#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 7.34 0.55 1.61 0.01 -1.26 -4.92 113.70 117.03 2k60 s SER -4 Ca 0.00 2.00 0.31 0.00 1.31 0.00 0.00 55.95 59.57 2k60 s SER -4 Cb 0.00 -2.60 1.56 0.00 0.21 0.00 0.00 66.02 65.19 2k60 s SER -4 CO 0.00 -0.17 2.09 0.45 0.41 0.00 0.00 173.24 176.02 2k60 h HIS -3 N 5.23 0.00 0.00 2.43 3.86 -2.02 0.32 115.15 124.98 2k60 h HIS -3 Ca -0.44 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 58.66 2k60 h HIS -3 Cb 1.21 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.66 2k60 h HIS -3 CO 0.63 0.09 -0.55 0.00 0.86 0.00 0.00 177.93 178.95 2k60 h MET -2 N 0.00 0.00 0.00 2.45 -0.00 -2.01 -3.32 114.93 112.05 2k60 h MET -2 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2k60 h MET -2 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.94 2k60 h MET -2 CO 0.01 0.55 -1.04 0.00 -0.00 0.00 0.00 176.91 176.44 2k60 n ALA -1 N -2.24 3.91 -3.32 -3.00 0.00 -0.52 -4.85 120.51 110.49 2k60 n ALA -1 Ca 0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 53.44 52.97 2k60 n ALA -1 Cb 0.75 -0.63 -0.04 0.00 0.00 0.00 0.00 19.45 19.54 2k60 n ALA -1 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2k60 s SER 0 N -2.95 -0.86 -0.00 0.00 1.04 0.10 -4.80 113.70 106.23 2k60 s SER 0 Ca 0.04 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.31 2k60 s SER 0 Cb 0.13 1.87 0.01 0.00 0.10 0.00 0.00 66.02 68.12 2k60 s SER 0 CO 0.72 -0.26 0.64 -0.24 0.98 0.00 0.00 173.24 175.08 2k60 n SER 58 N 5.41 0.21 -4.78 7.02 2.88 -1.25 -3.74 113.62 119.37 2k60 n SER 58 Ca -0.04 -1.30 -0.36 0.00 -1.33 0.00 0.00 58.87 55.84 2k60 n SER 58 Cb 0.50 -0.04 -0.04 0.00 -0.75 0.00 0.00 64.21 63.88 2k60 n SER 58 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2k60 s GLU 59 N -0.14 4.16 0.42 -1.46 8.01 -1.26 -4.91 118.70 123.52 2k60 s GLU 59 Ca 0.01 1.47 0.13 0.00 0.01 0.00 0.00 54.97 56.59 2k60 s GLU 59 Cb 0.01 -2.50 0.91 0.00 -4.31 0.00 0.00 34.13 28.24 2k60 s GLU 59 CO 0.00 -0.14 1.95 -0.44 0.01 0.00 0.00 175.26 176.64 2k60 h ASP 60 N 2.42 0.06 -4.34 -0.19 5.19 -2.05 -3.43 116.42 114.08 2k60 h ASP 60 Ca -0.48 -0.01 -0.49 0.00 -0.62 0.00 0.00 57.03 55.42 2k60 h ASP 60 Cb 1.21 -0.01 0.07 0.00 0.18 0.00 0.00 39.33 40.78 2k60 h ASP 60 CO 0.62 0.25 0.38 -1.61 -3.12 0.00 0.00 179.24 175.76 2k60 s GLU 61 N -4.61 2.99 -0.28 3.56 2.02 -1.26 -5.06 118.70 116.06 2k60 s GLU 61 Ca -0.04 0.44 0.02 0.00 0.02 0.00 0.00 54.97 55.41 2k60 s GLU 61 Cb 0.15 -2.07 0.08 0.00 0.10 0.00 0.00 34.13 32.39 2k60 s GLU 61 CO 0.71 -0.91 -0.01 0.21 0.02 0.00 0.00 175.26 175.28 2k60 s LYS 62 N -5.27 1.55 0.48 1.61 2.47 -1.26 -4.98 119.74 114.33 2k60 s LYS 62 Ca 0.57 -1.33 0.09 0.00 -1.56 0.00 0.00 55.97 53.73 2k60 s LYS 62 Cb -0.11 -2.74 0.04 0.00 -1.46 0.00 0.00 37.83 33.56 2k60 s LYS 62 CO 0.51 -0.76 0.64 -0.51 0.16 0.00 0.00 175.35 175.39 2k60 s LEU 63 N 1.23 3.43 -0.12 5.43 1.02 -1.26 -5.03 118.68 123.37 2k60 s LEU 63 Ca 0.01 -0.61 -0.16 0.00 0.02 0.00 0.00 54.13 53.39 2k60 s LEU 63 Cb -0.19 -2.23 -0.26 0.00 0.02 0.00 0.00 46.19 43.53 2k60 s LEU 63 CO -0.09 -0.97 0.51 -1.28 0.02 0.00 0.00 176.35 174.54 2k60 h SER 64 N 0.49 0.33 -0.99 2.29 0.87 -2.01 -3.38 113.55 111.16 2k60 h SER 64 Ca -0.36 -0.83 0.13 0.00 -1.23 0.00 0.00 61.79 59.50 2k60 h SER 64 Cb 1.28 -0.11 -0.09 0.00 -0.44 0.00 0.00 62.40 63.05 2k60 h SER 64 CO 0.44 1.60 0.61 0.15 -0.53 0.00 0.00 176.83 179.10 2k60 h PHE 65 N -0.38 1.10 -0.53 2.24 3.04 -1.99 -0.75 116.94 119.67 2k60 h PHE 65 Ca -0.31 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.68 2k60 h PHE 65 Cb 1.70 -0.34 -0.03 0.00 2.56 0.00 0.00 35.95 39.84 2k60 h PHE 65 CO 0.12 0.39 0.33 1.05 -2.02 0.00 0.00 178.31 178.19 2k60 h GLU 66 N 0.92 0.71 0.04 1.11 4.11 -1.91 0.12 114.58 119.68 2k60 h GLU 66 Ca 0.51 -0.06 -0.00 0.00 0.07 0.00 0.00 59.36 59.88 2k60 h GLU 66 Cb 0.57 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2k60 h GLU 66 CO -0.29 0.51 -0.02 0.00 0.07 0.00 0.00 179.01 179.28 2k60 h ALA 67 N 1.17 -0.05 0.03 1.06 0.00 -1.36 -0.30 119.26 119.80 2k60 h ALA 67 Ca 0.19 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2k60 h ALA 67 Cb -0.03 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2k60 h ALA 67 CO -0.04 -0.39 -0.13 0.28 0.00 0.00 0.00 179.25 178.98 2k60 h VAL 68 N -0.33 0.69 0.00 0.00 2.07 -0.99 -0.88 116.25 116.81 2k60 h VAL 68 Ca -0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2k60 h VAL 68 Cb 0.31 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 2k60 h VAL 68 CO 0.01 0.00 -0.17 0.08 0.02 0.00 0.00 177.57 177.51 2k60 h ARG 69 N -0.23 0.00 -0.29 1.57 0.11 -0.74 -1.43 114.38 113.37 2k60 h ARG 69 Ca 0.04 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.07 2k60 h ARG 69 Cb 0.27 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 2k60 h ARG 69 CO -0.10 0.17 0.02 -0.97 0.10 0.00 0.00 179.97 179.19 2k60 h ASN 70 N 0.00 0.48 0.28 0.08 -0.00 0.29 0.36 115.58 117.07 2k60 h ASN 70 Ca -0.00 -0.29 -0.08 0.00 -0.00 0.00 0.00 56.30 55.93 2k60 h ASN 70 Cb 0.33 -0.13 -0.01 0.00 -0.00 0.00 0.00 38.32 38.51 2k60 h ASN 70 CO 0.02 0.65 -0.35 0.40 -0.00 0.00 0.00 177.43 178.15 2k60 h ILE 71 N 0.29 1.27 -0.13 2.57 5.03 -0.51 -0.67 117.51 125.36 2k60 h ILE 71 Ca 0.08 -1.27 -0.10 0.00 -0.12 0.00 0.00 64.86 63.45 2k60 h ILE 71 Cb 0.39 1.62 -0.01 0.00 -3.03 0.00 0.00 36.82 35.78 2k60 h ILE 71 CO 0.01 0.37 -0.38 0.45 -0.68 0.00 0.00 178.15 177.92 2k60 h HIS 72 N 0.09 0.31 0.00 1.37 3.86 -0.84 -2.34 115.15 117.59 2k60 h HIS 72 Ca 0.01 -0.08 -0.02 0.00 -1.16 0.00 0.00 60.37 59.12 2k60 h HIS 72 Cb 0.66 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 29.06 2k60 h HIS 72 CO 0.00 0.62 -0.09 -0.22 0.86 0.00 0.00 177.93 179.11 2k60 h LYS 73 N 0.23 0.00 -0.98 2.45 1.63 0.12 -0.72 116.57 119.30 2k60 h LYS 73 Ca 0.02 0.00 0.28 0.00 -0.85 0.00 0.00 60.65 60.10 2k60 h LYS 73 Cb 0.78 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.36 2k60 h LYS 73 CO 0.06 0.09 0.69 -0.07 -3.45 0.00 0.00 179.45 176.77 2k60 h LEU 74 N 0.00 0.08 0.07 5.20 4.07 -0.72 -2.08 115.31 121.94 2k60 h LEU 74 Ca -0.00 0.01 -0.25 0.00 0.08 0.00 0.00 57.88 57.72 2k60 h LEU 74 Cb 0.19 -0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 2k60 h LEU 74 CO 0.01 0.02 -1.32 0.24 -1.08 0.00 0.00 178.44 176.32 2k60 h MET 75 N 0.07 0.16 -5.99 1.13 2.86 -1.29 -3.45 114.93 108.43 2k60 h MET 75 Ca 0.48 -0.27 -0.60 0.00 -2.06 0.00 0.00 59.70 57.25 2k60 h MET 75 Cb 1.78 0.10 -0.11 0.00 0.06 0.00 0.00 31.60 33.43 2k60 h MET 75 CO -0.05 1.13 0.50 0.34 1.06 0.00 0.00 176.91 179.89 2k60 s ASP 76 N -6.91 6.55 0.15 1.22 2.15 -0.78 -3.23 116.67 115.82 2k60 s ASP 76 Ca -0.23 0.28 -0.17 0.00 0.43 0.00 0.00 52.55 52.87 2k60 s ASP 76 Cb 0.04 -2.43 0.04 0.00 -0.30 0.00 0.00 42.92 40.28 2k60 s ASP 76 CO 0.71 -0.89 1.75 -0.78 -0.17 0.00 0.00 175.17 175.79 2k60 h ASP 77 N 8.74 0.14 0.43 -0.34 3.58 -1.78 -2.78 116.42 124.40 2k60 h ASP 77 Ca -0.24 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.24 2k60 h ASP 77 Cb 1.08 0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.15 2k60 h ASP 77 CO 0.97 0.12 -0.52 -0.90 -2.88 0.00 0.00 179.24 176.03 2k60 n ASP 78 N -5.01 0.60 -3.31 2.28 5.75 -1.26 -4.99 116.55 110.62 2k60 n ASP 78 Ca 0.01 -0.38 -0.16 0.00 -0.01 0.00 0.00 54.79 54.24 2k60 n ASP 78 Cb 0.11 0.30 0.01 0.00 -1.03 0.00 0.00 41.12 40.52 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 -1.41 -2.66 -0.43 2.12 0.00 -1.05 -4.92 120.51 112.15 2k60 n ALA 79 Ca 0.06 0.23 0.10 0.00 0.00 0.00 0.00 53.44 53.83 2k60 n ALA 79 Cb 0.34 -1.89 0.29 0.00 0.00 0.00 0.00 19.45 18.18 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 -1.42 3.96 0.00 0.00 6.94 -1.26 -4.90 115.26 118.58 2k60 n ASN 80 Ca -0.08 -2.18 0.00 0.00 -0.02 0.00 0.00 54.58 52.29 2k60 n ASN 80 Cb 0.58 -0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.54 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 1.13 1.21 3.28 4.83 0.00 -1.26 -5.00 105.19 109.37 2k60 n GLY 81 Ca 0.22 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 -1.92 -0.40 -0.10 1.61 1.47 -1.26 -0.62 116.67 115.44 2k60 s ASP 82 Ca 0.00 0.76 -0.17 0.00 1.18 0.00 0.00 52.55 54.32 2k60 s ASP 82 Cb 0.00 0.78 -0.05 0.00 -0.34 0.00 0.00 42.92 43.31 2k60 s ASP 82 CO 0.00 -0.15 0.44 0.68 0.68 0.00 0.00 175.17 176.82 2k60 s VAL 83 N 0.14 5.17 0.35 2.11 -7.23 0.60 -4.87 120.40 116.68 2k60 s VAL 83 Ca -0.01 0.88 0.03 0.00 -1.81 0.00 0.00 61.98 61.07 2k60 s VAL 83 Cb -0.03 -3.77 -0.02 0.00 0.56 0.00 0.00 36.38 33.12 2k60 s VAL 83 CO 0.01 0.38 0.53 -0.62 -0.31 0.00 0.00 175.10 175.08 2k60 s ASP 84 N 0.29 6.12 0.45 4.85 2.15 -1.26 -1.69 116.67 127.59 2k60 s ASP 84 Ca 0.24 0.21 0.17 0.00 0.43 0.00 0.00 52.55 53.61 2k60 s ASP 84 Cb -0.15 -1.72 1.12 0.00 -0.30 0.00 0.00 42.92 41.87 2k60 s ASP 84 CO 0.10 -0.38 1.95 -0.37 -0.17 0.00 0.00 175.17 176.30 2k60 h VAL 85 N 0.77 0.80 0.23 1.11 -1.51 -1.90 -0.56 116.25 115.20 2k60 h VAL 85 Ca -0.49 -0.11 -0.33 0.00 -1.23 0.00 0.00 66.70 64.55 2k60 h VAL 85 Cb 1.24 0.45 0.03 0.00 -2.13 0.00 0.00 31.29 30.87 2k60 h VAL 85 CO 0.59 0.06 -1.44 -0.33 -1.23 0.00 0.00 177.57 175.22 2k60 h GLU 86 N 0.33 0.48 0.39 5.19 5.08 -1.97 -2.76 114.58 121.33 2k60 h GLU 86 Ca 0.33 -0.83 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 2k60 h GLU 86 Cb 0.82 0.31 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2k60 h GLU 86 CO -0.09 1.40 -0.19 0.93 -1.00 0.00 0.00 179.01 180.06 2k60 h GLU 87 N 0.13 -0.51 -0.01 2.33 5.08 -1.48 -3.01 114.58 117.11 2k60 h GLU 87 Ca -0.23 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2k60 h GLU 87 Cb 2.13 0.12 0.00 0.00 0.50 0.00 0.00 28.75 31.50 2k60 h GLU 87 CO 0.26 -0.23 -0.06 -1.13 -1.00 0.00 0.00 179.01 176.85 2k60 n SER 88 N -5.23 0.62 -0.15 1.42 3.41 -0.69 -4.47 113.62 108.54 2k60 n SER 88 Ca -0.10 -0.92 -0.05 0.00 -0.26 0.00 0.00 58.87 57.53 2k60 n SER 88 Cb 0.27 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.15 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 0.89 -0.94 -0.37 4.04 3.58 -1.35 0.48 116.42 122.75 2k60 h ASP 89 Ca 0.00 0.14 -0.11 0.00 0.42 0.00 0.00 57.03 57.48 2k60 h ASP 89 Cb 0.31 0.41 -0.01 0.00 1.72 0.00 0.00 39.33 41.76 2k60 h ASP 89 CO 0.00 -0.13 -0.19 -0.08 -2.88 0.00 0.00 179.24 175.96 2k60 h GLU 90 N -0.06 0.77 0.23 0.28 4.81 -1.83 -2.83 114.58 115.95 2k60 h GLU 90 Ca 0.06 -0.34 0.01 0.00 -0.13 0.00 0.00 59.36 58.96 2k60 h GLU 90 Cb 0.21 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 2k60 h GLU 90 CO -0.38 0.96 -0.34 0.74 -0.73 0.00 0.00 179.01 179.27 2k60 h PHE 91 N 0.57 -0.93 0.17 0.92 0.04 -1.48 -1.45 116.94 114.78 2k60 h PHE 91 Ca 0.08 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.86 2k60 h PHE 91 Cb 0.74 0.38 -0.01 0.00 2.20 0.00 0.00 35.95 39.26 2k60 h PHE 91 CO 0.06 -0.46 -0.12 1.25 -0.60 0.00 0.00 178.31 178.44 2k60 h LEU 92 N -0.64 -0.30 0.07 1.54 5.85 -0.13 0.10 115.31 121.80 2k60 h LEU 92 Ca 0.00 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2k60 h LEU 92 Cb 0.62 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 2k60 h LEU 92 CO -0.13 -0.19 -0.26 0.03 -0.34 0.00 0.00 178.44 177.55 2k60 h ARG 93 N -0.29 -0.36 0.00 1.25 3.08 -1.23 -0.07 114.38 116.75 2k60 h ARG 93 Ca -0.01 0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 2k60 h ARG 93 Cb 0.25 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2k60 h ARG 93 CO 0.00 -0.24 -0.24 0.93 -1.07 0.00 0.00 179.97 179.35 2k60 h GLU 94 N -0.38 0.00 0.00 0.04 4.39 -1.31 0.60 114.58 117.92 2k60 h GLU 94 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 2k60 h GLU 94 Cb 0.38 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2k60 h GLU 94 CO -0.13 0.60 -0.06 0.22 -1.16 0.00 0.00 179.01 178.48 2k60 h ASP 95 N -1.00 0.00 0.00 1.42 3.58 -0.85 -1.12 116.42 118.45 2k60 h ASP 95 Ca -0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2k60 h ASP 95 Cb 0.70 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.75 2k60 h ASP 95 CO -0.03 0.06 -0.35 0.00 -2.88 0.00 0.00 179.24 176.03 2k60 n LEU 96 N -3.61 0.00 -0.31 2.28 -0.00 -0.77 -4.72 117.00 109.87 2k60 n LEU 96 Ca -0.02 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.10 2k60 n LEU 96 Cb 0.17 0.00 0.09 0.00 -0.00 0.00 0.00 43.42 43.68 2k60 n LEU 96 CO 0.28 0.00 0.35 0.59 -0.00 0.00 0.00 177.39 178.60 2k60 n ASN 97 N -0.72 1.48 0.00 1.45 5.03 -0.06 -4.80 115.26 117.64 2k60 n ASN 97 Ca 0.00 -1.17 0.00 0.00 0.87 0.00 0.00 54.58 54.28 2k60 n ASN 97 Cb 0.07 0.46 0.00 0.00 -1.02 0.00 0.00 39.78 39.29 2k60 n ASN 97 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2k60 n TYR 98 N -0.55 0.00 0.02 3.10 4.02 0.19 -4.15 117.16 119.79 2k60 n TYR 98 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.98 2k60 n TYR 98 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.72 2k60 n TYR 98 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2k60 n HIS 99 N 0.00 -0.19 -4.91 -0.72 8.25 -1.19 -4.38 115.22 112.09 2k60 n HIS 99 Ca 0.00 0.03 -0.26 0.00 -0.26 0.00 0.00 57.72 57.23 2k60 n HIS 99 Cb 0.00 0.19 -0.16 0.00 1.12 0.00 0.00 29.99 31.15 2k60 n HIS 99 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2k60 s ASP 100 N -4.82 2.27 -0.02 0.41 -4.77 -1.26 -4.48 116.67 104.00 2k60 s ASP 100 Ca 0.00 -0.36 0.16 0.00 -3.30 0.00 0.00 52.55 49.04 2k60 s ASP 100 Cb 0.00 -0.48 0.49 0.00 -1.09 0.00 0.00 42.92 41.84 2k60 s ASP 100 CO 0.00 0.19 1.40 -0.81 0.70 0.00 0.00 175.17 176.65 2k60 n PRO 101 N 2.92 2.44 -0.34 2.11 -0.04 -1.26 -4.43 135.00 136.39 2k60 n PRO 101 Ca -0.17 -1.98 0.08 0.00 -0.04 0.00 0.00 63.50 61.40 2k60 n PRO 101 Cb 0.53 -1.49 0.27 0.00 -0.04 0.00 0.00 33.50 32.77 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 3.12 0.89 -0.01 0.52 2.02 -1.98 0.20 112.91 117.67 2k60 h THR 102 Ca 0.00 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.86 2k60 h THR 102 Cb 0.82 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 2k60 h THR 102 CO 0.04 0.17 0.00 1.62 0.37 0.00 0.00 175.52 177.73 2k60 h VAL 103 N 0.92 1.01 -0.22 3.16 3.04 -1.98 0.17 116.25 122.35 2k60 h VAL 103 Ca 0.49 -0.04 -0.18 0.00 -1.01 0.00 0.00 66.70 65.96 2k60 h VAL 103 Cb 0.56 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 2k60 h VAL 103 CO -0.26 0.01 -0.58 0.11 -1.01 0.00 0.00 177.57 175.85 2k60 h LYS 104 N -0.00 0.77 0.31 4.17 1.79 -1.55 0.15 116.57 122.21 2k60 h LYS 104 Ca 0.00 -0.54 -0.02 0.00 -2.18 0.00 0.00 60.65 57.92 2k60 h LYS 104 Cb 0.01 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 2k60 h LYS 104 CO -0.00 1.16 -0.15 0.45 -1.08 0.00 0.00 179.45 179.84 2k60 h HIS 105 N 0.51 -0.38 -0.23 -1.35 3.86 -0.63 -1.05 115.15 115.88 2k60 h HIS 105 Ca -0.01 -0.01 -0.16 0.00 -1.16 0.00 0.00 60.37 59.03 2k60 h HIS 105 Cb 1.19 0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.78 2k60 h HIS 105 CO 0.08 -0.18 -0.50 0.77 0.86 0.00 0.00 177.93 178.97 2k60 h SER 106 N -0.50 0.70 -0.17 2.45 0.02 -0.69 -0.69 113.55 114.65 2k60 h SER 106 Ca -0.04 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.55 2k60 h SER 106 Cb 0.38 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2k60 h SER 106 CO 0.07 1.08 0.08 0.74 -1.14 0.00 0.00 176.83 177.65 2k60 h THR 107 N 0.50 1.14 0.25 -2.27 2.02 -0.69 0.55 112.91 114.42 2k60 h THR 107 Ca 0.02 -0.42 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 2k60 h THR 107 Cb 1.05 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 2k60 h THR 107 CO 0.10 0.13 -0.12 0.15 0.37 0.00 0.00 175.52 176.16 2k60 h PHE 108 N 0.14 -0.31 0.01 3.16 3.57 -1.16 -3.38 116.94 118.98 2k60 h PHE 108 Ca 0.06 -0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.30 2k60 h PHE 108 Cb 0.14 0.10 0.01 0.00 2.79 0.00 0.00 35.95 39.00 2k60 h PHE 108 CO -0.02 -0.19 -1.01 1.25 -2.23 0.00 0.00 178.31 176.11 2k60 h HIS 109 N -1.05 0.86 0.00 0.41 2.76 -1.25 -3.47 115.15 113.41 2k60 h HIS 109 Ca -0.03 -0.47 0.00 0.00 -2.20 0.00 0.00 60.37 57.66 2k60 h HIS 109 Cb 0.25 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.12 2k60 h HIS 109 CO 0.00 1.30 0.00 0.41 -1.30 0.00 0.00 177.93 178.35 2k60 n GLY 110 N 1.04 2.21 0.15 5.26 0.00 0.19 -4.57 105.19 109.47 2k60 n GLY 110 Ca -0.09 -0.43 0.15 0.00 0.00 0.00 0.00 46.02 45.65 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 1.11 -2.62 1.61 2.13 -1.26 -4.77 120.64 116.85 2k60 n GLU 111 Ca 0.00 -0.31 -0.09 0.00 0.66 0.00 0.00 57.16 57.42 2k60 n GLU 111 Cb 0.00 -1.49 0.02 0.00 0.27 0.00 0.00 31.44 30.23 2k60 n GLU 111 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2k60 n ASP 112 N -0.67 -3.34 0.00 4.31 2.03 -1.24 -4.95 116.55 112.69 2k60 n ASP 112 Ca 0.21 -0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.39 2k60 n ASP 112 Cb 0.21 -2.18 0.00 0.00 -0.72 0.00 0.00 41.12 38.43 2k60 n ASP 112 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2k60 n LYS 113 N -2.02 0.00 -2.43 -0.67 4.76 -1.25 -4.71 118.16 111.83 2k60 n LYS 113 Ca -0.03 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.01 2k60 n LYS 113 Cb 0.54 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.69 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 0.00 4.40 -0.23 -0.35 1.02 -1.26 -4.45 118.68 117.81 2k60 s LEU 114 Ca 0.00 2.26 0.01 0.00 0.02 0.00 0.00 54.13 56.43 2k60 s LEU 114 Cb 0.00 -3.81 0.04 0.00 0.02 0.00 0.00 46.19 42.44 2k60 s LEU 114 CO 0.00 -0.33 -0.13 -0.63 0.02 0.00 0.00 176.35 175.28 2k60 s ILE 115 N -1.31 2.28 -0.04 -0.59 -1.09 -0.68 -4.41 121.20 115.35 2k60 s ILE 115 Ca 0.50 -1.26 0.01 0.00 -2.23 0.00 0.00 60.65 57.66 2k60 s ILE 115 Cb -0.30 -2.17 -0.03 0.00 -1.58 0.00 0.00 42.46 38.38 2k60 s ILE 115 CO 0.39 0.22 -0.05 -0.94 -1.23 0.00 0.00 174.94 173.33 2k60 s SER 116 N 1.21 4.79 0.20 3.58 1.04 -1.26 -0.29 113.70 122.97 2k60 s SER 116 Ca -0.02 -0.03 -0.10 0.00 0.48 0.00 0.00 55.95 56.28 2k60 s SER 116 Cb -0.17 -1.21 0.13 0.00 0.10 0.00 0.00 66.02 64.88 2k60 s SER 116 CO -0.08 0.33 1.80 -0.37 0.98 0.00 0.00 173.24 175.91 2k60 h VAL 117 N 4.01 1.23 -0.26 5.02 -1.51 -1.26 0.16 116.25 123.65 2k60 h VAL 117 Ca -0.49 -0.63 -0.07 0.00 -1.23 0.00 0.00 66.70 64.29 2k60 h VAL 117 Cb 1.17 0.31 -0.01 0.00 -2.13 0.00 0.00 31.29 30.63 2k60 h VAL 117 CO 0.54 0.27 -0.10 1.05 -1.23 0.00 0.00 177.57 178.10 2k60 h GLU 118 N 1.01 0.53 -0.10 5.19 4.11 -1.96 0.32 114.58 123.69 2k60 h GLU 118 Ca 0.25 -0.22 -0.14 0.00 0.07 0.00 0.00 59.36 59.33 2k60 h GLU 118 Cb 0.09 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2k60 h GLU 118 CO -0.03 0.76 -0.54 -0.44 0.07 0.00 0.00 179.01 178.83 2k60 h ASP 119 N 0.27 0.32 -0.50 3.06 3.32 -1.88 -1.37 116.42 119.63 2k60 h ASP 119 Ca 0.06 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 56.89 2k60 h ASP 119 Cb 0.59 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 2k60 h ASP 119 CO 0.03 0.80 0.08 -0.07 -1.72 0.00 0.00 179.24 178.35 2k60 h LEU 120 N 0.22 0.80 -0.49 1.55 3.38 -0.56 0.68 115.31 120.90 2k60 h LEU 120 Ca 0.00 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.76 2k60 h LEU 120 Cb 1.02 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.51 2k60 h LEU 120 CO 0.09 0.86 0.22 -0.25 0.09 0.00 0.00 178.44 179.45 2k60 h TRP 121 N 0.71 0.40 -0.67 1.13 7.01 -0.42 0.36 115.95 124.47 2k60 h TRP 121 Ca 0.15 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.15 2k60 h TRP 121 Cb 0.41 -0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.33 2k60 h TRP 121 CO 0.03 0.17 0.34 0.87 -2.79 0.00 0.00 178.44 177.06 2k60 h LYS 122 N 0.43 0.95 -0.07 2.65 6.56 -1.01 -1.64 116.57 124.44 2k60 h LYS 122 Ca 0.23 -0.13 -0.01 0.00 -1.06 0.00 0.00 60.65 59.68 2k60 h LYS 122 Cb 0.18 -0.18 -0.00 0.00 -0.57 0.00 0.00 32.23 31.66 2k60 h LYS 122 CO -0.19 0.74 0.02 0.00 -2.06 0.00 0.00 179.45 177.96 2k60 h ALA 123 N 1.16 0.09 -0.59 3.86 0.00 -0.08 -2.97 119.26 120.73 2k60 h ALA 123 Ca 0.23 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.11 2k60 h ALA 123 Cb 0.08 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 2k60 h ALA 123 CO -0.03 -0.31 0.24 2.35 0.00 0.00 0.00 179.25 181.50 2k60 h TRP 124 N -0.09 0.41 0.00 0.00 7.01 -0.18 0.19 115.95 123.30 2k60 h TRP 124 Ca 0.02 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.05 2k60 h TRP 124 Cb 0.21 -0.10 -0.00 0.00 -2.10 0.00 0.00 29.16 27.17 2k60 h TRP 124 CO -0.00 0.13 -0.00 0.87 -2.79 0.00 0.00 178.44 176.64 2k60 h LYS 125 N 0.43 0.00 0.00 2.65 1.57 -1.23 -1.99 116.57 118.00 2k60 h LYS 125 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2k60 h LYS 125 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2k60 h LYS 125 CO -0.27 0.00 -1.22 0.45 -0.57 0.00 0.00 179.45 177.84 2k60 n SER 126 N -4.20 0.77 -4.58 0.86 2.88 -0.24 -4.75 113.62 104.36 2k60 n SER 126 Ca -0.03 -0.76 -0.29 0.00 -1.33 0.00 0.00 58.87 56.46 2k60 n SER 126 Cb 0.09 1.21 0.13 0.00 -0.75 0.00 0.00 64.21 64.89 2k60 n SER 126 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2k60 s SER 127 N -3.35 3.96 0.50 -3.46 0.01 0.50 -4.94 113.70 106.91 2k60 s SER 127 Ca 0.04 0.50 0.24 0.00 1.31 0.00 0.00 55.95 58.04 2k60 s SER 127 Cb 0.16 -0.82 1.30 0.00 0.21 0.00 0.00 66.02 66.87 2k60 s SER 127 CO 0.88 -2.21 2.04 -0.33 0.41 0.00 0.00 173.24 174.02 2k60 h GLU 128 N -1.23 0.00 0.38 12.44 4.39 -1.90 -3.27 114.58 125.39 2k60 h GLU 128 Ca -0.45 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 2k60 h GLU 128 Cb 1.29 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.92 2k60 h GLU 128 CO 0.53 0.15 -0.39 0.28 -1.16 0.00 0.00 179.01 178.42 2k60 h VAL 129 N 0.00 0.00 0.00 3.13 2.07 -1.88 0.18 116.25 119.75 2k60 h VAL 129 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2k60 h VAL 129 Cb 0.35 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2k60 h VAL 129 CO 0.02 0.00 -0.06 0.22 0.02 0.00 0.00 177.57 177.77 2k60 h TYR 130 N -0.78 0.00 0.00 1.57 3.20 -1.60 -0.91 116.97 118.45 2k60 h TYR 130 Ca -0.05 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.70 2k60 h TYR 130 Cb 0.68 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.93 2k60 h TYR 130 CO -0.22 0.06 -0.59 -0.97 -1.64 0.00 0.00 178.16 174.80 2k60 h ASN 131 N 0.00 0.00 -2.72 -2.11 -0.73 -1.50 -3.42 115.58 105.10 2k60 h ASN 131 Ca -0.00 0.00 -0.54 0.00 1.87 0.00 0.00 56.30 57.63 2k60 h ASN 131 Cb 0.38 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.98 2k60 h ASN 131 CO 0.01 0.59 0.98 0.26 -0.37 0.00 0.00 177.43 178.90 2k60 s TRP 132 N -3.04 2.39 0.68 0.67 0.51 0.01 -4.94 118.94 115.22 2k60 s TRP 132 Ca 0.02 0.41 -0.12 0.00 -2.12 0.00 0.00 56.10 54.30 2k60 s TRP 132 Cb 0.09 -3.86 0.16 0.00 -0.81 0.00 0.00 33.47 29.04 2k60 s TRP 132 CO 0.75 -3.47 0.92 -2.37 -0.51 0.00 0.00 176.95 172.28 2k60 n THR 133 N 4.97 0.00 -0.21 2.01 5.66 -1.26 -0.92 114.28 124.53 2k60 n THR 133 Ca 0.16 -0.67 -0.05 0.00 -3.05 0.00 0.00 64.05 60.43 2k60 n THR 133 Cb 0.42 -1.65 0.05 0.00 -1.55 0.00 0.00 70.33 67.60 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 -1.55 1.09 -0.98 1.08 2.07 -1.94 -2.13 116.25 113.89 2k60 h VAL 134 Ca -0.30 -0.25 0.07 0.00 0.82 0.00 0.00 66.70 67.04 2k60 h VAL 134 Cb 0.82 0.28 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 2k60 h VAL 134 CO 0.21 0.13 0.63 0.44 0.02 0.00 0.00 177.57 179.00 2k60 h ASP 135 N 0.74 0.99 -0.07 0.57 5.19 -1.93 0.30 116.42 122.21 2k60 h ASP 135 Ca 0.24 0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 56.63 2k60 h ASP 135 Cb -0.00 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.32 2k60 h ASP 135 CO -0.09 0.61 -0.10 -0.33 -3.12 0.00 0.00 179.24 176.21 2k60 h GLU 136 N 1.12 0.20 -0.25 3.56 4.39 -1.75 -1.28 114.58 120.55 2k60 h GLU 136 Ca 0.44 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.93 2k60 h GLU 136 Cb 0.22 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2k60 h GLU 136 CO -0.19 0.67 -0.22 -0.24 -1.16 0.00 0.00 179.01 177.88 2k60 h VAL 137 N -0.26 1.25 0.25 3.13 3.04 -1.13 -0.55 116.25 121.99 2k60 h VAL 137 Ca 0.01 -1.19 -0.01 0.00 -1.01 0.00 0.00 66.70 64.50 2k60 h VAL 137 Cb 0.65 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 31.24 2k60 h VAL 137 CO 0.02 0.38 -0.12 0.58 -1.01 0.00 0.00 177.57 177.42 2k60 h VAL 138 N 0.42 0.77 -0.02 1.51 2.07 -0.82 0.44 116.25 120.61 2k60 h VAL 138 Ca 0.07 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 2k60 h VAL 138 Cb 0.61 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2k60 h VAL 138 CO 0.04 0.02 -0.28 0.06 0.02 0.00 0.00 177.57 177.43 2k60 h GLN 139 N -0.38 0.04 -0.07 1.57 3.07 -1.06 -1.35 115.11 116.93 2k60 h GLN 139 Ca -0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 58.65 58.66 2k60 h GLN 139 Cb 0.29 -0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.84 2k60 h GLN 139 CO 0.06 0.32 -0.08 2.35 0.09 0.00 0.00 178.83 181.56 2k60 h TRP 140 N 0.04 0.22 -0.57 0.06 2.91 -0.71 -0.05 115.95 117.85 2k60 h TRP 140 Ca 0.00 -0.07 -0.06 0.00 1.13 0.00 0.00 58.89 59.90 2k60 h TRP 140 Cb 0.51 -0.05 -0.03 0.00 -0.51 0.00 0.00 29.16 29.09 2k60 h TRP 140 CO 0.00 0.64 0.12 1.37 -1.03 0.00 0.00 178.44 179.55 2k60 h LEU 141 N -0.26 0.84 -0.02 0.65 8.10 0.16 0.65 115.31 125.44 2k60 h LEU 141 Ca 0.01 -0.16 -0.05 0.00 0.11 0.00 0.00 57.88 57.79 2k60 h LEU 141 Cb 0.61 -0.22 0.00 0.00 -0.44 0.00 0.00 40.66 40.61 2k60 h LEU 141 CO 0.02 0.83 -0.18 0.16 -4.11 0.00 0.00 178.44 175.16 2k60 h ILE 142 N 0.86 1.51 0.00 0.15 3.07 -1.23 0.25 117.51 122.12 2k60 h ILE 142 Ca 0.18 -1.75 -0.00 0.00 1.55 0.00 0.00 64.86 64.84 2k60 h ILE 142 Cb 0.33 2.58 -0.00 0.00 -0.27 0.00 0.00 36.82 39.47 2k60 h ILE 142 CO 0.00 0.48 -0.02 0.00 -1.05 0.00 0.00 178.15 177.56 2k60 h THR 143 N -0.46 0.05 0.00 0.16 1.03 -0.74 -0.63 112.91 112.32 2k60 h THR 143 Ca -0.02 -0.57 -0.07 0.00 -0.01 0.00 0.00 66.41 65.74 2k60 h THR 143 Cb 0.88 1.54 -0.01 0.00 -1.07 0.00 0.00 68.15 69.49 2k60 h THR 143 CO 0.04 0.02 -1.27 -1.22 -0.01 0.00 0.00 175.52 173.08 2k60 n TYR 144 N -3.12 0.00 0.12 0.00 4.01 0.20 -4.72 117.16 113.65 2k60 n TYR 144 Ca 0.01 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.82 2k60 n TYR 144 Cb 0.32 -0.18 0.02 0.00 -0.31 0.00 0.00 39.34 39.20 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 -0.07 0.24 -0.73 -0.72 2.07 -0.63 -3.48 116.25 112.93 2k60 h VAL 145 Ca -0.11 -1.40 -0.15 0.00 0.82 0.00 0.00 66.70 65.86 2k60 h VAL 145 Cb 1.14 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.74 2k60 h VAL 145 CO -0.04 0.14 -0.17 -0.62 0.02 0.00 0.00 177.57 176.90 2k60 n GLU 146 N -2.90 -0.56 -3.28 1.57 1.02 -0.24 -4.93 120.64 111.32 2k60 n GLU 146 Ca -0.01 0.55 -0.45 0.00 -0.02 0.00 0.00 57.16 57.24 2k60 n GLU 146 Cb 0.64 -4.42 -0.06 0.00 -0.02 0.00 0.00 31.44 27.57 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 -1.94 5.64 -0.12 -4.62 2.01 -1.22 -4.93 118.68 113.49 2k60 s LEU 147 Ca 0.00 -1.40 0.04 0.00 0.01 0.00 0.00 54.13 52.78 2k60 s LEU 147 Cb 0.00 -2.26 0.30 0.00 0.01 0.00 0.00 46.19 44.25 2k60 s LEU 147 CO 0.00 -0.82 1.13 -0.81 1.01 0.00 0.00 176.35 176.85 2k60 n PRO 148 N 5.56 2.16 -0.33 1.29 -0.04 -1.26 -3.52 135.00 138.86 2k60 n PRO 148 Ca -0.11 -1.22 0.11 0.00 -0.04 0.00 0.00 63.50 62.24 2k60 n PRO 148 Cb 0.43 -1.68 0.30 0.00 -0.04 0.00 0.00 33.50 32.51 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 0.10 2.59 -0.33 0.54 -0.06 -1.26 -4.61 117.38 114.35 2k60 n GLN 149 Ca 0.15 -2.46 0.04 0.00 -2.00 0.00 0.00 57.00 52.73 2k60 n GLN 149 Cb 0.75 -1.54 0.19 0.00 -4.06 0.00 0.00 30.24 25.58 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 4.12 1.03 -0.14 3.69 -0.00 -1.96 -1.44 116.97 122.26 2k60 h TYR 150 Ca 0.00 0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 58.75 2k60 h TYR 150 Cb 0.94 -0.33 -0.01 0.00 -0.00 0.00 0.00 36.73 37.34 2k60 h TYR 150 CO 0.43 0.45 0.03 1.49 -0.00 0.00 0.00 178.16 180.57 2k60 h GLU 151 N 0.95 0.22 -0.38 0.10 4.81 -1.92 0.34 114.58 118.71 2k60 h GLU 151 Ca 0.43 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.55 2k60 h GLU 151 Cb 0.34 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2k60 h GLU 151 CO -0.23 0.39 0.00 0.93 -0.73 0.00 0.00 179.01 179.37 2k60 h GLU 152 N 0.02 0.67 -0.31 1.92 4.39 -1.84 -1.05 114.58 118.38 2k60 h GLU 152 Ca 0.04 -0.21 -0.16 0.00 0.34 0.00 0.00 59.36 59.37 2k60 h GLU 152 Cb 0.27 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2k60 h GLU 152 CO 0.00 0.77 -0.43 0.00 -1.16 0.00 0.00 179.01 178.19 2k60 h THR 153 N 0.50 1.28 -0.24 1.13 1.03 -1.00 0.28 112.91 115.88 2k60 h THR 153 Ca 0.11 -1.61 -0.10 0.00 -0.01 0.00 0.00 66.41 64.79 2k60 h THR 153 Cb 0.46 1.57 -0.01 0.00 -1.07 0.00 0.00 68.15 69.11 2k60 h THR 153 CO 0.02 0.53 -0.27 2.19 -0.01 0.00 0.00 175.52 177.97 2k60 h PHE 154 N 0.61 0.54 0.00 0.00 -5.15 -0.24 0.74 116.94 113.43 2k60 h PHE 154 Ca 0.03 -0.12 -0.06 0.00 -0.20 0.00 0.00 57.97 57.62 2k60 h PHE 154 Cb 1.03 -0.13 -0.01 0.00 0.22 0.00 0.00 35.95 37.06 2k60 h PHE 154 CO 0.07 0.71 -0.29 0.07 -2.00 0.00 0.00 178.31 176.87 2k60 h ARG 155 N 0.42 0.00 0.01 6.09 0.11 -1.01 0.20 114.38 120.20 2k60 h ARG 155 Ca 0.06 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.14 2k60 h ARG 155 Cb 0.70 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.78 2k60 h ARG 155 CO 0.05 0.29 -0.01 0.87 0.10 0.00 0.00 179.97 181.28 2k60 h LYS 156 N 0.00 -0.02 0.00 0.08 1.79 0.17 -3.42 116.57 115.18 2k60 h LYS 156 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k60 h LYS 156 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2k60 h LYS 156 CO 0.04 0.78 -0.18 1.47 -1.08 0.00 0.00 179.45 180.47 2k60 n LEU 157 N -4.69 0.12 -2.79 2.94 -0.00 0.15 -5.08 117.00 107.64 2k60 n LEU 157 Ca -0.09 -0.47 -0.02 0.00 -0.00 0.00 0.00 56.01 55.43 2k60 n LEU 157 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.81 2k60 n LEU 157 CO 0.31 0.03 -0.41 0.00 -0.00 0.00 0.00 177.39 177.32 2k60 n GLN 158 N -1.09 -3.06 -3.18 1.47 6.02 0.70 -5.00 117.38 113.23 2k60 n GLN 158 Ca 0.00 2.52 -0.28 0.00 -0.01 0.00 0.00 57.00 59.23 2k60 n GLN 158 Cb 0.04 -5.05 -0.03 0.00 1.02 0.00 0.00 30.24 26.22 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 -1.76 3.97 0.00 1.08 2.34 -1.26 -4.86 118.68 118.18 2k60 s LEU 159 Ca 0.05 0.80 0.00 0.00 0.06 0.00 0.00 54.13 55.03 2k60 s LEU 159 Cb -0.01 -3.64 0.00 0.00 -0.56 0.00 0.00 46.19 41.97 2k60 s LEU 159 CO 0.73 -0.28 0.00 -1.54 -1.06 0.00 0.00 176.35 174.20 2k60 n SER 160 N -1.20 0.00 0.31 1.48 3.41 -1.26 -3.78 113.62 112.58 2k60 n SER 160 Ca -0.01 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.79 2k60 n SER 160 Cb 0.54 0.00 1.03 0.00 -0.26 0.00 0.00 64.21 65.52 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 -1.12 0.27 103.07 108.40 2k60 h GLY 161 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 2k60 h GLY 161 CO 0.00 0.00 -1.57 0.84 0.00 0.00 0.00 176.54 175.81 2k60 h HIS 162 N 0.00 0.58 0.00 5.60 -0.00 -1.84 -3.29 115.15 116.21 2k60 h HIS 162 Ca -0.00 -0.42 -0.08 0.00 -0.00 0.00 0.00 60.37 59.87 2k60 h HIS 162 Cb 0.09 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.47 2k60 h HIS 162 CO 0.00 1.47 -0.39 0.00 -0.00 0.00 0.00 177.93 179.01 2k60 h ALA 163 N 0.37 0.98 -0.25 5.26 0.00 -1.60 -2.44 119.26 121.59 2k60 h ALA 163 Ca -0.26 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.34 2k60 h ALA 163 Cb 2.05 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 19.70 2k60 h ALA 163 CO 0.18 0.49 -0.45 0.52 0.00 0.00 0.00 179.25 179.99 2k60 h MET 164 N 0.00 -0.42 -0.27 0.00 2.86 -0.58 0.83 114.93 117.35 2k60 h MET 164 Ca -0.00 0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 2k60 h MET 164 Cb 0.92 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 2k60 h MET 164 CO 0.05 -0.28 -0.23 -1.00 1.06 0.00 0.00 176.91 176.51 2k60 h PRO 165 N -0.44 0.63 -1.00 -0.22 0.13 -1.72 -2.51 132.00 126.88 2k60 h PRO 165 Ca 0.09 -0.32 0.19 0.00 -0.87 0.00 0.00 66.00 65.09 2k60 h PRO 165 Cb 0.62 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.65 2k60 h PRO 165 CO -0.48 0.92 0.61 -0.09 -0.23 0.00 0.00 178.00 178.73 2k60 h ARG 166 N 0.36 0.75 0.00 0.86 2.43 -0.88 -1.35 114.38 116.55 2k60 h ARG 166 Ca 0.05 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2k60 h ARG 166 Cb 0.78 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 2k60 h ARG 166 CO 0.06 0.49 -0.55 1.37 -1.51 0.00 0.00 179.97 179.83 2k60 h LEU 167 N 0.77 0.00 -0.88 3.80 8.10 0.70 -3.27 115.31 124.52 2k60 h LEU 167 Ca 0.57 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.56 2k60 h LEU 167 Cb 0.88 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.10 2k60 h LEU 167 CO -0.36 0.23 0.00 0.00 -4.11 0.00 0.00 178.44 174.19 2k60 h ALA 168 N 1.77 1.00 -2.91 0.17 0.00 -0.78 -3.36 119.26 115.16 2k60 h ALA 168 Ca -0.02 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.24 2k60 h ALA 168 Cb 1.19 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.80 2k60 h ALA 168 CO 0.03 0.00 -0.54 0.54 0.00 0.00 0.00 179.25 179.28 2k60 s VAL 169 N -3.38 5.14 0.00 0.00 0.11 -1.21 -4.49 120.40 116.56 2k60 s VAL 169 Ca 0.03 0.11 0.00 0.00 -2.93 0.00 0.00 61.98 59.19 2k60 s VAL 169 Cb 0.09 -3.45 0.00 0.00 -1.53 0.00 0.00 36.38 31.49 2k60 s VAL 169 CO 0.38 0.26 0.00 0.35 -3.33 0.00 0.00 175.10 172.76 2k60 n THR 170 N 5.04 0.00 0.00 5.04 -2.24 -1.26 -4.06 114.28 116.79 2k60 n THR 170 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2k60 n THR 170 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 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 0.00 0.00 -0.28 3.42 0.23 -1.26 -4.75 115.26 112.62 2k60 n ASN 171 Ca 0.00 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 54.11 2k60 n ASN 171 Cb 0.00 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 37.90 2k60 n ASN 171 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2k60 h THR 172 N 0.00 0.74 -0.57 5.53 2.02 -1.91 -0.40 112.91 118.31 2k60 h THR 172 Ca 0.00 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2k60 h THR 172 Cb 0.00 0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 2k60 h THR 172 CO 0.00 0.11 0.26 0.74 0.37 0.00 0.00 175.52 177.00 2k60 h THR 173 N 0.58 1.19 0.09 3.16 2.02 -1.85 -3.11 112.91 114.99 2k60 h THR 173 Ca 0.43 -0.57 -0.13 0.00 0.77 0.00 0.00 66.41 66.91 2k60 h THR 173 Cb 0.59 0.48 0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2k60 h THR 173 CO -0.35 0.23 -0.60 -0.03 0.37 0.00 0.00 175.52 175.14 2k60 h MET 174 N 0.81 0.19 -5.74 6.66 1.85 -1.41 -3.43 114.93 113.86 2k60 h MET 174 Ca 0.20 -0.33 -0.44 0.00 -0.61 0.00 0.00 59.70 58.52 2k60 h MET 174 Cb 0.11 0.12 -0.06 0.00 0.43 0.00 0.00 31.60 32.20 2k60 h MET 174 CO -0.02 1.16 1.29 -0.08 -0.40 0.00 0.00 176.91 178.85 2k60 s THR 175 N -2.36 3.71 -0.29 -0.77 -1.32 -0.30 -4.62 115.64 109.68 2k60 s THR 175 Ca -0.16 -0.94 0.16 0.00 -1.21 0.00 0.00 61.69 59.54 2k60 s THR 175 Cb -0.00 -4.63 0.54 0.00 -1.51 0.00 0.00 72.50 66.90 2k60 s THR 175 CO 0.78 -1.37 1.44 0.61 -2.21 0.00 0.00 174.62 173.86 2k60 n GLY 176 N 6.23 3.77 3.59 6.08 0.00 -1.26 -4.91 105.19 118.70 2k60 n GLY 176 Ca 0.42 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 2k60 n GLY 176 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k60 s THR 177 N -2.60 0.00 -1.06 2.61 2.01 -1.26 -5.04 115.64 110.29 2k60 s THR 177 Ca 0.42 -1.41 -0.24 0.00 0.31 0.00 0.00 61.69 60.78 2k60 s THR 177 Cb 0.32 -2.77 -0.07 0.00 0.01 0.00 0.00 72.50 69.99 2k60 s THR 177 CO 0.11 0.00 1.94 0.54 -0.69 0.00 0.00 174.62 176.52 2k60 s VAL 178 N -2.68 3.50 -0.37 3.82 0.11 -1.26 -4.83 120.40 118.68 2k60 s VAL 178 Ca 0.26 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.65 2k60 s VAL 178 Cb -0.02 -4.32 0.11 0.00 -1.53 0.00 0.00 36.38 30.63 2k60 s VAL 178 CO 0.18 -0.96 0.15 -0.22 -3.33 0.00 0.00 175.10 170.92 2k60 s LEU 179 N 10.69 3.00 0.38 2.54 2.96 -1.26 -5.02 118.68 131.96 2k60 s LEU 179 Ca 0.69 -2.17 0.00 0.00 -0.22 0.00 0.00 54.13 52.44 2k60 s LEU 179 Cb -0.03 -1.12 0.00 0.00 0.50 0.00 0.00 46.19 45.54 2k60 s LEU 179 CO 0.07 -0.35 0.00 1.17 -1.32 0.00 0.00 176.35 175.93 2k60 n LYS 180 N 4.17 -2.10 -0.06 1.98 3.00 -1.26 -4.84 118.16 119.07 2k60 n LYS 180 Ca 0.03 1.71 -0.07 0.00 -0.00 0.00 0.00 58.31 59.98 2k60 n LYS 180 Cb 0.39 -2.40 -0.06 0.00 0.00 0.00 0.00 35.03 32.96 2k60 n LYS 180 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 2k60 n MET 181 N -3.30 0.86 -2.74 1.64 0.00 -1.26 -4.95 117.12 107.36 2k60 n MET 181 Ca -0.05 0.05 -0.43 0.00 -0.00 0.00 0.00 57.70 57.27 2k60 n MET 181 Cb 0.41 -1.24 -0.03 0.00 0.00 0.00 0.00 33.22 32.36 2k60 n MET 181 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2k60 s THR 182 N -2.24 4.51 0.13 1.12 -4.23 -1.26 -4.94 115.64 108.74 2k60 s THR 182 Ca -0.13 1.30 -0.19 0.00 -1.18 0.00 0.00 61.69 61.49 2k60 s THR 182 Cb 0.04 -4.39 -0.03 0.00 1.34 0.00 0.00 72.50 69.46 2k60 s THR 182 CO 0.30 -0.60 1.72 0.44 -0.54 0.00 0.00 174.62 175.94 2k60 h ASP 183 N 8.51 -0.09 -0.04 3.99 5.19 -1.95 0.96 116.42 132.99 2k60 h ASP 183 Ca -0.23 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.23 2k60 h ASP 183 Cb 1.07 0.09 -0.00 0.00 0.18 0.00 0.00 39.33 40.67 2k60 h ASP 183 CO 1.01 -0.02 -0.01 -0.09 -3.12 0.00 0.00 179.24 177.02 2k60 h ARG 184 N 0.07 0.07 -0.81 3.56 2.43 -1.92 -0.18 114.38 117.60 2k60 h ARG 184 Ca 0.10 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.31 2k60 h ARG 184 Cb 0.13 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.62 2k60 h ARG 184 CO -0.18 0.43 0.49 1.03 -1.51 0.00 0.00 179.97 180.23 2k60 h SER 185 N -0.29 0.75 0.54 -3.80 0.87 -1.95 0.41 113.55 110.09 2k60 h SER 185 Ca 0.01 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.57 2k60 h SER 185 Cb 0.40 -0.13 0.01 0.00 -0.44 0.00 0.00 62.40 62.24 2k60 h SER 185 CO 0.00 0.47 -0.26 -0.74 -0.53 0.00 0.00 176.83 175.77 2k60 h HIS 186 N 0.88 -0.67 -0.93 2.24 -0.00 -0.67 -1.60 115.15 114.39 2k60 h HIS 186 Ca 0.36 -0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.71 2k60 h HIS 186 Cb 0.21 0.22 -0.04 0.00 -0.00 0.00 0.00 27.41 27.80 2k60 h HIS 186 CO -0.05 -0.36 0.56 0.07 -0.00 0.00 0.00 177.93 178.15 2k60 h ARG 187 N -0.89 1.27 0.06 5.26 0.11 -0.64 -1.19 114.38 118.35 2k60 h ARG 187 Ca -0.07 -0.12 -0.00 0.00 0.10 0.00 0.00 59.98 59.89 2k60 h ARG 187 Cb 0.62 -0.26 -0.00 0.00 1.11 0.00 0.00 29.97 31.43 2k60 h ARG 187 CO 0.12 0.89 -0.03 1.96 0.10 0.00 0.00 179.97 183.01 2k60 h GLN 188 N 1.29 -0.09 -0.09 0.08 1.08 -0.05 0.64 115.11 117.98 2k60 h GLN 188 Ca 0.33 0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.52 2k60 h GLN 188 Cb -0.05 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.40 2k60 h GLN 188 CO -0.06 -0.06 -0.03 0.87 -0.95 0.00 0.00 178.83 178.60 2k60 h LYS 189 N -0.09 0.18 -0.15 1.46 1.79 -1.11 -0.80 116.57 117.85 2k60 h LYS 189 Ca -0.01 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 2k60 h LYS 189 Cb 0.07 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 2k60 h LYS 189 CO 0.01 0.52 0.06 -0.07 -1.08 0.00 0.00 179.45 178.89 2k60 h LEU 190 N -0.17 0.21 -0.69 2.94 -0.00 -1.15 -1.99 115.31 114.46 2k60 h LEU 190 Ca 0.02 -0.16 -0.12 0.00 -0.00 0.00 0.00 57.88 57.63 2k60 h LEU 190 Cb 0.46 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.05 2k60 h LEU 190 CO 0.01 0.31 -0.23 0.06 -0.00 0.00 0.00 178.44 178.60 2k60 h GLN 191 N 0.09 0.77 0.06 1.13 3.07 0.29 0.40 115.11 120.92 2k60 h GLN 191 Ca 0.05 -0.31 0.01 0.00 0.09 0.00 0.00 58.65 58.49 2k60 h GLN 191 Cb 0.17 -0.03 -0.02 0.00 0.08 0.00 0.00 27.48 27.67 2k60 h GLN 191 CO -0.00 0.92 -0.12 -0.07 0.09 0.00 0.00 178.83 179.65 2k60 h LEU 192 N 0.67 -0.34 0.01 0.06 -0.00 -0.96 0.52 115.31 115.27 2k60 h LEU 192 Ca 0.09 0.04 -0.00 0.00 -0.00 0.00 0.00 57.88 58.01 2k60 h LEU 192 Cb 0.74 0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 2k60 h LEU 192 CO 0.06 -0.18 -0.00 0.11 -0.00 0.00 0.00 178.44 178.43 2k60 h LYS 193 N -0.23 -0.01 -0.40 1.13 6.56 -1.12 -1.68 116.57 120.82 2k60 h LYS 193 Ca 0.03 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.57 2k60 h LYS 193 Cb 0.26 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.90 2k60 h LYS 193 CO -0.08 0.55 0.07 0.00 -2.06 0.00 0.00 179.45 177.93 2k60 h ALA 194 N 0.43 0.54 -0.20 3.86 0.00 -0.13 -0.06 119.26 123.70 2k60 h ALA 194 Ca -0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 2k60 h ALA 194 Cb 0.56 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2k60 h ALA 194 CO 0.00 0.24 -0.18 1.25 0.00 0.00 0.00 179.25 180.57 2k60 h LEU 195 N 0.52 0.50 -1.64 0.00 5.85 -0.04 0.46 115.31 120.94 2k60 h LEU 195 Ca 0.12 -0.47 0.05 0.00 0.84 0.00 0.00 57.88 58.42 2k60 h LEU 195 Cb 0.36 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2k60 h LEU 195 CO 0.01 0.86 0.31 -0.78 -0.34 0.00 0.00 178.44 178.50 2k60 h ASP 196 N 0.14 0.39 0.09 1.25 3.58 -1.21 -0.69 116.42 119.97 2k60 h ASP 196 Ca 0.03 -0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 2k60 h ASP 196 Cb 0.71 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.67 2k60 h ASP 196 CO 0.04 0.26 -0.04 0.74 -2.88 0.00 0.00 179.24 177.37 2k60 h THR 197 N 0.45 1.05 0.00 2.25 2.02 -0.54 0.22 112.91 118.36 2k60 h THR 197 Ca 0.20 -1.40 -0.00 0.00 0.77 0.00 0.00 66.41 65.97 2k60 h THR 197 Cb 0.22 1.83 -0.00 0.00 -1.74 0.00 0.00 68.15 68.45 2k60 h THR 197 CO -0.05 0.30 -0.02 -0.37 0.37 0.00 0.00 175.52 175.75 2k60 h VAL 198 N -0.86 0.77 0.00 3.16 -1.51 0.16 -1.64 116.25 116.33 2k60 h VAL 198 Ca -0.01 -0.07 -0.13 0.00 -1.23 0.00 0.00 66.70 65.26 2k60 h VAL 198 Cb 0.58 1.04 -0.02 0.00 -2.13 0.00 0.00 31.29 30.76 2k60 h VAL 198 CO 0.02 0.02 -0.73 -0.07 -1.23 0.00 0.00 177.57 175.58 2k60 h LEU 199 N 0.00 0.00 0.00 4.19 3.38 -1.20 -3.40 115.31 118.27 2k60 h LEU 199 Ca -0.00 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.32 2k60 h LEU 199 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2k60 h LEU 199 CO 0.00 1.25 -0.03 0.33 0.09 0.00 0.00 178.44 180.08 2k60 n PHE 200 N -4.52 0.00 -0.85 1.13 -0.00 0.57 -4.97 117.46 108.82 2k60 n PHE 200 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.23 2k60 n PHE 200 Cb 0.57 -0.01 0.00 0.00 -0.00 0.00 0.00 39.48 40.03 2k60 n PHE 200 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17