60 h VAL 68 N -0.03 0.37 0.00 0.00 2.07 -0.18 -0.96 116.25 117.52 2k60 h VAL 68 Ca 0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 2k60 h VAL 68 Cb 0.34 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2k60 h VAL 68 CO 0.01 0.00 -0.07 0.08 0.02 0.00 0.00 177.57 177.60 2k60 h ARG 69 N -0.49 0.00 0.11 1.57 0.11 -0.36 -1.48 114.38 113.84 2k60 h ARG 69 Ca 0.04 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.11 2k60 h ARG 69 Cb 0.53 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.61 2k60 h ARG 69 CO -0.19 0.07 -0.05 -0.97 0.10 0.00 0.00 179.97 178.93 2k60 h ASN 70 N 0.00 -0.13 0.19 0.08 -1.24 0.17 0.32 115.58 114.98 2k60 h ASN 70 Ca -0.00 -0.26 -0.08 0.00 0.71 0.00 0.00 56.30 56.67 2k60 h ASN 70 Cb 0.14 0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.21 2k60 h ASN 70 CO 0.01 0.20 -0.29 0.40 -1.29 0.00 0.00 177.43 176.46 2k60 h ILE 71 N -0.47 1.24 -0.11 2.57 5.03 -0.71 -0.71 117.51 124.36 2k60 h ILE 71 Ca -0.02 -1.15 -0.14 0.00 -0.12 0.00 0.00 64.86 63.44 2k60 h ILE 71 Cb 0.38 1.50 -0.01 0.00 -3.03 0.00 0.00 36.82 35.66 2k60 h ILE 71 CO 0.02 0.34 -0.53 0.45 -0.68 0.00 0.00 178.15 177.75 2k60 h HIS 72 N 0.14 0.38 0.00 1.37 3.86 -1.20 -2.97 115.15 116.74 2k60 h HIS 72 Ca 0.02 -0.13 -0.04 0.00 -1.16 0.00 0.00 60.37 59.06 2k60 h HIS 72 Cb 0.59 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 2k60 h HIS 72 CO 0.01 0.78 -0.18 1.57 0.86 0.00 0.00 177.93 180.97 2k60 h LYS 73 N 0.24 0.00 -0.35 2.45 5.09 0.11 -2.71 116.57 121.40 2k60 h LYS 73 Ca 0.01 0.00 0.10 0.00 0.09 0.00 0.00 60.65 60.85 2k60 h LYS 73 Cb 1.02 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.34 2k60 h LYS 73 CO 0.09 0.18 0.57 -0.07 -2.09 0.00 0.00 179.45 178.12 2k60 h LEU 74 N 0.00 0.00 0.00 7.07 3.38 -1.09 0.19 115.31 124.87 2k60 h LEU 74 Ca -0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2k60 h LEU 74 Cb 0.63 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 2k60 h LEU 74 CO 0.02 0.00 -1.57 0.24 0.09 0.00 0.00 178.44 177.22 2k60 h MET 75 N 0.00 0.00 -6.34 1.13 2.86 -1.67 -3.46 114.93 107.45 2k60 h MET 75 Ca 0.17 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 57.25 2k60 h MET 75 Cb 1.30 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.92 2k60 h MET 75 CO -0.00 0.45 -0.01 0.34 1.06 0.00 0.00 176.91 178.75 2k60 s ASP 76 N -6.03 7.03 -0.03 1.22 -1.08 0.06 -2.55 116.67 115.30 2k60 s ASP 76 Ca -0.04 1.28 -0.21 0.00 -0.52 0.00 0.00 52.55 53.06 2k60 s ASP 76 Cb 0.08 -2.36 -0.29 0.00 -1.46 0.00 0.00 42.92 38.88 2k60 s ASP 76 CO 0.82 0.19 0.95 -0.78 0.52 0.00 0.00 175.17 176.87 2k60 h ASP 77 N 4.09 0.50 0.21 -0.34 3.58 -1.81 -3.36 116.42 119.29 2k60 h ASP 77 Ca -0.49 -0.90 0.00 0.00 0.42 0.00 0.00 57.03 56.06 2k60 h ASP 77 Cb 1.20 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.10 2k60 h ASP 77 CO 0.64 1.36 -0.90 -0.90 -2.88 0.00 0.00 179.24 176.56 2k60 n ASP 78 N -4.14 0.76 -3.76 2.28 5.75 -1.26 -0.23 116.55 115.95 2k60 n ASP 78 Ca -0.13 -0.63 -0.27 0.00 -0.01 0.00 0.00 54.79 53.75 2k60 n ASP 78 Cb 0.79 0.80 0.05 0.00 -1.03 0.00 0.00 41.12 41.73 2k60 n ASP 78 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k60 n ALA 79 N -1.58 -1.39 1.77 2.12 0.00 -1.26 -4.80 120.51 115.38 2k60 n ALA 79 Ca 0.04 0.23 0.15 0.00 0.00 0.00 0.00 53.44 53.86 2k60 n ALA 79 Cb 0.36 -4.57 0.83 0.00 0.00 0.00 0.00 19.45 16.07 2k60 n ALA 79 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2k60 n ASN 80 N -2.93 0.21 0.00 0.00 6.94 -1.26 -4.84 115.26 113.38 2k60 n ASN 80 Ca -0.01 -0.83 0.00 0.00 -0.02 0.00 0.00 54.58 53.71 2k60 n ASN 80 Cb 0.56 -0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.91 2k60 n ASN 80 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2k60 n GLY 81 N 1.11 0.46 2.74 4.83 0.00 -1.26 -5.04 105.19 108.03 2k60 n GLY 81 Ca 0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 2k60 n GLY 81 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k60 s ASP 82 N -2.09 1.73 -0.16 1.61 1.47 -1.26 -1.20 116.67 116.79 2k60 s ASP 82 Ca 0.00 -0.19 -0.25 0.00 1.18 0.00 0.00 52.55 53.30 2k60 s ASP 82 Cb 0.00 -0.40 -0.02 0.00 -0.34 0.00 0.00 42.92 42.16 2k60 s ASP 82 CO 0.00 -0.23 0.79 0.68 0.68 0.00 0.00 175.17 177.09 2k60 s VAL 83 N 2.00 4.92 0.59 2.11 -7.23 0.11 -4.89 120.40 118.01 2k60 s VAL 83 Ca 0.04 1.56 -0.07 0.00 -1.81 0.00 0.00 61.98 61.69 2k60 s VAL 83 Cb -0.13 -4.10 -0.00 0.00 0.56 0.00 0.00 36.38 32.70 2k60 s VAL 83 CO -0.05 0.07 0.93 -1.81 -0.31 0.00 0.00 175.10 173.92 2k60 s ASP 84 N 1.11 5.75 0.47 4.85 1.01 -1.26 -2.69 116.67 125.92 2k60 s ASP 84 Ca 0.37 0.89 0.13 0.00 0.71 0.00 0.00 52.55 54.65 2k60 s ASP 84 Cb -0.17 -1.91 1.09 0.00 1.01 0.00 0.00 42.92 42.94 2k60 s ASP 84 CO 0.13 -1.00 2.10 -0.37 0.21 0.00 0.00 175.17 176.23 2k60 h VAL 85 N -0.20 1.05 0.00 -1.27 -1.51 -1.96 -1.05 116.25 111.31 2k60 h VAL 85 Ca -0.45 -0.15 -0.10 0.00 -1.23 0.00 0.00 66.70 64.76 2k60 h VAL 85 Cb 1.24 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 31.27 2k60 h VAL 85 CO 0.61 0.06 -0.48 -0.33 -1.23 0.00 0.00 177.57 176.20 2k60 h GLU 86 N 0.19 0.00 0.04 5.19 5.08 -1.98 -2.70 114.58 120.40 2k60 h GLU 86 Ca 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2k60 h GLU 86 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2k60 h GLU 86 CO -0.01 0.48 -0.02 0.93 -1.00 0.00 0.00 179.01 179.39 2k60 h GLU 87 N 0.00 -0.06 -0.01 2.33 5.08 -1.52 -3.21 114.58 117.21 2k60 h GLU 87 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2k60 h GLU 87 Cb 1.35 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.61 2k60 h GLU 87 CO 0.06 0.59 0.00 -1.13 -1.00 0.00 0.00 179.01 177.54 2k60 n SER 88 N -4.77 0.45 -0.36 1.42 3.41 -1.02 -4.28 113.62 108.48 2k60 n SER 88 Ca -0.08 -1.16 -0.11 0.00 -0.26 0.00 0.00 58.87 57.26 2k60 n SER 88 Cb 0.33 -0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.19 2k60 n SER 88 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2k60 h ASP 89 N 0.70 -2.01 0.08 4.04 1.82 -1.48 0.29 116.42 119.86 2k60 h ASP 89 Ca 0.00 0.30 -0.13 0.00 -0.39 0.00 0.00 57.03 56.81 2k60 h ASP 89 Cb 0.15 0.88 0.01 0.00 0.68 0.00 0.00 39.33 41.05 2k60 h ASP 89 CO 0.00 -0.24 -0.62 -0.08 -1.61 0.00 0.00 179.24 176.69 2k60 h GLU 90 N -0.05 0.16 -0.25 0.28 4.81 -1.85 -3.38 114.58 114.30 2k60 h GLU 90 Ca 0.14 -0.27 0.04 0.00 -0.13 0.00 0.00 59.36 59.13 2k60 h GLU 90 Cb 0.41 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.83 2k60 h GLU 90 CO -0.84 1.13 -0.48 0.74 -0.73 0.00 0.00 179.01 178.82 2k60 h PHE 91 N -0.64 -1.46 -0.37 0.92 0.04 -1.61 -1.53 116.94 112.28 2k60 h PHE 91 Ca -0.13 0.06 0.03 0.00 2.80 0.00 0.00 57.97 60.73 2k60 h PHE 91 Cb 1.40 0.67 -0.03 0.00 2.20 0.00 0.00 35.95 40.19 2k60 h PHE 91 CO 0.21 -0.45 0.18 1.25 -0.60 0.00 0.00 178.31 178.90 2k60 h LEU 92 N -0.42 0.27 0.19 1.54 5.85 -0.67 0.12 115.31 122.20 2k60 h LEU 92 Ca 0.05 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 2k60 h LEU 92 Cb 0.55 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2k60 h LEU 92 CO -0.46 0.20 -0.29 0.03 -0.34 0.00 0.00 178.44 177.58 2k60 h ARG 93 N 0.38 -0.49 0.10 1.25 3.08 -1.58 -1.10 114.38 116.01 2k60 h ARG 93 Ca 0.15 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 2k60 h ARG 93 Cb 0.06 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2k60 h ARG 93 CO -0.11 -0.32 -0.05 0.93 -1.07 0.00 0.00 179.97 179.35 2k60 h GLU 94 N -0.50 -0.13 -0.16 0.04 4.39 -1.25 0.81 114.58 117.78 2k60 h GLU 94 Ca -0.02 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.73 2k60 h GLU 94 Cb 0.46 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2k60 h GLU 94 CO -0.09 0.18 0.17 0.22 -1.16 0.00 0.00 179.01 178.34 2k60 h ASP 95 N -0.99 0.00 0.00 1.42 3.58 -0.80 -1.42 116.42 118.20 2k60 h ASP 95 Ca -0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2k60 h ASP 95 Cb 0.37 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2k60 h ASP 95 CO 0.02 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.38 2k60 n LEU 96 N -3.85 0.00 -0.30 2.28 -0.00 -0.82 -4.60 117.00 109.71 2k60 n LEU 96 Ca 0.01 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.13 2k60 n LEU 96 Cb 0.29 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.67 2k60 n LEU 96 CO 0.28 0.00 0.18 -3.20 -0.00 0.00 0.00 177.39 174.65 2k60 n ASN 97 N 0.00 1.61 0.00 1.45 4.05 0.10 -4.76 115.26 117.71 2k60 n ASN 97 Ca 0.00 -1.30 0.00 0.00 0.45 0.00 0.00 54.58 53.73 2k60 n ASN 97 Cb 0.00 0.67 0.00 0.00 1.23 0.00 0.00 39.78 41.68 2k60 n ASN 97 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k60 n TYR 98 N -0.60 0.00 0.00 1.20 4.11 0.26 -4.15 117.16 117.98 2k60 n TYR 98 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.97 2k60 n TYR 98 Cb 0.41 -0.06 0.00 0.00 -0.00 0.00 0.00 39.34 39.70 2k60 n TYR 98 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.86 178.44 2k60 n HIS 99 N -0.11 0.00 -4.29 -3.48 -0.00 -1.23 -4.71 115.22 101.40 2k60 n HIS 99 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.72 57.54 2k60 n HIS 99 Cb 0.00 0.02 -0.14 0.00 -0.00 0.00 0.00 29.99 29.87 2k60 n HIS 99 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 2k60 s ASP 100 N -0.10 0.92 -0.00 0.26 1.47 -1.26 -4.60 116.67 113.36 2k60 s ASP 100 Ca 0.00 -0.16 0.12 0.00 1.18 0.00 0.00 52.55 53.69 2k60 s ASP 100 Cb 0.00 -0.10 0.34 0.00 -0.34 0.00 0.00 42.92 42.82 2k60 s ASP 100 CO 0.00 0.08 1.28 -0.81 0.68 0.00 0.00 175.17 176.40 2k60 n PRO 101 N 2.82 1.90 -0.02 2.11 -0.04 -1.26 -4.14 135.00 136.36 2k60 n PRO 101 Ca -0.14 -1.38 0.07 0.00 -0.04 0.00 0.00 63.50 62.01 2k60 n PRO 101 Cb 0.57 -1.30 0.46 0.00 -0.04 0.00 0.00 33.50 33.19 2k60 n PRO 101 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2k60 h THR 102 N 2.24 1.02 0.63 0.52 2.02 -1.98 0.22 112.91 117.58 2k60 h THR 102 Ca 0.00 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 2k60 h THR 102 Cb 0.52 0.50 0.01 0.00 -1.74 0.00 0.00 68.15 67.43 2k60 h THR 102 CO 0.00 0.09 -0.30 0.58 0.37 0.00 0.00 175.52 176.26 2k60 h VAL 103 N 0.48 0.32 -0.39 3.16 2.07 -1.98 -0.32 116.25 119.59 2k60 h VAL 103 Ca 0.19 -0.18 -0.10 0.00 0.82 0.00 0.00 66.70 67.43 2k60 h VAL 103 Cb 0.17 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2k60 h VAL 103 CO -0.05 0.02 -0.16 0.11 0.02 0.00 0.00 177.57 177.52 2k60 h LYS 104 N -0.97 0.80 0.51 1.57 1.79 -1.71 -0.12 116.57 118.43 2k60 h LYS 104 Ca -0.09 -0.33 -0.02 0.00 -2.18 0.00 0.00 60.65 58.03 2k60 h LYS 104 Cb 0.69 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 2k60 h LYS 104 CO 0.14 0.96 -0.38 0.45 -1.08 0.00 0.00 179.45 179.54 2k60 h HIS 105 N 0.60 -1.02 0.00 -1.35 3.86 -0.62 -0.67 115.15 115.96 2k60 h HIS 105 Ca 0.09 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 2k60 h HIS 105 Cb 0.70 0.38 -0.00 0.00 1.06 0.00 0.00 27.41 29.54 2k60 h HIS 105 CO 0.06 -0.56 -0.10 0.77 0.86 0.00 0.00 177.93 178.96 2k60 h SER 106 N -0.87 0.00 -0.09 2.45 0.02 -1.07 -1.42 113.55 112.57 2k60 h SER 106 Ca -0.06 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.76 2k60 h SER 106 Cb 0.74 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.28 2k60 h SER 106 CO 0.02 0.10 -0.48 0.74 -1.14 0.00 0.00 176.83 176.06 2k60 h THR 107 N 0.00 1.38 0.24 -2.27 2.02 -0.96 -2.96 112.91 110.36 2k60 h THR 107 Ca -0.00 -1.84 -0.01 0.00 0.77 0.00 0.00 66.41 65.33 2k60 h THR 107 Cb 0.97 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.64 2k60 h THR 107 CO 0.01 0.55 -0.11 0.15 0.37 0.00 0.00 175.52 176.48 2k60 h PHE 108 N 0.05 -0.29 0.05 3.16 3.57 -0.89 -3.40 116.94 119.19 2k60 h PHE 108 Ca -0.04 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 2k60 h PHE 108 Cb 1.14 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.97 2k60 h PHE 108 CO 0.12 -0.18 -0.02 1.25 -2.23 0.00 0.00 178.31 177.24 2k60 h HIS 109 N -0.90 -0.06 0.00 0.41 2.76 -1.46 -3.50 115.15 112.40 2k60 h HIS 109 Ca -0.03 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 2k60 h HIS 109 Cb 0.24 0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.22 2k60 h HIS 109 CO 0.01 0.19 0.00 0.41 -1.30 0.00 0.00 177.93 177.24 2k60 n GLY 110 N 1.52 1.29 0.66 5.26 0.00 -1.12 -4.66 105.19 108.14 2k60 n GLY 110 Ca -0.03 -0.54 0.13 0.00 0.00 0.00 0.00 46.02 45.58 2k60 n GLY 110 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2k60 n GLU 111 N 0.00 1.90 -4.47 1.61 2.13 -1.26 -4.32 120.64 116.23 2k60 n GLU 111 Ca 0.00 -1.32 -0.23 0.00 0.66 0.00 0.00 57.16 56.27 2k60 n GLU 111 Cb 0.00 -1.47 -0.10 0.00 0.27 0.00 0.00 31.44 30.14 2k60 n GLU 111 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2k60 s ASP 112 N -2.01 2.47 -0.03 4.31 -1.08 -1.26 -5.09 116.67 113.99 2k60 s ASP 112 Ca 0.34 -1.45 0.04 0.00 -0.52 0.00 0.00 52.55 50.95 2k60 s ASP 112 Cb 0.21 0.08 0.06 0.00 -1.46 0.00 0.00 42.92 41.80 2k60 s ASP 112 CO 0.33 -0.69 0.88 0.29 0.52 0.00 0.00 175.17 176.49 2k60 n LYS 113 N -0.75 1.04 -2.60 4.34 4.76 -1.26 -4.35 118.16 119.34 2k60 n LYS 113 Ca -0.04 -1.30 -0.42 0.00 -2.87 0.00 0.00 58.31 53.68 2k60 n LYS 113 Cb 0.66 -0.84 -0.03 0.00 -1.84 0.00 0.00 35.03 32.99 2k60 n LYS 113 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2k60 s LEU 114 N -0.85 4.35 -0.21 -0.35 1.43 -1.26 -4.70 118.68 117.09 2k60 s LEU 114 Ca 0.07 1.76 -0.09 0.00 -1.03 0.00 0.00 54.13 54.84 2k60 s LEU 114 Cb 0.06 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.66 2k60 s LEU 114 CO 0.01 -0.38 0.10 -0.63 0.23 0.00 0.00 176.35 175.68 2k60 s ILE 115 N 1.27 5.01 -0.02 -0.59 -1.09 -1.09 -4.49 121.20 120.19 2k60 s ILE 115 Ca 0.54 0.05 0.03 0.00 -2.23 0.00 0.00 60.65 59.04 2k60 s ILE 115 Cb -0.23 -3.30 -0.00 0.00 -1.58 0.00 0.00 42.46 37.35 2k60 s ILE 115 CO 0.26 0.41 -0.12 -0.44 -1.23 0.00 0.00 174.94 173.82 2k60 s SER 116 N 0.73 1.54 0.22 3.58 0.01 -1.26 0.05 113.70 118.56 2k60 s SER 116 Ca 0.05 -0.24 -0.09 0.00 1.31 0.00 0.00 55.95 56.98 2k60 s SER 116 Cb -0.13 -0.32 0.17 0.00 0.21 0.00 0.00 66.02 65.95 2k60 s SER 116 CO 0.02 0.12 1.86 -0.37 0.41 0.00 0.00 173.24 175.28 2k60 h VAL 117 N 5.14 1.22 0.00 3.43 -1.51 -1.54 0.26 116.25 123.25 2k60 h VAL 117 Ca -0.33 -0.48 -0.20 0.00 -1.23 0.00 0.00 66.70 64.46 2k60 h VAL 117 Cb 1.17 0.09 -0.03 0.00 -2.13 0.00 0.00 31.29 30.39 2k60 h VAL 117 CO 0.49 0.23 -0.95 1.05 -1.23 0.00 0.00 177.57 177.16 2k60 h GLU 118 N 1.11 0.00 -0.07 5.19 4.11 -1.97 0.83 114.58 123.78 2k60 h GLU 118 Ca 0.29 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.57 2k60 h GLU 118 Cb -0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2k60 h GLU 118 CO -0.06 0.95 -0.61 0.22 0.07 0.00 0.00 179.01 179.58 2k60 h ASP 119 N 0.00 0.27 -0.63 3.06 3.58 -1.85 -0.47 116.42 120.38 2k60 h ASP 119 Ca -0.01 -0.16 -0.09 0.00 0.42 0.00 0.00 57.03 57.19 2k60 h ASP 119 Cb 1.73 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 42.68 2k60 h ASP 119 CO 0.12 0.81 0.04 -0.07 -2.88 0.00 0.00 179.24 177.27 2k60 h LEU 120 N 0.17 1.05 -0.28 2.28 3.38 -0.84 0.21 115.31 121.29 2k60 h LEU 120 Ca -0.01 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.73 2k60 h LEU 120 Cb 1.12 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 2k60 h LEU 120 CO 0.09 1.08 -0.07 -0.25 0.09 0.00 0.00 178.44 179.39 2k60 h TRP 121 N 0.99 -0.14 -0.51 1.13 7.01 -0.21 0.60 115.95 124.82 2k60 h TRP 121 Ca 0.18 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.21 2k60 h TRP 121 Cb 0.52 0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.66 2k60 h TRP 121 CO 0.04 -0.12 0.34 0.87 -2.79 0.00 0.00 178.44 176.78 2k60 h LYS 122 N 0.00 0.67 -0.33 2.65 6.56 -0.76 -1.40 116.57 123.95 2k60 h LYS 122 Ca 0.13 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.67 2k60 h LYS 122 Cb 0.20 -0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 31.70 2k60 h LYS 122 CO -0.28 0.44 0.17 0.00 -2.06 0.00 0.00 179.45 177.72 2k60 h ALA 123 N 1.19 0.43 -0.89 3.86 0.00 0.07 -2.03 119.26 121.88 2k60 h ALA 123 Ca 0.19 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.10 2k60 h ALA 123 Cb -0.07 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.51 2k60 h ALA 123 CO -0.04 -0.03 0.55 2.35 0.00 0.00 0.00 179.25 182.07 2k60 h TRP 124 N 0.41 1.00 0.00 0.00 7.01 0.39 0.32 115.95 125.08 2k60 h TRP 124 Ca 0.12 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.15 2k60 h TRP 124 Cb 0.09 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 26.84 2k60 h TRP 124 CO -0.02 0.45 0.00 0.87 -2.79 0.00 0.00 178.44 176.95 2k60 h LYS 125 N 0.93 0.00 -0.08 2.65 1.57 -0.80 -1.83 116.57 119.02 2k60 h LYS 125 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 2k60 h LYS 125 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2k60 h LYS 125 CO -0.22 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.09 2k60 n SER 126 N -2.55 2.17 -4.83 0.86 7.64 -0.07 -4.95 113.62 111.89 2k60 n SER 126 Ca 0.02 -1.59 -0.22 0.00 1.01 0.00 0.00 58.87 58.09 2k60 n SER 126 Cb 0.27 -0.05 -0.04 0.00 -1.01 0.00 0.00 64.21 63.38 2k60 n SER 126 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k60 s SER 127 N -0.99 5.20 0.58 6.43 0.01 0.94 -4.99 113.70 120.88 2k60 s SER 127 Ca 0.16 -0.53 0.36 0.00 1.31 0.00 0.00 55.95 57.25 2k60 s SER 127 Cb 0.10 -0.95 1.63 0.00 0.21 0.00 0.00 66.02 67.01 2k60 s SER 127 CO 0.15 -0.33 2.08 -0.33 0.41 0.00 0.00 173.24 175.23 2k60 h GLU 128 N 1.31 0.00 0.00 12.44 4.39 -1.89 -3.22 114.58 127.61 2k60 h GLU 128 Ca -0.45 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.27 2k60 h GLU 128 Cb 1.25 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.85 2k60 h GLU 128 CO 0.59 0.01 -0.47 0.28 -1.16 0.00 0.00 179.01 178.26 2k60 h VAL 129 N 0.00 0.00 0.00 3.13 2.07 -1.90 0.09 116.25 119.64 2k60 h VAL 129 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2k60 h VAL 129 Cb 0.38 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2k60 h VAL 129 CO 0.00 0.00 -0.01 0.22 0.02 0.00 0.00 177.57 177.80 2k60 h TYR 130 N -0.59 0.00 0.00 1.57 3.20 -1.56 -1.46 116.97 118.13 2k60 h TYR 130 Ca 0.01 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.73 2k60 h TYR 130 Cb 0.63 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 2k60 h TYR 130 CO -0.50 0.01 -0.96 -0.97 -1.64 0.00 0.00 178.16 174.10 2k60 h ASN 131 N 0.00 0.00 -2.28 -2.11 -1.24 -1.41 -3.42 115.58 105.13 2k60 h ASN 131 Ca -0.00 0.00 -0.55 0.00 0.71 0.00 0.00 56.30 56.46 2k60 h ASN 131 Cb 0.22 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.28 2k60 h ASN 131 CO 0.00 0.61 1.30 0.26 -1.29 0.00 0.00 177.43 178.31 2k60 s TRP 132 N -2.90 1.26 0.55 0.67 0.51 -0.08 -4.91 118.94 114.04 2k60 s TRP 132 Ca 0.01 -0.18 -0.09 0.00 -2.12 0.00 0.00 56.10 53.71 2k60 s TRP 132 Cb 0.08 -4.16 0.13 0.00 -0.81 0.00 0.00 33.47 28.71 2k60 s TRP 132 CO 0.78 -5.14 0.72 -2.37 -0.51 0.00 0.00 176.95 170.44 2k60 n THR 133 N 6.15 0.00 -0.18 2.01 5.66 -1.26 -0.77 114.28 125.89 2k60 n THR 133 Ca 0.22 -0.52 -0.08 0.00 -3.05 0.00 0.00 64.05 60.63 2k60 n THR 133 Cb 0.42 -1.69 0.02 0.00 -1.55 0.00 0.00 70.33 67.53 2k60 n THR 133 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 2k60 h VAL 134 N -1.48 1.20 -0.71 1.08 2.07 -1.94 -1.33 116.25 115.12 2k60 h VAL 134 Ca -0.24 -0.55 0.02 0.00 0.82 0.00 0.00 66.70 66.76 2k60 h VAL 134 Cb 0.65 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2k60 h VAL 134 CO 0.16 0.22 0.46 -0.78 0.02 0.00 0.00 177.57 177.65 2k60 h ASP 135 N 0.70 0.77 0.01 0.57 3.58 -1.93 0.57 116.42 120.69 2k60 h ASP 135 Ca 0.18 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 2k60 h ASP 135 Cb 0.11 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2k60 h ASP 135 CO -0.02 0.54 -0.00 -0.33 -2.88 0.00 0.00 179.24 176.55 2k60 h GLU 136 N 0.91 -0.01 -0.18 0.28 4.39 -1.83 -1.62 114.58 116.52 2k60 h GLU 136 Ca 0.28 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.88 2k60 h GLU 136 Cb -0.03 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2k60 h GLU 136 CO -0.09 0.09 -0.33 -0.24 -1.16 0.00 0.00 179.01 177.28 2k60 h VAL 137 N -0.11 1.28 0.31 3.13 3.04 -0.96 -0.51 116.25 122.43 2k60 h VAL 137 Ca -0.00 -1.38 -0.01 0.00 -1.01 0.00 0.00 66.70 64.29 2k60 h VAL 137 Cb 0.11 1.51 -0.00 0.00 -2.01 0.00 0.00 31.29 30.90 2k60 h VAL 137 CO 0.00 0.43 -0.18 0.58 -1.01 0.00 0.00 177.57 177.39 2k60 h VAL 138 N 0.32 0.64 -0.04 1.51 2.07 -0.56 0.67 116.25 120.85 2k60 h VAL 138 Ca 0.04 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.48 2k60 h VAL 138 Cb 0.74 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2k60 h VAL 138 CO 0.06 0.00 -0.36 0.06 0.02 0.00 0.00 177.57 177.35 2k60 h GLN 139 N -0.46 0.08 -0.19 1.57 3.07 -1.14 -1.51 115.11 116.52 2k60 h GLN 139 Ca -0.04 -0.03 -0.14 0.00 0.09 0.00 0.00 58.65 58.53 2k60 h GLN 139 Cb 0.37 -0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.93 2k60 h GLN 139 CO 0.05 0.43 -0.43 2.35 0.09 0.00 0.00 178.83 181.32 2k60 h TRP 140 N 0.07 0.80 -0.59 0.06 2.91 -0.74 -1.26 115.95 117.21 2k60 h TRP 140 Ca 0.01 -0.30 -0.07 0.00 1.13 0.00 0.00 58.89 59.66 2k60 h TRP 140 Cb 0.67 -0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 29.16 2k60 h TRP 140 CO 0.00 1.06 0.08 1.37 -1.03 0.00 0.00 178.44 179.93 2k60 h LEU 141 N 0.30 0.91 -0.02 0.65 8.10 0.70 0.88 115.31 126.84 2k60 h LEU 141 Ca 0.00 -0.21 -0.02 0.00 0.11 0.00 0.00 57.88 57.77 2k60 h LEU 141 Cb 1.04 -0.24 0.00 0.00 -0.44 0.00 0.00 40.66 41.02 2k60 h LEU 141 CO 0.09 0.92 -0.06 0.16 -4.11 0.00 0.00 178.44 175.45 2k60 h ILE 142 N 0.90 1.48 0.00 0.15 3.07 -1.24 0.43 117.51 122.29 2k60 h ILE 142 Ca 0.18 -1.49 -0.01 0.00 1.55 0.00 0.00 64.86 65.09 2k60 h ILE 142 Cb 0.41 2.42 -0.00 0.00 -0.27 0.00 0.00 36.82 39.38 2k60 h ILE 142 CO 0.01 0.40 -0.06 0.00 -1.05 0.00 0.00 178.15 177.45 2k60 h THR 143 N -0.51 0.17 0.00 0.16 1.03 -1.05 -1.18 112.91 111.53 2k60 h THR 143 Ca -0.00 -0.64 0.00 0.00 -0.01 0.00 0.00 66.41 65.76 2k60 h THR 143 Cb 0.67 1.54 0.00 0.00 -1.07 0.00 0.00 68.15 69.30 2k60 h THR 143 CO 0.01 0.06 -0.49 -1.22 -0.01 0.00 0.00 175.52 173.88 2k60 n TYR 144 N -3.20 0.00 0.41 0.00 4.01 0.29 -4.72 117.16 113.95 2k60 n TYR 144 Ca 0.00 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.88 2k60 n TYR 144 Cb 0.32 -0.24 0.48 0.00 -0.31 0.00 0.00 39.34 39.59 2k60 n TYR 144 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2k60 h VAL 145 N -0.49 0.00 -0.30 -0.72 2.07 -0.27 -3.46 116.25 113.08 2k60 h VAL 145 Ca 0.00 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 2k60 h VAL 145 Cb 0.49 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.53 2k60 h VAL 145 CO 0.00 0.00 -0.12 -0.62 0.02 0.00 0.00 177.57 176.85 2k60 n GLU 146 N -2.53 -0.45 -3.33 1.57 1.02 -0.44 -4.78 120.64 111.69 2k60 n GLU 146 Ca 0.03 0.72 -0.45 0.00 -0.02 0.00 0.00 57.16 57.44 2k60 n GLU 146 Cb 0.33 -4.49 -0.07 0.00 -0.02 0.00 0.00 31.44 27.20 2k60 n GLU 146 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k60 s LEU 147 N -1.45 5.73 -0.08 -4.62 2.01 -1.23 -4.93 118.68 114.11 2k60 s LEU 147 Ca 0.00 -1.44 0.05 0.00 0.01 0.00 0.00 54.13 52.75 2k60 s LEU 147 Cb 0.00 -2.22 0.27 0.00 0.01 0.00 0.00 46.19 44.25 2k60 s LEU 147 CO 0.00 -0.76 0.92 -0.81 1.01 0.00 0.00 176.35 176.71 2k60 n PRO 148 N 5.35 2.29 -0.85 1.29 -0.04 -1.26 -3.60 135.00 138.17 2k60 n PRO 148 Ca -0.12 -1.04 0.07 0.00 -0.04 0.00 0.00 63.50 62.36 2k60 n PRO 148 Cb 0.43 -1.75 0.39 0.00 -0.04 0.00 0.00 33.50 32.52 2k60 n PRO 148 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2k60 n GLN 149 N 0.20 4.70 -0.34 0.54 -0.06 -1.26 -4.64 117.38 116.52 2k60 n GLN 149 Ca 0.09 -2.99 0.04 0.00 -2.00 0.00 0.00 57.00 52.14 2k60 n GLN 149 Cb 0.57 -2.23 0.19 0.00 -4.06 0.00 0.00 30.24 24.71 2k60 n GLN 149 CO 0.00 0.00 0.00 0.10 -0.20 0.00 0.00 177.06 176.96 2k60 h TYR 150 N 3.80 1.09 0.11 3.69 -0.00 -1.96 -1.34 116.97 122.36 2k60 h TYR 150 Ca 0.00 0.03 0.01 0.00 -0.00 0.00 0.00 58.73 58.77 2k60 h TYR 150 Cb 1.91 -0.35 -0.02 0.00 -0.00 0.00 0.00 36.73 38.27 2k60 h TYR 150 CO 1.04 0.49 -0.17 1.49 -0.00 0.00 0.00 178.16 181.01 2k60 h GLU 151 N 1.01 -0.33 0.12 0.10 4.81 -1.93 0.49 114.58 118.85 2k60 h GLU 151 Ca 0.44 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.69 2k60 h GLU 151 Cb 0.33 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.78 2k60 h GLU 151 CO -0.22 -0.22 -0.06 0.93 -0.73 0.00 0.00 179.01 178.71 2k60 h GLU 152 N -0.34 -0.15 -0.60 1.92 4.39 -1.78 -1.07 114.58 116.95 2k60 h GLU 152 Ca 0.02 0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 2k60 h GLU 152 Cb 0.35 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 2k60 h GLU 152 CO -0.08 -0.02 0.08 0.00 -1.16 0.00 0.00 179.01 177.83 2k60 h THR 153 N -0.24 1.26 -0.17 1.13 1.03 -1.11 0.11 112.91 114.91 2k60 h THR 153 Ca -0.02 -1.03 -0.12 0.00 -0.01 0.00 0.00 66.41 65.23 2k60 h THR 153 Cb 0.20 0.75 -0.01 0.00 -1.07 0.00 0.00 68.15 68.01 2k60 h THR 153 CO 0.03 0.38 -0.43 2.19 -0.01 0.00 0.00 175.52 177.68 2k60 h PHE 154 N 0.91 0.48 0.00 0.00 -5.15 -0.82 0.19 116.94 112.55 2k60 h PHE 154 Ca 0.18 -0.14 -0.09 0.00 -0.20 0.00 0.00 57.97 57.72 2k60 h PHE 154 Cb 0.45 -0.10 -0.01 0.00 0.22 0.00 0.00 35.95 36.51 2k60 h PHE 154 CO 0.03 0.77 -0.42 0.07 -2.00 0.00 0.00 178.31 176.76 2k60 h ARG 155 N 0.33 0.00 0.00 6.09 0.11 -0.69 0.89 114.38 121.12 2k60 h ARG 155 Ca 0.03 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.09 2k60 h ARG 155 Cb 0.89 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.97 2k60 h ARG 155 CO 0.07 0.42 -0.05 0.87 0.10 0.00 0.00 179.97 181.39 2k60 h LYS 156 N 0.00 0.03 0.00 0.08 1.79 -0.26 -3.42 116.57 114.79 2k60 h LYS 156 Ca -0.00 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2k60 h LYS 156 Cb 1.01 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 2k60 h LYS 156 CO 0.05 0.88 -0.50 1.47 -1.08 0.00 0.00 179.45 180.27 2k60 n LEU 157 N -4.64 0.00 -2.89 2.94 -0.00 0.62 -5.08 117.00 107.95 2k60 n LEU 157 Ca -0.10 -0.21 -0.03 0.00 -0.00 0.00 0.00 56.01 55.67 2k60 n LEU 157 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.86 2k60 n LEU 157 CO 0.35 0.00 -0.42 0.00 -0.00 0.00 0.00 177.39 177.32 2k60 n GLN 158 N -1.18 -2.52 -2.52 1.47 6.02 0.30 -5.01 117.38 113.95 2k60 n GLN 158 Ca 0.00 2.17 -0.25 0.00 -0.01 0.00 0.00 57.00 58.91 2k60 n GLN 158 Cb 0.00 -4.21 0.03 0.00 1.02 0.00 0.00 30.24 27.08 2k60 n GLN 158 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2k60 s LEU 159 N -1.65 3.27 0.00 1.08 2.34 -1.26 -4.91 118.68 117.54 2k60 s LEU 159 Ca 0.05 0.51 0.00 0.00 0.06 0.00 0.00 54.13 54.75 2k60 s LEU 159 Cb -0.01 -3.33 0.00 0.00 -0.56 0.00 0.00 46.19 42.29 2k60 s LEU 159 CO 0.60 -1.07 0.00 -1.54 -1.06 0.00 0.00 176.35 173.28 2k60 n SER 160 N -2.50 0.00 0.22 1.48 3.41 -1.26 -3.70 113.62 111.28 2k60 n SER 160 Ca 0.05 -0.07 0.12 0.00 -0.26 0.00 0.00 58.87 58.70 2k60 n SER 160 Cb 0.58 0.00 0.71 0.00 -0.26 0.00 0.00 64.21 65.24 2k60 n SER 160 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2k60 h GLY 161 N 0.00 0.00 1.18 5.00 0.00 -1.01 0.28 103.07 108.51 2k60 h GLY 161 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.05 2k60 h GLY 161 CO 0.00 0.00 -1.57 1.12 0.00 0.00 0.00 176.54 176.09 2k60 h HIS 162 N 0.00 0.02 -0.15 5.60 -0.00 -1.84 -3.31 115.15 115.47 2k60 h HIS 162 Ca 0.05 -0.02 -0.10 0.00 -0.00 0.00 0.00 60.37 60.30 2k60 h HIS 162 Cb 0.20 -0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.59 2k60 h HIS 162 CO 0.00 1.03 -0.33 0.00 -0.00 0.00 0.00 177.93 178.63 2k60 h ALA 163 N 0.97 1.15 -0.34 6.11 0.00 -1.62 -2.19 119.26 123.34 2k60 h ALA 163 Ca -0.23 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.37 2k60 h ALA 163 Cb 1.97 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 19.58 2k60 h ALA 163 CO 0.09 0.55 -0.46 0.52 0.00 0.00 0.00 179.25 179.95 2k60 h MET 164 N 0.27 -0.38 -0.33 0.00 2.86 -0.58 0.96 114.93 117.74 2k60 h MET 164 Ca 0.03 0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2k60 h MET 164 Cb 0.72 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 2k60 h MET 164 CO 0.05 -0.25 0.01 -1.00 1.06 0.00 0.00 176.91 176.78 2k60 h PRO 165 N -0.39 0.58 -0.93 -0.22 0.13 -1.73 -1.13 132.00 128.31 2k60 h PRO 165 Ca 0.11 -0.18 0.16 0.00 -0.87 0.00 0.00 66.00 65.22 2k60 h PRO 165 Cb 0.60 -0.05 -0.10 0.00 0.13 0.00 0.00 31.00 31.58 2k60 h PRO 165 CO -0.54 0.70 0.54 -0.09 -0.23 0.00 0.00 178.00 178.37 2k60 h ARG 166 N 0.39 0.72 0.00 0.86 2.43 -0.66 -0.22 114.38 117.89 2k60 h ARG 166 Ca 0.09 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2k60 h ARG 166 Cb 0.43 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2k60 h ARG 166 CO 0.02 0.48 -0.33 1.47 -1.51 0.00 0.00 179.97 180.09 2k60 n LEU 167 N -4.79 0.35 0.16 3.80 -0.00 0.33 -3.50 117.00 113.35 2k60 n LEU 167 Ca 0.20 0.18 0.13 0.00 -0.00 0.00 0.00 56.01 56.52 2k60 n LEU 167 Cb 0.47 -0.33 0.49 0.00 -0.00 0.00 0.00 43.42 44.05 2k60 n LEU 167 CO 0.22 0.07 0.89 0.00 -0.00 0.00 0.00 177.39 178.57 2k60 h ALA 168 N 2.98 1.00 -2.91 1.47 0.00 0.29 -3.41 119.26 118.68 2k60 h ALA 168 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.26 2k60 h ALA 168 Cb 0.51 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.10 2k60 h ALA 168 CO 0.00 0.00 -0.56 0.54 0.00 0.00 0.00 179.25 179.23 2k60 s VAL 169 N -3.34 4.85 0.00 0.00 0.11 -1.20 -4.22 120.40 116.61 2k60 s VAL 169 Ca 0.05 -0.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.06 2k60 s VAL 169 Cb 0.10 -3.32 0.00 0.00 -1.53 0.00 0.00 36.38 31.62 2k60 s VAL 169 CO 0.49 0.25 0.00 0.35 -3.33 0.00 0.00 175.10 172.86 2k60 n THR 170 N 5.00 0.00 -0.02 5.04 -2.24 -1.26 -4.49 114.28 116.31 2k60 n THR 170 Ca -0.15 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.61 2k60 n THR 170 Cb 0.51 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 2k60 n THR 170 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2k60 n ASN 171 N -3.18 3.85 0.11 3.42 6.94 -1.26 -4.54 115.26 120.61 2k60 n ASN 171 Ca 0.00 -0.01 0.03 0.00 -0.02 0.00 0.00 54.58 54.58 2k60 n ASN 171 Cb 0.00 0.31 0.42 0.00 -2.36 0.00 0.00 39.78 38.15 2k60 n ASN 171 CO 0.00 0.00 0.00 0.71 -1.03 0.00 0.00 177.26 176.94 2k60 h THR 172 N 0.00 1.15 -0.14 5.53 1.35 -1.95 -1.83 112.91 117.02 2k60 h THR 172 Ca -0.11 -0.62 -0.05 0.00 -0.55 0.00 0.00 66.41 65.09 2k60 h THR 172 Cb 1.21 1.08 -0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2k60 h THR 172 CO -0.00 0.20 -0.09 0.74 -0.25 0.00 0.00 175.52 176.11 2k60 h THR 173 N 0.26 1.33 0.19 6.82 2.02 -1.80 -3.37 112.91 118.36 2k60 h THR 173 Ca 0.06 -1.19 -0.25 0.00 0.77 0.00 0.00 66.41 65.80 2k60 h THR 173 Cb 0.27 1.82 0.03 0.00 -1.74 0.00 0.00 68.15 68.53 2k60 h THR 173 CO 0.01 0.34 -1.09 -0.03 0.37 0.00 0.00 175.52 175.13 2k60 h MET 174 N -0.06 0.40 -0.90 6.66 1.85 -1.75 -3.38 114.93 117.75 2k60 h MET 174 Ca 0.03 -0.69 0.25 0.00 -0.61 0.00 0.00 59.70 58.67 2k60 h MET 174 Cb 0.59 0.26 -0.14 0.00 0.43 0.00 0.00 31.60 32.73 2k60 h MET 174 CO 0.03 1.33 0.32 0.00 -0.40 0.00 0.00 176.91 178.18 2k60 h THR 175 N -0.16 0.34 0.00 -0.77 1.03 -1.49 -3.45 112.91 108.42 2k60 h THR 175 Ca -0.19 -0.09 0.00 0.00 -0.01 0.00 0.00 66.41 66.12 2k60 h THR 175 Cb 1.86 0.06 0.00 0.00 -1.07 0.00 0.00 68.15 69.00 2k60 h THR 175 CO 0.20 0.05 0.00 0.61 -0.01 0.00 0.00 175.52 176.37 2k60 n GLY 176 N -1.36 1.29 0.00 2.99 0.00 -1.26 -3.64 105.19 103.21 2k60 n GLY 176 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2k60 n GLY 176 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k60 n THR 177 N 0.00 0.00 -3.44 2.61 -1.04 -1.26 -5.07 114.28 106.08 2k60 n THR 177 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 2k60 n THR 177 Cb 0.00 -0.04 -0.11 0.00 -1.82 0.00 0.00 70.33 68.36 2k60 n THR 177 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2k60 s VAL 178 N 0.00 -0.16 -0.15 12.58 1.01 -1.24 -4.97 120.40 127.47 2k60 s VAL 178 Ca 0.00 -1.01 -0.16 0.00 0.00 0.00 0.00 61.98 60.81 2k60 s VAL 178 Cb 0.00 -0.94 -0.24 0.00 0.00 0.00 0.00 36.38 35.20 2k60 s VAL 178 CO 0.00 -0.70 0.39 0.25 0.00 0.00 0.00 175.10 175.04 2k60 h LEU 179 N 7.65 0.24 -7.25 3.92 5.85 -1.93 -3.47 115.31 120.32 2k60 h LEU 179 Ca -0.05 -0.76 -0.14 0.00 0.84 0.00 0.00 57.88 57.77 2k60 h LEU 179 Cb 1.03 -0.08 -0.27 0.00 0.37 0.00 0.00 40.66 41.70 2k60 h LEU 179 CO 0.31 1.62 -0.35 -0.75 -0.34 0.00 0.00 178.44 178.92 2k60 s LYS 180 N -2.45 0.34 0.19 1.25 2.47 -1.26 -4.82 119.74 115.46 2k60 s LYS 180 Ca -0.24 0.73 -0.04 0.00 -1.56 0.00 0.00 55.97 54.87 2k60 s LYS 180 Cb 0.05 -0.04 0.12 0.00 -1.46 0.00 0.00 37.83 36.51 2k60 s LYS 180 CO 0.70 -0.17 1.53 0.00 0.16 0.00 0.00 175.35 177.57 2k60 h MET 181 N 7.20 0.62 -6.28 4.03 -0.00 -1.98 -3.43 114.93 115.09 2k60 h MET 181 Ca -0.37 -0.36 -0.57 0.00 -0.00 0.00 0.00 59.70 58.41 2k60 h MET 181 Cb 1.17 0.03 -0.04 0.00 -0.00 0.00 0.00 31.60 32.76 2k60 h MET 181 CO 0.31 0.96 1.03 0.95 -0.00 0.00 0.00 176.91 180.16 2k60 s THR 182 N -4.13 3.95 0.17 -0.10 -4.23 -1.26 -4.90 115.64 105.14 2k60 s THR 182 Ca -0.08 1.09 -0.17 0.00 -1.18 0.00 0.00 61.69 61.35 2k60 s THR 182 Cb 0.12 -3.90 0.11 0.00 1.34 0.00 0.00 72.50 70.17 2k60 s THR 182 CO 0.84 -0.31 1.66 0.44 -0.54 0.00 0.00 174.62 176.71 2k60 h ASP 183 N 9.67 -0.47 0.00 3.99 5.19 -1.99 0.50 116.42 133.31 2k60 h ASP 183 Ca -0.30 0.14 -0.00 0.00 -0.62 0.00 0.00 57.03 56.24 2k60 h ASP 183 Cb 1.13 0.29 0.00 0.00 0.18 0.00 0.00 39.33 40.93 2k60 h ASP 183 CO 1.00 -0.17 -0.00 -0.09 -3.12 0.00 0.00 179.24 176.87 2k60 h ARG 184 N -0.04 -0.00 -0.84 3.56 2.43 -1.97 -1.34 114.38 116.19 2k60 h ARG 184 Ca 0.20 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.41 2k60 h ARG 184 Cb 0.35 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 2k60 h ARG 184 CO -0.45 0.44 0.53 1.03 -1.51 0.00 0.00 179.97 180.01 2k60 h SER 185 N -0.44 0.88 0.60 -3.80 0.87 -1.88 0.45 113.55 110.23 2k60 h SER 185 Ca -0.00 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2k60 h SER 185 Cb 0.44 -0.19 0.01 0.00 -0.44 0.00 0.00 62.40 62.22 2k60 h SER 185 CO 0.00 0.60 -0.29 -0.74 -0.53 0.00 0.00 176.83 175.87 2k60 h HIS 186 N 1.03 -0.75 -0.40 2.24 -0.00 -0.89 -1.49 115.15 114.89 2k60 h HIS 186 Ca 0.34 -0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.63 2k60 h HIS 186 Cb 0.03 0.25 -0.02 0.00 -0.00 0.00 0.00 27.41 27.67 2k60 h HIS 186 CO -0.03 -0.41 0.00 0.07 -0.00 0.00 0.00 177.93 177.56 2k60 h ARG 187 N -1.02 0.64 -0.33 5.26 0.11 -0.70 -0.46 114.38 117.87 2k60 h ARG 187 Ca -0.08 -0.15 -0.04 0.00 0.10 0.00 0.00 59.98 59.80 2k60 h ARG 187 Cb 0.67 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 31.66 2k60 h ARG 187 CO 0.14 0.66 0.04 1.96 0.10 0.00 0.00 179.97 182.86 2k60 h GLN 188 N 0.61 0.56 -0.15 0.08 1.08 -0.08 0.40 115.11 117.61 2k60 h GLN 188 Ca 0.13 -0.16 -0.04 0.00 -1.45 0.00 0.00 58.65 57.13 2k60 h GLN 188 Cb 0.38 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2k60 h GLN 188 CO 0.01 0.66 -0.06 0.87 -0.95 0.00 0.00 178.83 179.36 2k60 h LYS 189 N 0.38 0.31 0.36 1.46 6.56 -1.02 -0.99 116.57 123.63 2k60 h LYS 189 Ca 0.10 -0.13 -0.02 0.00 -1.06 0.00 0.00 60.65 59.54 2k60 h LYS 189 Cb 0.38 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.04 2k60 h LYS 189 CO 0.01 0.61 -0.17 -0.07 -2.06 0.00 0.00 179.45 177.77 2k60 h LEU 190 N -0.02 -0.40 -0.35 2.94 -0.00 -0.99 -1.65 115.31 114.85 2k60 h LEU 190 Ca 0.04 -0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.78 2k60 h LEU 190 Cb 0.51 0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 41.27 2k60 h LEU 190 CO 0.02 -0.27 -0.31 0.06 -0.00 0.00 0.00 178.44 177.94 2k60 h GLN 191 N -0.50 0.82 0.09 1.13 3.07 -0.24 0.22 115.11 119.69 2k60 h GLN 191 Ca -0.05 -0.42 0.01 0.00 0.09 0.00 0.00 58.65 58.28 2k60 h GLN 191 Cb 0.38 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 27.93 2k60 h GLN 191 CO 0.08 1.05 -0.16 -0.07 0.09 0.00 0.00 178.83 179.83 2k60 h LEU 192 N 0.61 -0.43 0.03 0.06 -0.00 -1.13 0.25 115.31 114.69 2k60 h LEU 192 Ca 0.06 0.05 -0.00 0.00 -0.00 0.00 0.00 57.88 57.99 2k60 h LEU 192 Cb 0.89 0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.71 2k60 h LEU 192 CO 0.08 -0.23 -0.01 0.11 -0.00 0.00 0.00 178.44 178.39 2k60 h LYS 193 N -0.30 -0.03 -0.45 1.13 6.56 -1.26 -1.75 116.57 120.46 2k60 h LYS 193 Ca 0.02 0.00 -0.13 0.00 -1.06 0.00 0.00 60.65 59.49 2k60 h LYS 193 Cb 0.32 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 31.98 2k60 h LYS 193 CO -0.09 0.58 -0.23 0.00 -2.06 0.00 0.00 179.45 177.66 2k60 h ALA 194 N 0.23 0.64 -0.13 3.86 0.00 -0.54 -0.18 119.26 123.14 2k60 h ALA 194 Ca -0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 2k60 h ALA 194 Cb 0.63 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2k60 h ALA 194 CO 0.01 0.63 -0.27 1.25 0.00 0.00 0.00 179.25 180.86 2k60 h LEU 195 N 0.79 0.46 -1.40 0.00 5.85 -0.60 0.64 115.31 121.05 2k60 h LEU 195 Ca 0.10 -0.57 -0.03 0.00 0.84 0.00 0.00 57.88 58.22 2k60 h LEU 195 Cb 0.80 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 2k60 h LEU 195 CO 0.07 0.94 0.05 -0.78 -0.34 0.00 0.00 178.44 178.38 2k60 h ASP 196 N -0.00 0.41 0.08 1.25 3.58 -1.27 0.02 116.42 120.48 2k60 h ASP 196 Ca 0.00 -0.06 -0.28 0.00 0.42 0.00 0.00 57.03 57.11 2k60 h ASP 196 Cb 0.87 -0.11 0.03 0.00 1.72 0.00 0.00 39.33 41.84 2k60 h ASP 196 CO 0.06 0.44 -1.15 0.74 -2.88 0.00 0.00 179.24 176.45 2k60 h THR 197 N 0.44 1.28 0.00 2.25 2.02 -0.81 0.47 112.91 118.56 2k60 h THR 197 Ca 0.10 -2.36 -0.05 0.00 0.77 0.00 0.00 66.41 64.87 2k60 h THR 197 Cb 0.21 2.54 -0.01 0.00 -1.74 0.00 0.00 68.15 69.16 2k60 h THR 197 CO 0.00 0.73 -0.23 1.62 0.37 0.00 0.00 175.52 178.00 2k60 h VAL 198 N 0.33 0.63 0.00 3.16 3.04 0.64 -0.93 116.25 123.12 2k60 h VAL 198 Ca -0.16 -1.07 -0.18 0.00 -1.01 0.00 0.00 66.70 64.28 2k60 h VAL 198 Cb 1.81 1.71 -0.03 0.00 -2.01 0.00 0.00 31.29 32.77 2k60 h VAL 198 CO 0.22 0.23 -1.05 -0.07 -1.01 0.00 0.00 177.57 175.89 2k60 h LEU 199 N 0.00 0.00 0.00 3.16 3.38 -0.95 -3.43 115.31 117.47 2k60 h LEU 199 Ca -0.00 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2k60 h LEU 199 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2k60 h LEU 199 CO 0.03 1.34 -0.34 0.33 0.09 0.00 0.00 178.44 179.89 2k60 n PHE 200 N -4.48 0.17 -0.71 1.13 -0.00 0.16 -4.95 117.46 108.79 2k60 n PHE 200 Ca -0.27 0.08 0.00 0.00 -0.00 0.00 0.00 57.45 57.26 2k60 n PHE 200 Cb 0.60 -0.33 0.00 0.00 -0.00 0.00 0.00 39.48 39.75 2k60 n PHE 200 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17