#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ind h PHE 61 N 0.00 0.00 -0.56 7.33 0.04 -1.98 -3.14 116.94 118.63 3ind h PHE 61 Ca 0.00 0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.87 3ind h PHE 61 Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 3ind h PHE 61 CO 0.00 0.03 0.38 -0.39 -0.60 0.00 0.00 178.31 177.73 3ind h VAL 62 N 0.00 0.88 -0.00 -0.55 -1.51 -2.02 0.04 116.25 113.09 3ind h VAL 62 Ca -0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 3ind h VAL 62 Cb 0.61 0.51 0.00 0.00 -2.13 0.00 0.00 31.29 30.29 3ind h VAL 62 CO 0.00 0.06 -0.00 -0.62 -1.23 0.00 0.00 177.57 175.78 3ind n GLU 63 N -4.46 0.65 -0.00 5.19 1.02 -1.19 -2.64 120.64 119.21 3ind n GLU 63 Ca 0.09 -0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.32 3ind n GLU 63 Cb 0.39 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.19 3ind n GLU 63 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 3ind n MET 64 N -1.17 0.84 -1.74 3.49 2.81 -0.02 -4.57 117.12 116.75 3ind n MET 64 Ca 0.18 -0.06 -0.42 0.00 -1.81 0.00 0.00 57.70 55.59 3ind n MET 64 Cb 0.19 -1.39 -0.01 0.00 -0.71 0.00 0.00 33.22 31.30 3ind n MET 64 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3ind n VAL 65 N -1.67 1.39 -2.01 2.03 0.31 -1.08 -1.92 118.33 115.37 3ind n VAL 65 Ca 0.01 -0.35 -0.21 0.00 -0.01 0.00 0.00 64.34 63.79 3ind n VAL 65 Cb 0.35 -1.89 -0.05 0.00 -0.91 0.00 0.00 33.84 31.35 3ind n VAL 65 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3ind n ASP 66 N 1.54 -5.72 -0.09 4.52 2.03 -1.17 -4.85 116.55 112.81 3ind n ASP 66 Ca 0.06 0.24 0.10 0.00 0.52 0.00 0.00 54.79 55.71 3ind n ASP 66 Cb 0.37 -4.89 0.54 0.00 -0.72 0.00 0.00 41.12 36.42 3ind n ASP 66 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3ind n ASN 67 N -1.68 0.26 -4.52 1.67 6.94 -0.81 -4.78 115.26 112.34 3ind n ASN 67 Ca -0.23 -1.45 -0.34 0.00 -0.02 0.00 0.00 54.58 52.55 3ind n ASN 67 Cb 0.69 -0.02 -0.12 0.00 -2.36 0.00 0.00 39.78 37.97 3ind n ASN 67 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3ind s LEU 68 N -1.59 3.04 0.21 -4.53 1.02 -0.55 -4.25 118.68 112.02 3ind s LEU 68 Ca 0.29 -0.11 0.01 0.00 0.02 0.00 0.00 54.13 54.34 3ind s LEU 68 Cb 0.14 -1.67 -0.05 0.00 0.02 0.00 0.00 46.19 44.63 3ind s LEU 68 CO 0.23 0.31 0.07 -0.13 0.02 0.00 0.00 176.35 176.85 3ind s ARG 69 N -0.49 1.23 0.00 1.70 1.81 -0.35 -2.26 118.95 120.60 3ind s ARG 69 Ca 0.07 -1.64 0.00 0.00 -1.72 0.00 0.00 55.73 52.44 3ind s ARG 69 Cb -0.12 -0.12 0.00 0.00 -0.45 0.00 0.00 34.95 34.26 3ind s ARG 69 CO 0.02 -0.26 0.00 0.41 -0.68 0.00 0.00 175.30 174.79 3ind n GLY 70 N -0.32 0.91 3.82 -3.53 0.00 -0.98 0.58 105.19 105.67 3ind n GLY 70 Ca -0.02 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 3ind n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ind s LYS 71 N -2.00 3.25 -0.14 1.61 -0.14 -1.25 -0.37 119.74 120.71 3ind s LYS 71 Ca 0.00 -0.32 -0.38 0.00 -1.36 0.00 0.00 55.97 53.91 3ind s LYS 71 Cb 0.00 -3.01 -0.15 0.00 -1.68 0.00 0.00 37.83 32.99 3ind s LYS 71 CO 0.00 0.71 1.64 0.45 -0.76 0.00 0.00 175.35 177.38 3ind n SER 72 N 1.56 2.31 0.00 2.83 2.88 0.41 -0.24 113.62 123.37 3ind n SER 72 Ca -0.16 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.46 3ind n SER 72 Cb 0.54 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 3ind n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3ind n GLY 73 N 3.70 1.90 0.81 0.46 0.00 -1.26 -4.84 105.19 105.96 3ind n GLY 73 Ca 0.23 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.32 3ind n GLY 73 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ind n GLN 74 N -2.00 2.92 0.00 1.61 6.02 0.66 -4.89 117.38 121.71 3ind n GLN 74 Ca 0.00 -2.27 0.00 0.00 -0.01 0.00 0.00 57.00 54.72 3ind n GLN 74 Cb 0.00 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 29.85 3ind n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ind n GLY 75 N 0.55 -0.54 3.54 1.08 0.00 -1.23 -4.75 105.19 103.84 3ind n GLY 75 Ca 0.15 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.10 3ind n GLY 75 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ind s TYR 76 N -1.82 3.03 0.14 1.61 1.51 -1.26 -3.87 117.35 116.69 3ind s TYR 76 Ca 0.00 -0.17 0.11 0.00 -1.01 0.00 0.00 57.07 56.00 3ind s TYR 76 Cb 0.00 -1.90 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 3ind s TYR 76 CO 0.00 0.10 -0.26 1.52 -1.11 0.00 0.00 175.55 175.79 3ind s TYR 77 N -0.00 2.29 0.08 2.71 1.13 0.20 -0.52 117.35 123.23 3ind s TYR 77 Ca 0.01 -0.38 0.08 0.00 -1.41 0.00 0.00 57.07 55.37 3ind s TYR 77 Cb -0.13 -1.22 -0.04 0.00 -1.10 0.00 0.00 41.96 39.47 3ind s TYR 77 CO 0.03 0.36 -0.16 0.54 -2.51 0.00 0.00 175.55 173.81 3ind s VAL 78 N -1.15 2.99 0.12 -3.49 0.11 -0.40 -1.21 120.40 117.38 3ind s VAL 78 Ca 0.15 -1.30 -0.30 0.00 -2.93 0.00 0.00 61.98 57.60 3ind s VAL 78 Cb -0.10 -2.34 -0.06 0.00 -1.53 0.00 0.00 36.38 32.35 3ind s VAL 78 CO 0.06 0.20 1.07 -0.70 -3.33 0.00 0.00 175.10 172.41 3ind s GLU 79 N -1.87 4.58 0.12 1.54 2.12 -1.26 -0.32 118.70 123.62 3ind s GLU 79 Ca 0.17 1.63 0.02 0.00 0.36 0.00 0.00 54.97 57.16 3ind s GLU 79 Cb -0.11 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.90 3ind s GLU 79 CO 0.09 0.03 -0.07 -1.64 -0.54 0.00 0.00 175.26 173.14 3ind s MET 80 N 0.14 0.93 0.04 4.30 -1.94 0.85 -3.91 119.30 119.71 3ind s MET 80 Ca 0.51 -1.39 0.09 0.00 -1.71 0.00 0.00 55.69 53.18 3ind s MET 80 Cb -0.27 -0.33 -0.03 0.00 2.01 0.00 0.00 34.83 36.22 3ind s MET 80 CO 0.32 -0.01 -0.25 0.95 -0.01 0.00 0.00 175.02 176.02 3ind s THR 81 N -3.55 2.21 -0.02 2.05 -4.23 -0.32 -0.68 115.64 111.10 3ind s THR 81 Ca 0.15 -1.34 0.03 0.00 -1.18 0.00 0.00 61.69 59.35 3ind s THR 81 Cb 0.05 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 72.03 3ind s THR 81 CO -0.02 0.39 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.65 3ind s VAL 82 N -0.80 0.85 0.01 2.29 1.01 -0.35 -1.65 120.40 121.75 3ind s VAL 82 Ca 0.12 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.69 3ind s VAL 82 Cb -0.10 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.53 3ind s VAL 82 CO 0.02 0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3ind n GLY 83 N 3.21 -2.25 2.89 4.51 0.00 0.03 -1.33 105.19 112.25 3ind n GLY 83 Ca -0.18 -1.52 -0.25 0.00 0.00 0.00 0.00 46.02 44.07 3ind n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ind s SER 84 N -2.25 1.95 1.08 1.61 0.01 -1.26 -3.05 113.70 111.79 3ind s SER 84 Ca 0.00 -0.25 -0.12 0.00 1.31 0.00 0.00 55.95 56.89 3ind s SER 84 Cb 0.00 -0.73 0.24 0.00 0.21 0.00 0.00 66.02 65.73 3ind s SER 84 CO 0.00 -0.12 1.06 -2.84 0.41 0.00 0.00 173.24 171.75 3ind s PRO 85 N 1.63 -0.26 -0.13 12.44 0.02 -1.26 -0.68 135.00 146.76 3ind s PRO 85 Ca 0.02 0.78 -0.29 0.00 0.02 0.00 0.00 61.00 61.53 3ind s PRO 85 Cb -0.13 -1.64 -0.05 0.00 0.02 0.00 0.00 34.50 32.71 3ind s PRO 85 CO -0.06 -3.26 1.80 -2.14 -0.33 0.00 0.00 177.00 173.00 3ind s PRO 86 N -4.66 3.85 -0.27 5.54 0.02 -1.17 -4.88 135.00 133.43 3ind s PRO 86 Ca 0.67 2.05 -0.19 0.00 0.02 0.00 0.00 61.00 63.55 3ind s PRO 86 Cb -0.22 -4.11 -0.02 0.00 0.02 0.00 0.00 34.50 30.17 3ind s PRO 86 CO 0.61 -1.25 0.55 -0.65 -0.33 0.00 0.00 177.00 175.94 3ind s GLN 87 N 4.75 4.02 -0.00 5.54 -0.21 -0.44 -4.84 119.66 128.48 3ind s GLN 87 Ca 0.80 0.33 -0.30 0.00 0.02 0.00 0.00 55.36 56.21 3ind s GLN 87 Cb -0.32 -3.67 -0.03 0.00 1.00 0.00 0.00 33.01 29.99 3ind s GLN 87 CO 0.33 -0.41 0.97 0.99 -2.12 0.00 0.00 175.29 175.05 3ind s THR 88 N 2.40 4.87 -0.08 -0.19 2.01 -1.26 -1.21 115.64 122.18 3ind s THR 88 Ca 0.22 2.05 -0.09 0.00 0.31 0.00 0.00 61.69 64.18 3ind s THR 88 Cb -0.15 -4.31 0.02 0.00 0.01 0.00 0.00 72.50 68.06 3ind s THR 88 CO 0.10 0.16 0.25 -0.76 -0.69 0.00 0.00 174.62 173.68 3ind s LEU 89 N 1.01 1.07 -0.17 4.42 1.43 0.14 -4.94 118.68 121.65 3ind s LEU 89 Ca 0.52 0.38 -0.21 0.00 -1.03 0.00 0.00 54.13 53.79 3ind s LEU 89 Cb -0.21 0.90 -0.03 0.00 0.03 0.00 0.00 46.19 46.88 3ind s LEU 89 CO 0.28 -0.16 0.62 0.20 0.23 0.00 0.00 176.35 177.52 3ind s ASN 90 N -0.20 6.73 -0.17 2.29 0.01 -1.26 -0.11 114.94 122.23 3ind s ASN 90 Ca -0.03 0.88 0.01 0.00 -0.71 0.00 0.00 52.86 53.01 3ind s ASN 90 Cb -0.03 -2.35 0.03 0.00 0.41 0.00 0.00 41.25 39.31 3ind s ASN 90 CO 0.01 -0.21 -0.14 -0.63 -1.51 0.00 0.00 177.10 174.61 3ind s ILE 91 N 1.58 1.71 0.22 0.60 -1.09 0.57 0.55 121.20 125.33 3ind s ILE 91 Ca 0.30 -0.82 -0.32 0.00 -2.23 0.00 0.00 60.65 57.57 3ind s ILE 91 Cb -0.16 -1.64 -0.12 0.00 -1.58 0.00 0.00 42.46 38.95 3ind s ILE 91 CO 0.11 0.38 1.63 -0.11 -1.23 0.00 0.00 174.94 175.73 3ind n LEU 92 N 4.71 3.82 -4.61 2.97 7.94 0.22 -1.27 117.00 130.79 3ind n LEU 92 Ca -0.17 1.10 -0.42 0.00 -1.11 0.00 0.00 56.01 55.40 3ind n LEU 92 Cb 0.49 -1.54 -0.04 0.00 0.53 0.00 0.00 43.42 42.86 3ind n LEU 92 CO 0.22 0.01 0.70 -0.69 -1.11 0.00 0.00 177.39 176.52 3ind s VAL 93 N 0.69 4.67 -0.32 1.96 1.01 0.32 0.18 120.40 128.91 3ind s VAL 93 Ca 0.72 1.20 0.01 0.00 0.00 0.00 0.00 61.98 63.91 3ind s VAL 93 Cb -0.55 -4.26 0.10 0.00 0.00 0.00 0.00 36.38 31.67 3ind s VAL 93 CO 0.39 -0.42 0.09 -0.62 0.00 0.00 0.00 175.10 174.54 3ind s ASP 94 N 1.76 4.22 0.00 3.32 2.15 -0.68 -4.09 116.67 123.36 3ind s ASP 94 Ca 0.36 -1.79 0.16 0.00 0.43 0.00 0.00 52.55 51.71 3ind s ASP 94 Cb -0.13 -1.07 0.95 0.00 -0.30 0.00 0.00 42.92 42.37 3ind s ASP 94 CO 0.16 -0.40 1.61 0.35 -0.17 0.00 0.00 175.17 176.72 3ind n THR 95 N 4.68 0.00 -0.23 1.71 -2.24 -1.26 0.01 114.28 116.94 3ind n THR 95 Ca -0.00 -0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.85 3ind n THR 95 Cb 0.42 -0.24 0.21 0.00 -2.10 0.00 0.00 70.33 68.61 3ind n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ind n GLY 96 N 0.75 2.65 3.59 3.38 0.00 -1.26 -4.25 105.19 110.05 3ind n GLY 96 Ca 0.12 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 3ind n GLY 96 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ind s SER 97 N -1.00 0.32 0.00 1.61 1.04 -1.23 -4.99 113.70 109.46 3ind s SER 97 Ca 0.32 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.56 3ind s SER 97 Cb 0.17 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.95 3ind s SER 97 CO 0.22 -1.30 0.49 -1.20 0.98 0.00 0.00 173.24 172.43 3ind n SER 98 N -0.96 0.69 -4.65 7.02 7.64 -1.26 -0.01 113.62 122.09 3ind n SER 98 Ca -0.02 -1.24 -0.35 0.00 1.01 0.00 0.00 58.87 58.28 3ind n SER 98 Cb 0.61 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.72 3ind n SER 98 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3ind s ASN 99 N -0.24 5.43 -0.64 6.43 -0.87 -1.26 -4.48 114.94 119.31 3ind s ASN 99 Ca 0.00 0.11 -0.26 0.00 -1.57 0.00 0.00 52.86 51.14 3ind s ASN 99 Cb 0.00 -1.78 0.04 0.00 -0.02 0.00 0.00 41.25 39.49 3ind s ASN 99 CO 0.00 0.26 1.14 0.12 -2.57 0.00 0.00 177.10 176.05 3ind s PHE 100 N -0.19 2.54 -0.09 2.20 5.36 -1.26 -1.32 117.98 125.22 3ind s PHE 100 Ca 0.06 0.00 0.02 0.00 -0.96 0.00 0.00 56.93 56.05 3ind s PHE 100 Cb -0.12 -4.43 0.02 0.00 -0.34 0.00 0.00 43.02 38.14 3ind s PHE 100 CO 0.02 -1.73 -0.13 0.00 -1.46 0.00 0.00 175.22 171.92 3ind s ALA 101 N 4.88 1.48 -0.02 11.12 0.00 -0.52 -0.36 121.76 138.34 3ind s ALA 101 Ca 0.34 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.74 3ind s ALA 101 Cb -0.10 -0.75 -0.00 0.00 0.00 0.00 0.00 23.12 22.27 3ind s ALA 101 CO 0.18 -0.06 -0.10 0.08 0.00 0.00 0.00 175.76 175.87 3ind s VAL 102 N 0.98 0.79 0.09 0.00 1.01 -0.16 0.57 120.40 123.68 3ind s VAL 102 Ca -0.08 -0.39 -0.36 0.00 0.00 0.00 0.00 61.98 61.14 3ind s VAL 102 Cb -0.15 -0.68 -0.17 0.00 0.00 0.00 0.00 36.38 35.38 3ind s VAL 102 CO -0.01 0.24 1.35 0.61 0.00 0.00 0.00 175.10 177.29 3ind n GLY 103 N 3.08 0.50 0.39 4.51 0.00 0.17 -0.31 105.19 113.54 3ind n GLY 103 Ca -0.16 0.70 0.01 0.00 0.00 0.00 0.00 46.02 46.57 3ind n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ind n ALA 104 N 2.56 1.93 -3.21 4.61 0.00 -0.07 -0.03 120.51 126.30 3ind n ALA 104 Ca 0.18 -1.15 -0.13 0.00 0.00 0.00 0.00 53.44 52.34 3ind n ALA 104 Cb 0.20 -0.43 -0.05 0.00 0.00 0.00 0.00 19.45 19.17 3ind n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ind s ALA 105 N -0.37 -1.18 0.55 0.00 0.00 -1.19 -4.80 121.76 114.77 3ind s ALA 105 Ca 0.04 0.38 -0.20 0.00 0.00 0.00 0.00 51.96 52.18 3ind s ALA 105 Cb 0.03 0.47 -0.06 0.00 0.00 0.00 0.00 23.12 23.56 3ind s ALA 105 CO 0.00 -0.54 0.98 -2.30 0.00 0.00 0.00 175.76 173.91 3ind n PRO 106 N 0.25 1.06 -3.65 0.00 -0.02 -1.26 -4.92 135.00 126.46 3ind n PRO 106 Ca -0.18 0.40 -0.13 0.00 -2.02 0.00 0.00 63.50 61.57 3ind n PRO 106 Cb 0.61 -2.14 -0.08 0.00 -0.02 0.00 0.00 33.50 31.87 3ind n PRO 106 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3ind s HIS 107 N -1.45 -0.75 0.51 6.00 2.46 -1.26 -5.03 115.29 115.77 3ind s HIS 107 Ca 0.72 1.78 0.29 0.00 0.47 0.00 0.00 55.06 58.32 3ind s HIS 107 Cb -0.45 0.29 1.41 0.00 -0.13 0.00 0.00 32.58 33.70 3ind s HIS 107 CO 0.50 -0.36 1.87 -1.00 -2.47 0.00 0.00 174.74 173.28 3ind h PRO 108 N 5.38 0.08 -0.01 2.88 0.13 -2.03 0.29 132.00 138.71 3ind h PRO 108 Ca -0.29 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3ind h PRO 108 Cb 1.17 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3ind h PRO 108 CO 0.11 0.05 -0.37 1.19 -0.23 0.00 0.00 178.00 178.75 3ind n PHE 109 N -4.31 0.00 -3.73 1.56 3.72 -1.26 -4.87 117.46 108.56 3ind n PHE 109 Ca 0.20 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.24 3ind n PHE 109 Cb 0.95 -0.10 -0.09 0.00 -0.94 0.00 0.00 39.48 39.29 3ind n PHE 109 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ind s LEU 110 N -2.57 4.09 -0.02 4.37 1.43 0.10 -4.62 118.68 121.45 3ind s LEU 110 Ca 0.21 0.13 0.22 0.00 -1.03 0.00 0.00 54.13 53.66 3ind s LEU 110 Cb 0.19 -2.08 -0.30 0.00 0.03 0.00 0.00 46.19 44.03 3ind s LEU 110 CO 0.57 0.11 0.61 1.41 0.23 0.00 0.00 176.35 179.28 3ind n HIS 111 N 3.97 0.02 -4.09 0.29 8.25 -1.26 -4.49 115.22 117.90 3ind n HIS 111 Ca -0.16 0.01 -0.08 0.00 -0.26 0.00 0.00 57.72 57.23 3ind n HIS 111 Cb 0.52 -0.37 -0.10 0.00 1.12 0.00 0.00 29.99 31.15 3ind n HIS 111 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3ind s ARG 112 N -3.38 0.62 0.12 -0.41 0.52 -1.26 -5.15 118.95 110.02 3ind s ARG 112 Ca -0.04 -1.17 -0.20 0.00 -0.52 0.00 0.00 55.73 53.80 3ind s ARG 112 Cb 0.14 0.11 0.05 0.00 0.52 0.00 0.00 34.95 35.78 3ind s ARG 112 CO 0.90 -0.08 0.50 1.52 0.02 0.00 0.00 175.30 178.16 3ind s TYR 113 N -3.57 -0.38 0.03 -0.53 -0.85 -1.26 -4.90 117.35 105.89 3ind s TYR 113 Ca 0.05 0.19 -0.30 0.00 -0.52 0.00 0.00 57.07 56.49 3ind s TYR 113 Cb 0.05 0.39 -0.07 0.00 0.38 0.00 0.00 41.96 42.71 3ind s TYR 113 CO -0.08 -0.75 1.66 -0.47 -1.52 0.00 0.00 175.55 174.40 3ind s TYR 114 N -3.48 2.25 -0.45 -3.49 5.04 0.95 -4.92 117.35 113.26 3ind s TYR 114 Ca 0.00 0.26 -0.02 0.00 -2.44 0.00 0.00 57.07 54.87 3ind s TYR 114 Cb 0.00 -3.96 0.12 0.00 0.35 0.00 0.00 41.96 38.48 3ind s TYR 114 CO -0.10 -3.91 0.24 -0.65 -1.34 0.00 0.00 175.55 169.79 3ind s GLN 115 N 3.11 2.09 0.34 4.97 -0.21 -1.26 -4.22 119.66 124.48 3ind s GLN 115 Ca 0.74 -1.98 0.04 0.00 0.02 0.00 0.00 55.36 54.18 3ind s GLN 115 Cb -0.38 -3.59 0.66 0.00 1.00 0.00 0.00 33.01 30.70 3ind s GLN 115 CO 0.32 -1.09 1.94 0.00 -2.12 0.00 0.00 175.29 174.34 3ind h ARG 116 N 7.79 0.83 0.00 2.91 3.08 -1.93 -1.81 114.38 125.26 3ind h ARG 116 Ca -0.10 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.86 3ind h ARG 116 Cb 1.02 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 3ind h ARG 116 CO 0.69 0.55 -0.18 -0.56 -1.07 0.00 0.00 179.97 179.41 3ind h GLN 117 N 0.86 0.00 -0.00 0.04 -0.00 -2.00 -1.26 115.11 112.76 3ind h GLN 117 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.99 3ind h GLN 117 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.72 3ind h GLN 117 CO -0.12 0.18 -0.03 1.28 -0.00 0.00 0.00 178.83 180.13 3ind n LEU 118 N -3.63 0.11 -4.48 0.06 4.32 -0.68 -4.78 117.00 107.91 3ind n LEU 118 Ca -0.01 0.22 -0.37 0.00 -0.02 0.00 0.00 56.01 55.83 3ind n LEU 118 Cb 0.31 -0.26 -0.12 0.00 -1.62 0.00 0.00 43.42 41.72 3ind n LEU 118 CO 0.32 0.02 -0.25 -0.55 -1.22 0.00 0.00 177.39 175.70 3ind s SER 119 N -2.55 5.35 0.34 -1.43 0.15 -0.48 -4.17 113.70 110.91 3ind s SER 119 Ca 0.28 -0.15 0.26 0.00 0.70 0.00 0.00 55.95 57.05 3ind s SER 119 Cb 0.20 -1.97 0.91 0.00 -1.71 0.00 0.00 66.02 63.45 3ind s SER 119 CO 0.47 -0.03 1.77 0.77 1.20 0.00 0.00 173.24 177.42 3ind h SER 120 N 8.22 0.00 -0.26 5.45 4.64 -1.18 -3.13 113.55 127.29 3ind h SER 120 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3ind h SER 120 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3ind h SER 120 CO 0.57 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.88 3ind n THR 121 N -2.59 0.48 -2.23 2.95 -2.24 -1.26 -4.97 114.28 104.42 3ind n THR 121 Ca 0.03 -0.74 -0.41 0.00 -2.27 0.00 0.00 64.05 60.66 3ind n THR 121 Cb 0.35 0.93 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 3ind n THR 121 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3ind s TYR 122 N -1.19 3.24 -0.11 4.78 5.04 -1.18 -4.52 117.35 123.41 3ind s TYR 122 Ca 0.26 1.40 -0.01 0.00 -2.44 0.00 0.00 57.07 56.29 3ind s TYR 122 Cb 0.16 -3.57 0.03 0.00 0.35 0.00 0.00 41.96 38.93 3ind s TYR 122 CO 0.22 -1.59 -0.04 1.03 -1.34 0.00 0.00 175.55 173.83 3ind s ARG 123 N -1.10 1.11 0.27 4.97 0.52 -0.49 -5.01 118.95 119.22 3ind s ARG 123 Ca 0.51 -0.17 -0.29 0.00 -0.52 0.00 0.00 55.73 55.26 3ind s ARG 123 Cb -0.37 -1.45 -0.10 0.00 0.52 0.00 0.00 34.95 33.55 3ind s ARG 123 CO 0.45 -0.33 1.31 0.34 0.02 0.00 0.00 175.30 177.09 3ind s ASP 124 N 1.81 6.85 0.00 0.23 -1.08 -1.26 -1.00 116.67 122.21 3ind s ASP 124 Ca 0.04 2.54 0.26 0.00 -0.52 0.00 0.00 52.55 54.87 3ind s ASP 124 Cb -0.13 -2.63 0.53 0.00 -1.46 0.00 0.00 42.92 39.23 3ind s ASP 124 CO -0.07 -0.52 1.45 0.18 0.52 0.00 0.00 175.17 176.73 3ind n LEU 125 N 1.71 2.41 -3.89 -1.34 4.77 -0.74 -4.88 117.00 115.04 3ind n LEU 125 Ca 0.03 -0.81 -0.34 0.00 -0.03 0.00 0.00 56.01 54.87 3ind n LEU 125 Cb 0.42 -0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.52 3ind n LEU 125 CO 0.58 0.40 -0.20 0.54 -1.33 0.00 0.00 177.39 177.39 3ind n ARG 126 N 0.88 -0.98 -3.60 3.23 3.00 -1.26 -4.97 116.66 112.96 3ind n ARG 126 Ca 0.16 0.48 -0.02 0.00 -0.01 0.00 0.00 57.85 58.45 3ind n ARG 126 Cb 0.50 -2.50 -0.05 0.00 0.00 0.00 0.00 32.46 30.41 3ind n ARG 126 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 3ind s LYS 127 N -5.98 0.53 0.66 5.56 2.20 -1.26 -5.05 119.74 116.40 3ind s LYS 127 Ca 0.22 1.15 -0.08 0.00 -0.36 0.00 0.00 55.97 56.90 3ind s LYS 127 Cb -0.12 0.49 0.03 0.00 -1.51 0.00 0.00 37.83 36.72 3ind s LYS 127 CO 0.93 -0.15 1.00 0.20 -0.36 0.00 0.00 175.35 176.96 3ind s GLY 128 N 2.26 1.63 -0.11 5.54 0.00 -1.26 -0.23 107.32 115.16 3ind s GLY 128 Ca -0.07 -0.67 -0.05 0.00 0.00 0.00 0.00 44.72 43.93 3ind s GLY 128 CO -0.18 -0.32 0.25 0.54 0.00 0.00 0.00 173.10 173.39 3ind s VAL 129 N -3.19 -0.08 -0.18 1.40 0.11 -0.49 -4.78 120.40 113.20 3ind s VAL 129 Ca 0.57 0.16 0.01 0.00 -2.93 0.00 0.00 61.98 59.79 3ind s VAL 129 Cb -0.11 -0.39 0.01 0.00 -1.53 0.00 0.00 36.38 34.36 3ind s VAL 129 CO 0.47 0.07 -0.18 -0.47 -3.33 0.00 0.00 175.10 171.66 3ind s TYR 130 N 1.38 2.78 -0.56 1.54 5.04 -1.26 -1.24 117.35 125.03 3ind s TYR 130 Ca -0.08 -1.43 0.04 0.00 -2.44 0.00 0.00 57.07 53.16 3ind s TYR 130 Cb -0.11 -1.92 0.15 0.00 0.35 0.00 0.00 41.96 40.43 3ind s TYR 130 CO -0.09 -0.70 0.35 0.08 -1.34 0.00 0.00 175.55 173.85 3ind s VAL 131 N 1.17 2.24 0.26 3.14 1.01 -0.26 -4.97 120.40 122.99 3ind s VAL 131 Ca 0.02 -3.44 -0.23 0.00 0.00 0.00 0.00 61.98 58.32 3ind s VAL 131 Cb -0.14 -2.52 -0.09 0.00 0.00 0.00 0.00 36.38 33.63 3ind s VAL 131 CO -0.08 -0.93 0.83 -2.16 0.00 0.00 0.00 175.10 172.75 3ind s PRO 132 N -0.55 4.43 0.29 2.72 0.04 -1.26 -1.88 135.00 138.79 3ind s PRO 132 Ca 0.21 1.10 -0.04 0.00 0.04 0.00 0.00 61.00 62.31 3ind s PRO 132 Cb -0.15 -2.88 -0.01 0.00 0.04 0.00 0.00 34.50 31.50 3ind s PRO 132 CO -0.08 0.36 0.41 1.52 0.04 0.00 0.00 177.00 179.25 3ind s TYR 133 N -1.53 0.93 0.12 0.56 -0.85 0.09 -4.97 117.35 111.70 3ind s TYR 133 Ca 0.46 -1.18 -0.32 0.00 -0.52 0.00 0.00 57.07 55.50 3ind s TYR 133 Cb -0.18 -0.12 -0.10 0.00 0.38 0.00 0.00 41.96 41.93 3ind s TYR 133 CO 0.23 -1.00 1.56 1.15 -1.52 0.00 0.00 175.55 175.96 3ind h THR 134 N 2.23 0.03 0.00 -3.49 2.02 -2.03 -2.79 112.91 108.89 3ind h THR 134 Ca -0.29 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.83 3ind h THR 134 Cb 1.24 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 3ind h THR 134 CO 0.40 0.00 -0.31 1.56 0.37 0.00 0.00 175.52 177.54 3ind h GLN 135 N -0.54 0.00 0.00 6.66 4.20 -1.97 -3.48 115.11 119.97 3ind h GLN 135 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3ind h GLN 135 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 3ind h GLN 135 CO -0.45 0.31 0.00 0.41 -0.67 0.00 0.00 178.83 178.43 3ind n GLY 136 N 0.78 1.46 3.63 3.46 0.00 -1.05 -4.84 105.19 108.63 3ind n GLY 136 Ca 0.02 0.04 0.01 0.00 0.00 0.00 0.00 46.02 46.09 3ind n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ind s LYS 137 N 4.99 0.49 -0.08 1.61 -2.85 -0.81 -0.73 119.74 122.36 3ind s LYS 137 Ca 0.00 -0.27 -0.15 0.00 -1.00 0.00 0.00 55.97 54.56 3ind s LYS 137 Cb 0.00 0.17 0.03 0.00 -2.06 0.00 0.00 37.83 35.97 3ind s LYS 137 CO 0.00 -0.22 0.36 1.67 0.10 0.00 0.00 175.35 177.26 3ind s TRP 138 N -2.52 -0.33 0.07 1.78 1.48 -0.79 -0.78 118.94 117.86 3ind s TRP 138 Ca 0.14 0.70 0.09 0.00 -1.06 0.00 0.00 56.10 55.97 3ind s TRP 138 Cb 0.04 0.14 -0.03 0.00 -1.16 0.00 0.00 33.47 32.45 3ind s TRP 138 CO -0.03 -0.30 -0.24 -2.00 -4.06 0.00 0.00 176.95 170.32 3ind s GLU 139 N -0.52 1.76 0.37 3.25 2.12 0.11 -1.10 118.70 124.69 3ind s GLU 139 Ca -0.06 -1.15 -0.09 0.00 0.36 0.00 0.00 54.97 54.03 3ind s GLU 139 Cb -0.04 -2.02 0.04 0.00 0.26 0.00 0.00 34.13 32.37 3ind s GLU 139 CO 0.03 0.50 0.66 0.41 -0.54 0.00 0.00 175.26 176.31 3ind n GLY 140 N 1.41 1.47 3.24 -1.50 0.00 -0.37 -1.64 105.19 107.80 3ind n GLY 140 Ca -0.17 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.12 3ind n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ind s GLU 141 N -2.40 2.83 0.30 1.61 2.02 -0.58 -1.40 118.70 121.08 3ind s GLU 141 Ca 0.22 -0.89 -0.27 0.00 0.02 0.00 0.00 54.97 54.05 3ind s GLU 141 Cb -0.03 -2.23 -0.10 0.00 0.10 0.00 0.00 34.13 31.87 3ind s GLU 141 CO 0.16 0.26 0.94 -0.51 0.02 0.00 0.00 175.26 176.13 3ind s LEU 142 N 0.13 4.42 0.14 1.80 1.43 0.69 -1.37 118.68 125.91 3ind s LEU 142 Ca -0.12 1.86 -0.24 0.00 -1.03 0.00 0.00 54.13 54.59 3ind s LEU 142 Cb -0.16 -3.90 0.08 0.00 0.03 0.00 0.00 46.19 42.24 3ind s LEU 142 CO 0.07 -0.00 1.06 -0.83 0.23 0.00 0.00 176.35 176.87 3ind s GLY 143 N -1.50 -0.06 0.28 -3.19 0.00 -0.95 -1.79 107.32 100.11 3ind s GLY 143 Ca 0.48 -0.06 0.12 0.00 0.00 0.00 0.00 44.72 45.25 3ind s GLY 143 CO 0.26 1.62 -0.20 -0.51 0.00 0.00 0.00 173.10 174.27 3ind s THR 144 N -2.52 2.46 0.17 0.90 -4.23 -0.17 0.07 115.64 112.32 3ind s THR 144 Ca 0.19 -2.40 -0.24 0.00 -1.18 0.00 0.00 61.69 58.05 3ind s THR 144 Cb -0.01 -2.30 0.06 0.00 1.34 0.00 0.00 72.50 71.59 3ind s THR 144 CO 0.03 -0.40 0.96 -0.62 -0.54 0.00 0.00 174.62 174.05 3ind s ASP 145 N -3.51 -0.13 0.05 3.99 -1.08 -1.01 -1.39 116.67 113.59 3ind s ASP 145 Ca 0.30 -0.50 -0.30 0.00 -0.52 0.00 0.00 52.55 51.53 3ind s ASP 145 Cb -0.05 0.51 -0.04 0.00 -1.46 0.00 0.00 42.92 41.88 3ind s ASP 145 CO 0.15 -0.97 0.98 -0.76 0.52 0.00 0.00 175.17 175.09 3ind s LEU 146 N -3.04 4.42 -0.03 -1.34 1.43 -1.26 -1.74 118.68 117.12 3ind s LEU 146 Ca 0.14 1.73 0.04 0.00 -1.03 0.00 0.00 54.13 55.01 3ind s LEU 146 Cb -0.02 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.62 3ind s LEU 146 CO 0.03 -0.19 -0.14 -0.69 0.23 0.00 0.00 176.35 175.60 3ind s VAL 147 N 0.58 1.16 0.13 -1.59 1.01 0.96 -0.79 120.40 121.86 3ind s VAL 147 Ca 0.50 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.95 3ind s VAL 147 Cb -0.22 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 3ind s VAL 147 CO 0.29 0.34 -0.10 -0.44 0.00 0.00 0.00 175.10 175.19 3ind s SER 148 N 0.07 1.68 -0.34 3.32 0.01 -0.66 -1.66 113.70 116.11 3ind s SER 148 Ca -0.03 -0.99 0.03 0.00 1.31 0.00 0.00 55.95 56.28 3ind s SER 148 Cb -0.10 0.00 0.10 0.00 0.21 0.00 0.00 66.02 66.24 3ind s SER 148 CO 0.01 -0.34 0.06 -0.63 0.41 0.00 0.00 173.24 172.76 3ind s ILE 149 N -3.25 2.10 0.34 1.44 1.01 -1.26 -1.17 121.20 120.40 3ind s ILE 149 Ca 0.15 -2.26 0.12 0.00 0.00 0.00 0.00 60.65 58.66 3ind s ILE 149 Cb 0.02 -2.55 0.34 0.00 0.01 0.00 0.00 42.46 40.28 3ind s ILE 149 CO -0.00 -0.62 1.76 -0.65 0.00 0.00 0.00 174.94 175.43 3ind h PRO 150 N 7.63 0.55 -1.38 2.79 0.11 -1.90 0.17 132.00 139.98 3ind h PRO 150 Ca -0.05 -0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.36 3ind h PRO 150 Cb 1.01 -0.12 -0.34 0.00 0.11 0.00 0.00 31.00 31.66 3ind h PRO 150 CO 0.52 0.37 0.29 0.72 -0.21 0.00 0.00 178.00 179.69 3ind n HIS 151 N -4.76 3.10 -1.63 0.65 8.25 -1.26 -4.93 115.22 114.64 3ind n HIS 151 Ca 0.25 -2.67 0.00 0.00 -0.26 0.00 0.00 57.72 55.04 3ind n HIS 151 Cb 0.73 -0.88 0.00 0.00 1.12 0.00 0.00 29.99 30.96 3ind n HIS 151 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ind n GLY 152 N -0.67 5.44 3.78 -1.41 0.00 0.61 -4.26 105.19 108.68 3ind n GLY 152 Ca 0.52 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 3ind n GLY 152 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ind s PRO 153 N 2.55 4.16 -1.09 1.61 0.04 -1.26 -4.84 135.00 136.18 3ind s PRO 153 Ca 0.00 2.45 -0.07 0.00 0.04 0.00 0.00 61.00 63.42 3ind s PRO 153 Cb 0.00 -2.98 -0.08 0.00 0.04 0.00 0.00 34.50 31.48 3ind s PRO 153 CO 0.00 -0.44 2.53 -1.71 0.04 0.00 0.00 177.00 177.42 3ind n ASN 154 N 0.52 6.31 -4.30 6.66 5.15 -1.26 -4.61 115.26 123.74 3ind n ASN 154 Ca 0.01 -2.41 -0.16 0.00 -0.60 0.00 0.00 54.58 51.42 3ind n ASN 154 Cb 0.40 -1.27 -0.10 0.00 -0.53 0.00 0.00 39.78 38.28 3ind n ASN 154 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3ind s VAL 155 N 2.71 0.87 -0.03 3.44 -7.23 -1.26 -5.15 120.40 113.75 3ind s VAL 155 Ca 0.52 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.70 3ind s VAL 155 Cb 0.15 -2.29 0.01 0.00 0.56 0.00 0.00 36.38 34.81 3ind s VAL 155 CO -0.04 -0.35 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.43 3ind s THR 156 N -3.53 0.71 0.11 5.32 2.01 -1.26 -4.51 115.64 114.50 3ind s THR 156 Ca 0.28 -0.29 0.07 0.00 0.31 0.00 0.00 61.69 62.05 3ind s THR 156 Cb 0.06 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 3ind s THR 156 CO 0.07 0.24 -0.18 0.68 -0.69 0.00 0.00 174.62 174.74 3ind s VAL 157 N 0.39 1.55 -0.40 3.82 -7.23 -0.67 -4.92 120.40 112.96 3ind s VAL 157 Ca -0.06 -1.59 -0.23 0.00 -1.81 0.00 0.00 61.98 58.30 3ind s VAL 157 Cb -0.10 -1.50 0.02 0.00 0.56 0.00 0.00 36.38 35.35 3ind s VAL 157 CO 0.01 -0.19 0.76 -0.60 -0.31 0.00 0.00 175.10 174.76 3ind s ARG 158 N -2.14 3.58 0.25 4.82 3.52 -1.26 -0.03 118.95 127.70 3ind s ARG 158 Ca 0.07 0.08 0.12 0.00 -0.13 0.00 0.00 55.73 55.86 3ind s ARG 158 Cb -0.09 -3.87 -0.05 0.00 -1.56 0.00 0.00 34.95 29.39 3ind s ARG 158 CO 0.04 -0.95 -0.20 0.00 -0.81 0.00 0.00 175.30 173.38 3ind s ALA 159 N 3.11 2.72 0.30 6.12 0.00 -0.71 -4.90 121.76 128.40 3ind s ALA 159 Ca 0.29 -1.79 -0.29 0.00 0.00 0.00 0.00 51.96 50.18 3ind s ALA 159 Cb -0.13 -0.33 -0.10 0.00 0.00 0.00 0.00 23.12 22.56 3ind s ALA 159 CO 0.19 0.33 1.37 -0.80 0.00 0.00 0.00 175.76 176.85 3ind s ASN 160 N -3.26 6.69 -0.08 0.00 0.01 -1.26 -2.39 114.94 114.64 3ind s ASN 160 Ca 0.27 2.71 0.00 0.00 -0.71 0.00 0.00 52.86 55.14 3ind s ASN 160 Cb -0.06 -2.64 0.02 0.00 0.41 0.00 0.00 41.25 38.98 3ind s ASN 160 CO 0.14 -0.63 -0.05 -0.63 -1.51 0.00 0.00 177.10 174.41 3ind s ILE 161 N -0.69 0.72 -0.45 0.60 1.01 0.11 -4.58 121.20 117.92 3ind s ILE 161 Ca 0.53 -0.16 -0.22 0.00 0.00 0.00 0.00 60.65 60.80 3ind s ILE 161 Cb -0.41 -0.77 0.03 0.00 0.01 0.00 0.00 42.46 41.32 3ind s ILE 161 CO 0.50 0.30 0.75 0.00 0.00 0.00 0.00 174.94 176.49 3ind s ALA 162 N 1.40 3.30 -0.63 9.38 0.00 0.51 -2.25 121.76 133.47 3ind s ALA 162 Ca -0.02 -1.07 -0.25 0.00 0.00 0.00 0.00 51.96 50.61 3ind s ALA 162 Cb -0.13 -3.44 0.04 0.00 0.00 0.00 0.00 23.12 19.59 3ind s ALA 162 CO -0.03 -1.91 1.07 0.00 0.00 0.00 0.00 175.76 174.89 3ind s ALA 163 N 3.19 3.02 -0.30 0.00 0.00 -0.47 -0.99 121.76 126.21 3ind s ALA 163 Ca 0.28 -1.36 -0.29 0.00 0.00 0.00 0.00 51.96 50.59 3ind s ALA 163 Cb -0.13 -3.94 -0.01 0.00 0.00 0.00 0.00 23.12 19.03 3ind s ALA 163 CO 0.22 -2.75 1.64 0.42 0.00 0.00 0.00 175.76 175.29 3ind s ILE 164 N 4.58 3.66 -0.13 0.00 1.01 0.58 -1.53 121.20 129.37 3ind s ILE 164 Ca 0.31 0.70 0.19 0.00 0.00 0.00 0.00 60.65 61.86 3ind s ILE 164 Cb -0.12 -3.79 -0.28 0.00 0.01 0.00 0.00 42.46 38.28 3ind s ILE 164 CO 0.17 -0.44 0.23 0.35 0.00 0.00 0.00 174.94 175.25 3ind n THR 165 N 6.95 0.81 -3.82 2.92 -2.24 -0.65 -0.89 114.28 117.37 3ind n THR 165 Ca 0.20 -0.70 -0.12 0.00 -2.27 0.00 0.00 64.05 61.16 3ind n THR 165 Cb 0.46 -0.28 -0.10 0.00 -2.10 0.00 0.00 70.33 68.31 3ind n THR 165 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3ind s GLU 166 N -2.88 0.47 0.16 -0.78 2.56 -1.14 -4.78 118.70 112.31 3ind s GLU 166 Ca -0.09 -0.11 -0.20 0.00 0.00 0.00 0.00 54.97 54.57 3ind s GLU 166 Cb 0.09 0.21 0.05 0.00 2.00 0.00 0.00 34.13 36.48 3ind s GLU 166 CO 0.84 -0.11 0.53 -1.54 -0.56 0.00 0.00 175.26 174.42 3ind s SER 167 N -0.89 -0.43 -0.07 -1.70 1.04 -1.26 0.05 113.70 110.45 3ind s SER 167 Ca -0.10 -0.16 -0.01 0.00 0.48 0.00 0.00 55.95 56.17 3ind s SER 167 Cb -0.05 0.56 0.03 0.00 0.10 0.00 0.00 66.02 66.66 3ind s SER 167 CO 0.02 -0.95 -0.02 -0.62 0.98 0.00 0.00 173.24 172.65 3ind s ASP 168 N -2.78 1.40 -1.17 7.02 2.15 0.04 -4.84 116.67 118.49 3ind s ASP 168 Ca 0.03 -0.11 -0.06 0.00 0.43 0.00 0.00 52.55 52.84 3ind s ASP 168 Cb -0.00 -0.46 0.04 0.00 -0.30 0.00 0.00 42.92 42.20 3ind s ASP 168 CO -0.11 -0.15 0.33 0.29 -0.17 0.00 0.00 175.17 175.36 3ind n LYS 169 N 4.79 -3.09 -0.07 4.34 5.02 -1.26 -1.92 118.16 125.97 3ind n LYS 169 Ca -0.13 0.51 -0.06 0.00 -2.02 0.00 0.00 58.31 56.60 3ind n LYS 169 Cb 0.50 -5.18 -0.02 0.00 -0.02 0.00 0.00 35.03 30.31 3ind n LYS 169 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3ind n PHE 170 N -3.74 0.15 -2.07 2.13 7.35 -1.26 -4.70 117.46 115.33 3ind n PHE 170 Ca -0.06 0.07 -0.35 0.00 -0.76 0.00 0.00 57.45 56.35 3ind n PHE 170 Cb 0.56 -0.45 0.02 0.00 0.35 0.00 0.00 39.48 39.97 3ind n PHE 170 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3ind s PHE 171 N -2.39 2.56 -0.13 -5.13 0.40 -1.26 -5.03 117.98 107.00 3ind s PHE 171 Ca -0.21 1.54 0.01 0.00 -0.60 0.00 0.00 56.93 57.67 3ind s PHE 171 Cb 0.03 -3.32 -0.01 0.00 0.51 0.00 0.00 43.02 40.22 3ind s PHE 171 CO 0.30 -1.80 -0.15 0.42 0.70 0.00 0.00 175.22 174.69 3ind s ILE 172 N -1.84 2.87 0.04 0.64 1.01 -1.26 -5.03 121.20 117.62 3ind s ILE 172 Ca 0.73 -0.72 -0.30 0.00 0.00 0.00 0.00 60.65 60.35 3ind s ILE 172 Cb -0.25 -2.19 -0.09 0.00 0.01 0.00 0.00 42.46 39.94 3ind s ILE 172 CO 0.32 0.53 1.96 0.21 0.00 0.00 0.00 174.94 177.95 3ind s ASN 173 N 0.37 6.45 0.00 3.58 2.47 -1.26 -2.20 114.94 124.35 3ind s ASN 173 Ca -0.12 2.66 0.00 0.00 0.42 0.00 0.00 52.86 55.82 3ind s ASN 173 Cb -0.16 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.11 3ind s ASN 173 CO 0.06 -1.05 0.00 0.61 -3.72 0.00 0.00 177.10 173.00 3ind n GLY 174 N 4.52 0.59 0.18 1.21 0.00 -1.26 -4.91 105.19 105.52 3ind n GLY 174 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 3ind n GLY 174 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ind h SER 175 N 0.00 0.00 -0.20 1.61 4.64 -1.79 -3.47 113.55 114.34 3ind h SER 175 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 3ind h SER 175 Cb 0.04 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 3ind h SER 175 CO 0.00 0.42 -0.08 -3.20 -0.87 0.00 0.00 176.83 173.10 3ind n ASN 176 N -3.94 -3.94 -4.50 4.97 5.15 -1.26 -4.50 115.26 107.24 3ind n ASN 176 Ca -0.02 0.10 -0.29 0.00 -0.60 0.00 0.00 54.58 53.78 3ind n ASN 176 Cb 0.46 -1.80 -0.11 0.00 -0.53 0.00 0.00 39.78 37.80 3ind n ASN 176 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 3ind s TRP 177 N -2.00 2.54 -0.34 1.20 1.48 -1.26 -4.63 118.94 115.93 3ind s TRP 177 Ca 0.00 -0.26 0.03 0.00 -1.06 0.00 0.00 56.10 54.81 3ind s TRP 177 Cb 0.00 -1.32 0.02 0.00 -1.16 0.00 0.00 33.47 31.02 3ind s TRP 177 CO 0.00 0.43 0.61 0.39 -4.06 0.00 0.00 176.95 174.31 3ind n GLU 178 N 0.58 -0.46 -3.87 3.25 4.71 0.19 -4.86 120.64 120.19 3ind n GLU 178 Ca -0.14 -0.71 -0.04 0.00 -0.01 0.00 0.00 57.16 56.26 3ind n GLU 178 Cb 0.54 -1.05 0.02 0.00 -1.01 0.00 0.00 31.44 29.93 3ind n GLU 178 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 3ind s GLY 179 N -0.26 0.14 0.08 0.62 0.00 -1.16 -0.65 107.32 106.08 3ind s GLY 179 Ca 0.03 -0.38 0.05 0.00 0.00 0.00 0.00 44.72 44.42 3ind s GLY 179 CO 0.03 1.89 -0.15 -0.26 0.00 0.00 0.00 173.10 174.61 3ind s ILE 180 N -2.25 1.18 -0.47 0.90 -4.36 0.19 -0.61 121.20 115.79 3ind s ILE 180 Ca 0.20 -1.35 -0.01 0.00 -0.26 0.00 0.00 60.65 59.23 3ind s ILE 180 Cb -0.03 -1.14 0.13 0.00 1.25 0.00 0.00 42.46 42.66 3ind s ILE 180 CO 0.06 -0.22 0.26 -0.22 0.24 0.00 0.00 174.94 175.06 3ind s LEU 181 N -1.79 5.11 -0.28 0.37 2.96 0.13 -1.44 118.68 123.74 3ind s LEU 181 Ca -0.01 -2.36 -0.29 0.00 -0.22 0.00 0.00 54.13 51.25 3ind s LEU 181 Cb -0.10 -1.80 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 3ind s LEU 181 CO 0.02 -0.45 1.61 -0.83 -1.32 0.00 0.00 176.35 175.38 3ind s GLY 182 N 1.22 1.12 0.00 7.98 0.00 -0.43 -1.68 107.32 115.52 3ind s GLY 182 Ca 0.12 0.31 0.23 0.00 0.00 0.00 0.00 44.72 45.38 3ind s GLY 182 CO -0.04 3.00 1.18 1.04 0.00 0.00 0.00 173.10 178.28 3ind n LEU 183 N 8.86 2.57 0.00 0.66 4.77 0.10 -4.22 117.00 129.74 3ind n LEU 183 Ca 0.19 -0.90 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 3ind n LEU 183 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3ind n LEU 183 CO 0.66 0.45 0.00 0.00 -1.33 0.00 0.00 177.39 177.17 3ind n ALA 184 N 0.75 0.00 -2.49 -1.18 0.00 0.99 -4.93 120.51 113.65 3ind n ALA 184 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.32 3ind n ALA 184 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.99 3ind n ALA 184 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3ind s TYR 185 N -0.77 3.39 0.54 0.00 1.51 -0.43 -4.67 117.35 116.92 3ind s TYR 185 Ca 0.00 0.34 0.25 0.00 -1.01 0.00 0.00 57.07 56.65 3ind s TYR 185 Cb 0.00 -2.10 1.44 0.00 -0.11 0.00 0.00 41.96 41.19 3ind s TYR 185 CO 0.00 -0.11 2.02 0.00 -1.11 0.00 0.00 175.55 176.36 3ind h ALA 186 N 0.57 2.30 -0.83 3.71 0.00 -1.86 -2.72 119.26 120.42 3ind h ALA 186 Ca -0.48 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 54.55 3ind h ALA 186 Cb 1.23 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.99 3ind h ALA 186 CO 0.60 -0.53 0.54 1.49 0.00 0.00 0.00 179.25 181.35 3ind h GLU 187 N 0.00 0.58 -0.56 0.00 4.81 -1.86 -0.82 114.58 116.73 3ind h GLU 187 Ca 0.19 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3ind h GLU 187 Cb 0.83 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.08 3ind h GLU 187 CO -0.00 0.39 0.00 0.44 -0.73 0.00 0.00 179.01 179.10 3ind n ILE 188 N -4.53 1.46 -2.10 2.32 -5.35 -1.03 -4.61 119.36 105.52 3ind n ILE 188 Ca 0.16 -1.17 -0.34 0.00 -0.27 0.00 0.00 62.75 61.14 3ind n ILE 188 Cb 0.47 0.28 0.01 0.00 -1.74 0.00 0.00 39.64 38.66 3ind n ILE 188 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ind s ALA 189 N -1.51 2.68 -0.02 -1.28 0.00 -0.31 -4.65 121.76 116.66 3ind s ALA 189 Ca 0.43 0.58 0.02 0.00 0.00 0.00 0.00 51.96 52.98 3ind s ALA 189 Cb 0.26 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 20.06 3ind s ALA 189 CO 0.23 -0.84 -0.04 1.03 0.00 0.00 0.00 175.76 176.14 3ind s ARG 190 N -3.74 2.70 0.42 0.00 1.81 -1.26 -2.68 118.95 116.19 3ind s ARG 190 Ca 0.67 -0.63 0.23 0.00 -1.72 0.00 0.00 55.73 54.28 3ind s ARG 190 Cb -0.19 -2.60 0.68 0.00 -0.45 0.00 0.00 34.95 32.40 3ind s ARG 190 CO 0.33 0.63 1.72 -1.35 -0.68 0.00 0.00 175.30 175.95 3ind h PRO 191 N 4.64 0.00 0.00 3.54 0.11 -1.93 -3.46 132.00 134.90 3ind h PRO 191 Ca -0.49 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 3ind h PRO 191 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3ind h PRO 191 CO 0.55 0.22 0.04 -0.40 -0.21 0.00 0.00 178.00 178.19 3ind n ASP 192 N -3.26 -0.60 0.00 -2.05 5.75 -1.09 -5.04 116.55 110.25 3ind n ASP 192 Ca 0.01 -1.52 0.15 0.00 -0.01 0.00 0.00 54.79 53.42 3ind n ASP 192 Cb 0.50 1.03 0.86 0.00 -1.03 0.00 0.00 41.12 42.48 3ind n ASP 192 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3ind n ASP 193 N -1.46 0.00 0.20 -1.12 5.75 -1.25 -2.88 116.55 115.79 3ind n ASP 193 Ca -0.02 -0.82 0.11 0.00 -0.01 0.00 0.00 54.79 54.06 3ind n ASP 193 Cb 0.18 -0.04 0.14 0.00 -1.03 0.00 0.00 41.12 40.37 3ind n ASP 193 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3ind h SER 194 N 0.00 0.00 -1.92 -1.12 4.64 -1.92 -3.42 113.55 109.81 3ind h SER 194 Ca 0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 3ind h SER 194 Cb 0.04 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.04 3ind h SER 194 CO 0.00 0.06 1.20 -0.22 -0.87 0.00 0.00 176.83 177.00 3ind s LEU 195 N -6.18 3.33 -0.05 5.97 2.96 -1.14 -4.96 118.68 118.61 3ind s LEU 195 Ca 0.06 -0.84 -0.35 0.00 -0.22 0.00 0.00 54.13 52.78 3ind s LEU 195 Cb 0.06 -2.56 -0.13 0.00 0.50 0.00 0.00 46.19 44.05 3ind s LEU 195 CO 0.69 -1.70 1.74 1.21 -1.32 0.00 0.00 176.35 176.97 3ind n GLU 196 N 9.13 1.90 -1.08 1.98 2.13 -1.26 -4.89 120.64 128.54 3ind n GLU 196 Ca 0.14 0.69 -0.31 0.00 0.66 0.00 0.00 57.16 58.34 3ind n GLU 196 Cb 0.50 -2.47 0.12 0.00 0.27 0.00 0.00 31.44 29.85 3ind n GLU 196 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3ind s PRO 197 N 2.95 1.77 0.14 5.31 0.02 -1.26 -4.52 135.00 139.40 3ind s PRO 197 Ca 0.90 1.40 -0.24 0.00 0.02 0.00 0.00 61.00 63.08 3ind s PRO 197 Cb -0.78 -1.82 -0.02 0.00 0.02 0.00 0.00 34.50 31.90 3ind s PRO 197 CO 0.51 -2.04 1.63 0.35 -0.33 0.00 0.00 177.00 177.11 3ind h PHE 198 N -1.27 -0.70 -0.40 6.54 3.04 -1.79 -1.92 116.94 120.44 3ind h PHE 198 Ca -0.44 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.51 3ind h PHE 198 Cb 1.25 0.33 -0.02 0.00 2.56 0.00 0.00 35.95 40.07 3ind h PHE 198 CO 0.53 -0.34 0.11 0.35 -2.02 0.00 0.00 178.31 176.94 3ind h PHE 199 N -0.34 0.59 -0.50 0.41 3.57 -1.92 0.17 116.94 118.93 3ind h PHE 199 Ca 0.10 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3ind h PHE 199 Cb 0.48 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 3ind h PHE 199 CO -0.35 0.50 0.31 -0.44 -2.23 0.00 0.00 178.31 176.10 3ind h ASP 200 N 0.58 0.60 -0.61 0.41 3.32 -1.82 -0.78 116.42 118.11 3ind h ASP 200 Ca 0.14 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 3ind h ASP 200 Cb 0.20 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 3ind h ASP 200 CO -0.01 0.47 0.25 0.28 -1.72 0.00 0.00 179.24 178.52 3ind h SER 201 N 0.67 0.84 0.07 6.45 0.02 -0.39 -0.85 113.55 120.37 3ind h SER 201 Ca 0.18 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3ind h SER 201 Cb -0.02 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.30 3ind h SER 201 CO -0.03 0.78 -0.06 0.25 -1.14 0.00 0.00 176.83 176.63 3ind h LEU 202 N 0.86 -0.14 -0.47 5.07 5.85 -0.50 0.38 115.31 126.35 3ind h LEU 202 Ca 0.21 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 3ind h LEU 202 Cb 0.20 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3ind h LEU 202 CO -0.02 -0.09 0.23 0.58 -0.34 0.00 0.00 178.44 178.80 3ind h VAL 203 N -0.13 1.19 -0.57 1.05 2.07 -1.01 -1.03 116.25 117.81 3ind h VAL 203 Ca -0.00 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 3ind h VAL 203 Cb 0.12 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3ind h VAL 203 CO -0.01 0.20 0.04 0.11 0.02 0.00 0.00 177.57 177.94 3ind h LYS 204 N 0.62 0.98 0.00 1.57 1.57 -1.00 -3.23 116.57 117.09 3ind h LYS 204 Ca 0.16 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3ind h LYS 204 Cb 0.11 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3ind h LYS 204 CO -0.02 0.96 -0.49 1.96 -0.57 0.00 0.00 179.45 181.29 3ind h GLN 205 N 0.88 0.00 0.00 3.15 4.20 -0.82 -3.47 115.11 119.04 3ind h GLN 205 Ca 0.17 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.35 3ind h GLN 205 Cb 0.49 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.16 3ind h GLN 205 CO 0.02 0.00 -0.42 0.25 -0.67 0.00 0.00 178.83 178.01 3ind n THR 206 N -2.47 0.00 -0.64 -0.54 -2.24 -0.40 -5.03 114.28 102.96 3ind n THR 206 Ca 0.03 -2.11 0.06 0.00 -2.27 0.00 0.00 64.05 59.76 3ind n THR 206 Cb 0.48 0.64 0.35 0.00 -2.10 0.00 0.00 70.33 69.70 3ind n THR 206 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3ind n HIS 207 N -0.92 1.80 -2.22 4.78 8.25 -1.26 -4.75 115.22 120.90 3ind n HIS 207 Ca -0.10 -0.63 -0.42 0.00 -0.26 0.00 0.00 57.72 56.31 3ind n HIS 207 Cb 0.55 -0.46 -0.03 0.00 1.12 0.00 0.00 29.99 31.18 3ind n HIS 207 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3ind s VAL 208 N -2.51 3.88 0.38 1.59 1.01 -1.26 -4.97 120.40 118.52 3ind s VAL 208 Ca 0.47 1.13 -0.26 0.00 0.00 0.00 0.00 61.98 63.32 3ind s VAL 208 Cb 0.36 -3.73 -0.11 0.00 0.00 0.00 0.00 36.38 32.90 3ind s VAL 208 CO 0.14 -0.07 1.11 -2.65 0.00 0.00 0.00 175.10 173.63 3ind n PRO 209 N 6.39 1.61 -1.71 2.72 -0.02 -1.26 -4.59 135.00 138.13 3ind n PRO 209 Ca 0.15 0.57 -0.39 0.00 -2.02 0.00 0.00 63.50 61.81 3ind n PRO 209 Cb 0.44 -2.13 -0.04 0.00 -0.02 0.00 0.00 33.50 31.75 3ind n PRO 209 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3ind n ASN 210 N 0.62 3.27 -3.63 2.55 5.15 -1.26 -4.24 115.26 117.71 3ind n ASN 210 Ca 0.08 -2.75 -0.07 0.00 -0.60 0.00 0.00 54.58 51.24 3ind n ASN 210 Cb 0.37 -1.47 -0.07 0.00 -0.53 0.00 0.00 39.78 38.09 3ind n ASN 210 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3ind s LEU 211 N 4.48 -0.28 0.07 1.20 0.20 -1.26 -1.53 118.68 121.55 3ind s LEU 211 Ca 0.58 0.50 -0.06 0.00 0.69 0.00 0.00 54.13 55.84 3ind s LEU 211 Cb 0.09 1.57 -0.02 0.00 -0.43 0.00 0.00 46.19 47.40 3ind s LEU 211 CO 0.08 -0.13 0.10 0.72 -0.29 0.00 0.00 176.35 176.84 3ind s PHE 212 N -0.12 0.28 0.01 5.38 -0.12 -1.13 0.34 117.98 122.63 3ind s PHE 212 Ca 0.04 -0.74 0.01 0.00 -0.05 0.00 0.00 56.93 56.19 3ind s PHE 212 Cb -0.04 -0.18 -0.01 0.00 -0.63 0.00 0.00 43.02 42.16 3ind s PHE 212 CO -0.08 -0.47 -0.04 -1.54 -0.05 0.00 0.00 175.22 173.03 3ind s SER 213 N -2.81 0.48 -0.15 1.98 1.04 0.50 0.07 113.70 114.82 3ind s SER 213 Ca 0.05 -0.27 0.02 0.00 0.48 0.00 0.00 55.95 56.22 3ind s SER 213 Cb 0.05 0.00 0.01 0.00 0.10 0.00 0.00 66.02 66.19 3ind s SER 213 CO -0.10 -0.09 -0.20 -0.76 0.98 0.00 0.00 173.24 173.07 3ind s LEU 214 N -0.74 2.02 -0.44 2.42 1.43 -0.03 -0.55 118.68 122.79 3ind s LEU 214 Ca -0.05 -0.58 -0.06 0.00 -1.03 0.00 0.00 54.13 52.41 3ind s LEU 214 Cb -0.05 -1.38 0.12 0.00 0.03 0.00 0.00 46.19 44.90 3ind s LEU 214 CO -0.00 0.04 0.27 -1.58 0.23 0.00 0.00 176.35 175.31 3ind s GLN 215 N 1.04 2.23 -0.24 1.70 0.74 0.32 -2.02 119.66 123.43 3ind s GLN 215 Ca -0.02 -1.80 -0.16 0.00 0.05 0.00 0.00 55.36 53.43 3ind s GLN 215 Cb -0.14 -3.75 -0.04 0.00 1.10 0.00 0.00 33.01 30.18 3ind s GLN 215 CO -0.06 -1.13 0.41 -0.51 -0.55 0.00 0.00 175.29 173.45 3ind s LEU 216 N 1.24 4.09 -0.12 3.68 1.43 -1.26 -0.41 118.68 127.33 3ind s LEU 216 Ca 0.07 0.44 0.19 0.00 -1.03 0.00 0.00 54.13 53.80 3ind s LEU 216 Cb -0.24 -2.52 -0.28 0.00 0.03 0.00 0.00 46.19 43.18 3ind s LEU 216 CO -0.03 -0.16 0.24 0.00 0.23 0.00 0.00 176.35 176.64 3ind n GLY 218 N 1.58 0.48 0.00 0.00 0.00 -1.21 -4.75 105.19 101.29 3ind n GLY 218 Ca -0.19 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3ind n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ind n ALA 219 N 7.04 0.31 0.00 4.61 0.00 -1.26 -2.60 120.51 128.60 3ind n ALA 219 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3ind n ALA 219 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3ind n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ind n GLY 220 N 3.24 -1.73 3.53 0.00 0.00 -1.26 -4.97 105.19 104.00 3ind n GLY 220 Ca 0.00 -1.32 -0.25 0.00 0.00 0.00 0.00 46.02 44.46 3ind n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ind s PHE 221 N -2.43 2.25 0.00 1.61 2.99 -1.26 -5.14 117.98 116.00 3ind s PHE 221 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 56.93 56.21 3ind s PHE 221 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 43.02 41.56 3ind s PHE 221 CO 0.00 0.33 0.00 0.28 -0.00 0.00 0.00 175.22 175.83 3ind n VAL 228 N -0.79 0.00 -1.64 -0.44 0.31 -1.26 -5.15 118.33 109.36 3ind n VAL 228 Ca -0.04 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.83 3ind n VAL 228 Cb 0.66 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.56 3ind n VAL 228 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 3ind n LEU 229 N 0.24 2.62 -4.76 7.52 7.94 -1.26 -4.88 117.00 124.40 3ind n LEU 229 Ca 0.00 1.16 -0.39 0.00 -1.11 0.00 0.00 56.01 55.66 3ind n LEU 229 Cb 0.00 -1.37 0.01 0.00 0.53 0.00 0.00 43.42 42.59 3ind n LEU 229 CO 0.00 -0.81 1.02 0.00 -1.11 0.00 0.00 177.39 176.49 3ind s ALA 230 N -0.41 3.19 0.02 1.96 0.00 -1.26 -4.74 121.76 120.53 3ind s ALA 230 Ca 0.66 1.36 -0.21 0.00 0.00 0.00 0.00 51.96 53.77 3ind s ALA 230 Cb -0.69 -3.55 -0.06 0.00 0.00 0.00 0.00 23.12 18.83 3ind s ALA 230 CO 0.54 -1.08 0.63 -1.12 0.00 0.00 0.00 175.76 174.73 3ind s SER 231 N -0.65 7.05 0.18 0.00 0.01 -1.26 -0.44 113.70 118.58 3ind s SER 231 Ca 0.61 1.25 0.09 0.00 1.31 0.00 0.00 55.95 59.21 3ind s SER 231 Cb -0.41 -2.39 -0.04 0.00 0.21 0.00 0.00 66.02 63.39 3ind s SER 231 CO 0.52 0.12 -0.12 0.68 0.41 0.00 0.00 173.24 174.85 3ind s VAL 232 N -0.35 3.08 0.30 3.43 -7.23 0.51 -4.37 120.40 115.76 3ind s VAL 232 Ca 0.32 -1.69 0.04 0.00 -1.81 0.00 0.00 61.98 58.84 3ind s VAL 232 Cb -0.19 -2.51 -0.06 0.00 0.56 0.00 0.00 36.38 34.18 3ind s VAL 232 CO 0.19 -0.10 0.05 -0.83 -0.31 0.00 0.00 175.10 174.10 3ind s GLY 233 N -2.76 1.96 0.00 2.32 0.00 -1.07 -2.32 107.32 105.44 3ind s GLY 233 Ca 0.24 -2.00 0.00 0.00 0.00 0.00 0.00 44.72 42.96 3ind s GLY 233 CO 0.14 -1.77 0.00 0.61 0.00 0.00 0.00 173.10 172.08 3ind n GLY 234 N -0.62 -1.24 2.83 0.20 0.00 -0.96 -1.62 105.19 103.78 3ind n GLY 234 Ca -0.02 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.90 3ind n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ind s SER 235 N -1.56 0.10 -0.38 1.61 0.01 0.45 -1.48 113.70 112.45 3ind s SER 235 Ca 0.00 0.01 -0.05 0.00 1.31 0.00 0.00 55.95 57.22 3ind s SER 235 Cb 0.00 -0.06 0.08 0.00 0.21 0.00 0.00 66.02 66.26 3ind s SER 235 CO 0.00 -0.06 0.17 -0.32 0.41 0.00 0.00 173.24 173.44 3ind s MET 236 N 0.54 2.35 -0.41 12.44 0.00 -1.26 -0.52 119.30 132.44 3ind s MET 236 Ca -0.05 -1.53 -0.23 0.00 0.00 0.00 0.00 55.69 53.89 3ind s MET 236 Cb -0.07 -3.56 0.02 0.00 0.00 0.00 0.00 34.83 31.22 3ind s MET 236 CO -0.01 -0.90 0.78 0.42 0.00 0.00 0.00 175.02 175.30 3ind s ILE 237 N 1.28 4.69 -0.25 10.11 -1.09 0.29 -4.90 121.20 131.33 3ind s ILE 237 Ca 0.03 0.63 -0.12 0.00 -2.23 0.00 0.00 60.65 58.96 3ind s ILE 237 Cb -0.22 -4.26 -0.05 0.00 -1.58 0.00 0.00 42.46 36.35 3ind s ILE 237 CO -0.01 -0.58 0.23 -0.63 -1.23 0.00 0.00 174.94 172.72 3ind s ILE 238 N 3.19 5.30 0.00 2.92 1.01 -1.26 -0.37 121.20 131.99 3ind s ILE 238 Ca 0.30 0.30 0.00 0.00 0.00 0.00 0.00 60.65 61.25 3ind s ILE 238 Cb -0.13 -3.57 0.00 0.00 0.01 0.00 0.00 42.46 38.78 3ind s ILE 238 CO 0.20 0.28 0.00 0.61 0.00 0.00 0.00 174.94 176.03 3ind n GLY 239 N 4.55 0.79 0.00 6.18 0.00 0.15 -4.80 105.19 112.06 3ind n GLY 239 Ca -0.13 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3ind n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ind n GLY 240 N -2.37 -1.44 3.29 -0.02 0.00 -1.23 -4.38 105.19 99.03 3ind n GLY 240 Ca 0.00 -1.04 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 3ind n GLY 240 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ind s ILE 241 N -2.82 2.60 -0.45 -0.61 1.01 -1.26 -4.23 121.20 115.44 3ind s ILE 241 Ca 0.00 -0.81 -0.16 0.00 0.00 0.00 0.00 60.65 59.68 3ind s ILE 241 Cb 0.00 -2.07 0.05 0.00 0.01 0.00 0.00 42.46 40.46 3ind s ILE 241 CO 0.00 0.53 0.38 -0.62 0.00 0.00 0.00 174.94 175.23 3ind s ASP 242 N 0.49 6.14 0.30 3.58 3.68 -1.26 -4.95 116.67 124.66 3ind s ASP 242 Ca -0.12 -1.12 0.24 0.00 2.13 0.00 0.00 52.55 53.68 3ind s ASP 242 Cb -0.16 -2.18 1.08 0.00 -1.45 0.00 0.00 42.92 40.20 3ind s ASP 242 CO 0.05 -0.59 1.74 0.45 0.13 0.00 0.00 175.17 176.94 3ind h HIS 243 N 8.73 0.00 0.00 -5.34 3.86 -1.98 -0.46 115.15 119.95 3ind h HIS 243 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 3ind h HIS 243 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 3ind h HIS 243 CO 0.61 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.27 3ind n SER 244 N -2.33 0.00 -0.10 2.45 3.41 -1.26 -3.49 113.62 112.30 3ind n SER 244 Ca 0.01 0.43 0.13 0.00 -0.26 0.00 0.00 58.87 59.18 3ind n SER 244 Cb 0.20 -0.48 0.39 0.00 -0.26 0.00 0.00 64.21 64.06 3ind n SER 244 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ind n LEU 245 N -1.48 0.61 -3.82 1.04 4.77 -0.18 -4.77 117.00 113.17 3ind n LEU 245 Ca 0.07 -0.03 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 3ind n LEU 245 Cb 0.31 -0.22 -0.08 0.00 -2.33 0.00 0.00 43.42 41.10 3ind n LEU 245 CO 0.25 0.13 -0.06 -0.72 -1.33 0.00 0.00 177.39 175.66 3ind s TYR 246 N -2.75 0.01 0.21 -1.77 1.13 -1.23 -1.37 117.35 111.59 3ind s TYR 246 Ca 0.19 -0.22 0.10 0.00 -1.41 0.00 0.00 57.07 55.72 3ind s TYR 246 Cb 0.19 0.01 -0.04 0.00 -1.10 0.00 0.00 41.96 41.01 3ind s TYR 246 CO 0.58 -0.47 -0.10 0.95 -2.51 0.00 0.00 175.55 174.01 3ind s THR 247 N -2.69 3.08 0.00 -3.49 -4.23 -0.41 -4.86 115.64 103.04 3ind s THR 247 Ca -0.04 -1.82 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 3ind s THR 247 Cb -0.00 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.28 3ind s THR 247 CO -0.04 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.46 3ind n GLY 248 N -0.18 -0.99 3.85 3.99 0.00 -1.26 -3.60 105.19 106.99 3ind n GLY 248 Ca -0.10 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.38 3ind n GLY 248 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ind s SER 249 N -4.00 6.00 -0.08 1.61 0.01 -1.26 -4.99 113.70 111.00 3ind s SER 249 Ca 0.00 0.20 -0.25 0.00 1.31 0.00 0.00 55.95 57.21 3ind s SER 249 Cb 0.00 -1.78 -0.03 0.00 0.21 0.00 0.00 66.02 64.42 3ind s SER 249 CO 0.00 0.22 0.77 -0.76 0.41 0.00 0.00 173.24 173.88 3ind s LEU 250 N -2.14 4.30 -0.11 2.44 1.43 -1.26 -4.51 118.68 118.83 3ind s LEU 250 Ca 0.29 1.26 -0.00 0.00 -1.03 0.00 0.00 54.13 54.64 3ind s LEU 250 Cb -0.12 -3.19 -0.02 0.00 0.03 0.00 0.00 46.19 42.88 3ind s LEU 250 CO 0.21 -0.19 -0.08 0.26 0.23 0.00 0.00 176.35 176.77 3ind s TRP 251 N 1.10 2.90 -0.12 0.29 0.52 0.10 -4.88 118.94 118.86 3ind s TRP 251 Ca 0.40 -0.26 -0.02 0.00 0.02 0.00 0.00 56.10 56.24 3ind s TRP 251 Cb -0.18 -1.81 -0.03 0.00 -1.15 0.00 0.00 33.47 30.31 3ind s TRP 251 CO 0.19 0.07 -0.05 0.71 0.02 0.00 0.00 176.95 177.89 3ind s TYR 252 N -0.17 3.00 -0.08 -1.98 1.51 -1.26 0.01 117.35 118.39 3ind s TYR 252 Ca 0.02 -0.14 0.03 0.00 -1.01 0.00 0.00 57.07 55.96 3ind s TYR 252 Cb -0.13 -1.85 -0.02 0.00 -0.11 0.00 0.00 41.96 39.85 3ind s TYR 252 CO 0.03 0.15 -0.15 -0.08 -1.11 0.00 0.00 175.55 174.38 3ind s THR 253 N -0.20 2.92 0.30 -0.71 -1.32 -0.02 -3.45 115.64 113.15 3ind s THR 253 Ca 0.03 -0.75 -0.29 0.00 -1.21 0.00 0.00 61.69 59.47 3ind s THR 253 Cb -0.13 -2.16 -0.10 0.00 -1.51 0.00 0.00 72.50 68.60 3ind s THR 253 CO 0.02 0.57 1.31 -2.16 -2.21 0.00 0.00 174.62 172.15 3ind s PRO 254 N -0.31 4.37 -0.24 7.08 0.04 -1.26 -0.42 135.00 144.26 3ind s PRO 254 Ca 0.02 2.18 -0.29 0.00 0.04 0.00 0.00 61.00 62.95 3ind s PRO 254 Cb -0.13 -3.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.30 3ind s PRO 254 CO 0.03 -0.20 1.51 0.42 0.04 0.00 0.00 177.00 178.80 3ind s ILE 255 N -0.84 3.85 0.14 0.56 1.01 -0.55 -4.51 121.20 120.85 3ind s ILE 255 Ca 0.51 0.96 -0.15 0.00 0.00 0.00 0.00 60.65 61.97 3ind s ILE 255 Cb -0.39 -3.85 0.02 0.00 0.01 0.00 0.00 42.46 38.24 3ind s ILE 255 CO 0.49 -0.34 1.70 -0.09 0.00 0.00 0.00 174.94 176.70 3ind h ARG 256 N 10.18 0.66 -2.88 2.79 2.43 -0.80 -3.45 114.38 123.32 3ind h ARG 256 Ca -0.31 -0.12 -0.11 0.00 -0.81 0.00 0.00 59.98 58.63 3ind h ARG 256 Cb 1.13 -0.11 -0.21 0.00 -0.42 0.00 0.00 29.97 30.37 3ind h ARG 256 CO 1.01 0.60 -0.22 0.50 -1.51 0.00 0.00 179.97 180.35 3ind s ARG 257 N -5.58 0.68 -1.18 0.20 3.52 -1.26 -5.07 118.95 110.26 3ind s ARG 257 Ca -0.13 -0.02 -0.16 0.00 -0.13 0.00 0.00 55.73 55.29 3ind s ARG 257 Cb 0.11 0.31 0.14 0.00 -1.56 0.00 0.00 34.95 33.95 3ind s ARG 257 CO 0.76 -0.18 1.45 -1.21 -0.81 0.00 0.00 175.30 175.31 3ind s GLU 258 N -1.05 3.99 0.00 5.12 2.02 -1.26 -4.02 118.70 123.50 3ind s GLU 258 Ca -0.11 -2.32 0.00 0.00 0.02 0.00 0.00 54.97 52.56 3ind s GLU 258 Cb -0.04 -5.14 0.00 0.00 0.10 0.00 0.00 34.13 29.04 3ind s GLU 258 CO 0.04 -1.87 0.00 -2.67 0.02 0.00 0.00 175.26 170.78 3ind n TRP 259 N 6.39 0.00 -1.39 1.61 4.27 -1.26 -4.51 117.44 122.54 3ind n TRP 259 Ca 0.37 0.00 -0.30 0.00 -3.89 0.00 0.00 57.50 53.68 3ind n TRP 259 Cb 0.44 0.00 0.21 0.00 -1.36 0.00 0.00 31.31 30.60 3ind n TRP 259 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3ind s TYR 260 N 0.00 1.11 -1.14 -2.67 2.02 -1.26 -1.32 117.35 114.09 3ind s TYR 260 Ca 0.00 0.50 -0.17 0.00 -0.37 0.00 0.00 57.07 57.03 3ind s TYR 260 Cb 0.00 -3.64 0.13 0.00 -0.40 0.00 0.00 41.96 38.05 3ind s TYR 260 CO 0.00 -3.30 1.42 0.71 -1.57 0.00 0.00 175.55 172.81 3ind s TYR 261 N -3.30 3.17 0.02 2.71 1.51 -1.26 -4.82 117.35 115.37 3ind s TYR 261 Ca 0.71 -1.72 -0.23 0.00 -1.01 0.00 0.00 57.07 54.81 3ind s TYR 261 Cb -0.09 -4.43 -0.05 0.00 -0.11 0.00 0.00 41.96 37.27 3ind s TYR 261 CO 0.55 -1.56 0.70 -2.00 -1.11 0.00 0.00 175.55 172.13 3ind s GLU 262 N 2.72 4.43 0.33 -0.62 2.12 -1.26 -1.87 118.70 124.55 3ind s GLU 262 Ca 0.43 0.92 0.03 0.00 0.36 0.00 0.00 54.97 56.72 3ind s GLU 262 Cb -0.02 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.97 3ind s GLU 262 CO -0.02 0.29 0.12 0.14 -0.54 0.00 0.00 175.26 175.26 3ind s VAL 263 N -0.01 0.60 -0.16 3.70 -7.23 0.28 -0.06 120.40 117.52 3ind s VAL 263 Ca 0.36 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.54 3ind s VAL 263 Cb -0.19 -2.54 0.01 0.00 0.56 0.00 0.00 36.38 34.21 3ind s VAL 263 CO 0.20 0.00 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.17 3ind s ILE 264 N -3.46 2.27 -0.19 -0.62 -1.09 -1.26 -3.93 121.20 112.93 3ind s ILE 264 Ca 0.33 -0.90 -0.15 0.00 -2.23 0.00 0.00 60.65 57.70 3ind s ILE 264 Cb 0.05 -1.94 -0.04 0.00 -1.58 0.00 0.00 42.46 38.95 3ind s ILE 264 CO 0.16 0.53 0.34 -0.63 -1.23 0.00 0.00 174.94 174.11 3ind s ILE 265 N 0.94 5.25 -0.19 2.92 1.01 -1.26 -0.88 121.20 129.00 3ind s ILE 265 Ca -0.04 0.62 0.14 0.00 0.00 0.00 0.00 60.65 61.37 3ind s ILE 265 Cb -0.15 -3.68 -0.21 0.00 0.01 0.00 0.00 42.46 38.44 3ind s ILE 265 CO -0.04 0.31 0.39 1.33 0.00 0.00 0.00 174.94 176.93 3ind n VAL 266 N 4.04 0.00 -3.55 2.92 0.24 0.41 -4.65 118.33 117.74 3ind n VAL 266 Ca -0.10 -0.29 -0.16 0.00 -2.04 0.00 0.00 64.34 61.75 3ind n VAL 266 Cb 0.51 0.38 -0.06 0.00 -1.47 0.00 0.00 33.84 33.21 3ind n VAL 266 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3ind s ARG 267 N -2.83 0.95 -0.02 7.34 3.52 -1.19 -4.70 118.95 122.02 3ind s ARG 267 Ca -0.03 0.39 0.02 0.00 -0.13 0.00 0.00 55.73 55.99 3ind s ARG 267 Cb 0.10 0.45 -0.00 0.00 -1.56 0.00 0.00 34.95 33.94 3ind s ARG 267 CO 0.60 -0.26 -0.09 0.08 -0.81 0.00 0.00 175.30 174.82 3ind s VAL 268 N -0.85 0.71 -0.02 7.11 1.01 -1.26 0.00 120.40 127.11 3ind s VAL 268 Ca -0.07 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.59 3ind s VAL 268 Cb -0.01 -0.62 -0.00 0.00 0.00 0.00 0.00 36.38 35.75 3ind s VAL 268 CO 0.07 0.22 -0.11 -1.61 0.00 0.00 0.00 175.10 173.67 3ind s GLU 269 N 0.02 0.98 -0.20 2.72 2.02 -0.37 -1.38 118.70 122.50 3ind s GLU 269 Ca -0.00 -0.37 -0.03 0.00 0.02 0.00 0.00 54.97 54.58 3ind s GLU 269 Cb -0.06 -0.92 -0.01 0.00 0.10 0.00 0.00 34.13 33.24 3ind s GLU 269 CO 0.00 0.19 -0.06 0.42 0.02 0.00 0.00 175.26 175.83 3ind s ILE 270 N -0.06 3.34 -1.45 -1.63 -1.09 -0.63 -0.67 121.20 119.01 3ind s ILE 270 Ca 0.01 -0.51 -0.02 0.00 -2.23 0.00 0.00 60.65 57.90 3ind s ILE 270 Cb -0.06 -2.50 0.00 0.00 -1.58 0.00 0.00 42.46 38.32 3ind s ILE 270 CO 0.00 0.44 0.27 0.59 -1.23 0.00 0.00 174.94 175.01 3ind n ASN 271 N 4.55 -0.06 0.00 3.58 4.13 0.08 -0.90 115.26 126.64 3ind n ASN 271 Ca -0.18 -1.12 0.00 0.00 1.68 0.00 0.00 54.58 54.95 3ind n ASN 271 Cb 0.51 -2.44 0.00 0.00 -1.54 0.00 0.00 39.78 36.31 3ind n ASN 271 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ind n GLY 272 N -2.22 2.53 3.60 7.41 0.00 -1.26 -4.96 105.19 110.29 3ind n GLY 272 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 3ind n GLY 272 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ind s GLN 273 N 0.00 3.79 0.26 1.61 2.00 -0.07 -4.98 119.66 122.26 3ind s GLN 273 Ca 0.00 0.56 -0.31 0.00 -2.00 0.00 0.00 55.36 53.61 3ind s GLN 273 Cb 0.00 -3.84 -0.12 0.00 0.80 0.00 0.00 33.01 29.85 3ind s GLN 273 CO 0.00 -1.07 1.62 -3.47 -0.50 0.00 0.00 175.29 171.87 3ind n ASP 274 N 7.04 3.77 0.22 6.67 4.64 -1.26 -1.60 116.55 136.03 3ind n ASP 274 Ca 0.08 1.12 0.15 0.00 -1.38 0.00 0.00 54.79 54.76 3ind n ASP 274 Cb 0.48 -1.57 0.62 0.00 -1.04 0.00 0.00 41.12 39.62 3ind n ASP 274 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3ind h LEU 275 N 5.39 0.00 0.36 -2.67 3.38 -1.61 -3.47 115.31 116.69 3ind h LEU 275 Ca -0.46 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.11 3ind h LEU 275 Cb 1.22 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.02 3ind h LEU 275 CO 0.84 0.00 -0.63 0.29 0.09 0.00 0.00 178.44 179.03 3ind n LYS 276 N -2.71 -5.44 -3.88 1.13 5.02 -1.26 -4.99 118.16 106.03 3ind n LYS 276 Ca 0.01 0.81 -0.30 0.00 -2.02 0.00 0.00 58.31 56.81 3ind n LYS 276 Cb 0.26 -5.70 -0.04 0.00 -0.02 0.00 0.00 35.03 29.53 3ind n LYS 276 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3ind s MET 277 N -5.96 3.47 -0.09 1.97 -1.94 -1.26 -5.03 119.30 110.45 3ind s MET 277 Ca 0.41 -0.41 -0.34 0.00 -1.71 0.00 0.00 55.69 53.64 3ind s MET 277 Cb -0.19 -2.99 -0.12 0.00 2.01 0.00 0.00 34.83 33.54 3ind s MET 277 CO 0.51 0.56 1.89 -3.47 -0.01 0.00 0.00 175.02 174.50 3ind n ASP 278 N 0.09 3.47 0.24 3.03 -0.08 -1.26 -4.81 116.55 117.22 3ind n ASP 278 Ca -0.05 0.97 0.18 0.00 -1.51 0.00 0.00 54.79 54.38 3ind n ASP 278 Cb 0.52 -1.37 0.83 0.00 2.34 0.00 0.00 41.12 43.44 3ind n ASP 278 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ind h LYS 280 N 0.00 0.00 0.00 0.00 1.57 -1.83 -0.93 116.57 115.39 3ind h LYS 280 Ca 0.07 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 3ind h LYS 280 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 3ind h LYS 280 CO -0.00 0.00 -0.35 0.93 -0.57 0.00 0.00 179.45 179.45 3ind h GLU 281 N 0.00 0.00 0.00 3.15 4.39 -0.87 -2.56 114.58 118.70 3ind h GLU 281 Ca 0.08 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 3ind h GLU 281 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 3ind h GLU 281 CO -0.00 0.35 -0.20 1.88 -1.16 0.00 0.00 179.01 179.88 3ind h TYR 282 N 0.00 0.00 -0.48 4.33 0.05 -1.32 -3.27 116.97 116.29 3ind h TYR 282 Ca -0.00 0.00 -0.35 0.00 0.05 0.00 0.00 58.73 58.42 3ind h TYR 282 Cb 0.78 0.00 -0.31 0.00 1.01 0.00 0.00 36.73 38.21 3ind h TYR 282 CO 0.00 0.20 -0.77 0.09 -1.05 0.00 0.00 178.16 176.63 3ind n ASN 283 N -3.31 3.54 -4.29 3.88 3.02 -0.98 -4.35 115.26 112.77 3ind n ASN 283 Ca 0.01 -3.54 -0.38 0.00 -0.03 0.00 0.00 54.58 50.64 3ind n ASN 283 Cb 0.45 -0.40 -0.12 0.00 -0.61 0.00 0.00 39.78 39.10 3ind n ASN 283 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3ind s TYR 284 N -3.36 3.24 -2.50 3.10 5.04 -1.08 -1.22 117.35 120.56 3ind s TYR 284 Ca 0.44 -1.33 0.23 0.00 -2.44 0.00 0.00 57.07 53.97 3ind s TYR 284 Cb 0.39 -2.28 0.51 0.00 0.35 0.00 0.00 41.96 40.93 3ind s TYR 284 CO -0.01 -0.70 1.44 -0.40 -1.34 0.00 0.00 175.55 174.54 3ind n ASP 285 N 4.83 2.82 -3.56 4.32 5.75 -1.26 -3.48 116.55 125.97 3ind n ASP 285 Ca -0.13 -1.90 -0.07 0.00 -0.01 0.00 0.00 54.79 52.69 3ind n ASP 285 Cb 0.45 -0.16 -0.02 0.00 -1.03 0.00 0.00 41.12 40.36 3ind n ASP 285 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3ind s LYS 286 N -1.67 0.76 -0.05 0.11 -2.85 -0.35 -4.60 119.74 111.08 3ind s LYS 286 Ca 0.35 -0.31 0.04 0.00 -1.00 0.00 0.00 55.97 55.06 3ind s LYS 286 Cb 0.21 0.33 -0.00 0.00 -2.06 0.00 0.00 37.83 36.31 3ind s LYS 286 CO 0.30 -0.34 -0.18 -1.12 0.10 0.00 0.00 175.35 174.12 3ind s SER 287 N -2.51 2.24 0.06 0.03 0.01 -1.25 -0.27 113.70 112.02 3ind s SER 287 Ca 0.07 -0.37 0.01 0.00 1.31 0.00 0.00 55.95 56.97 3ind s SER 287 Cb -0.01 -0.69 -0.03 0.00 0.21 0.00 0.00 66.02 65.50 3ind s SER 287 CO -0.07 0.15 -0.06 0.27 0.41 0.00 0.00 173.24 173.95 3ind s ILE 288 N 0.10 0.46 -0.26 1.44 -4.36 -0.21 -0.55 121.20 117.82 3ind s ILE 288 Ca -0.06 -1.53 -0.11 0.00 -0.26 0.00 0.00 60.65 58.69 3ind s ILE 288 Cb -0.12 -1.15 -0.05 0.00 1.25 0.00 0.00 42.46 42.38 3ind s ILE 288 CO 0.03 -0.72 0.17 -0.69 0.24 0.00 0.00 174.94 173.98 3ind s VAL 289 N -2.78 5.27 -0.25 8.37 1.01 -0.78 -0.71 120.40 130.53 3ind s VAL 289 Ca 0.01 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.10 3ind s VAL 289 Cb -0.00 -3.49 0.09 0.00 0.00 0.00 0.00 36.38 32.97 3ind s VAL 289 CO -0.04 0.29 0.12 -0.62 0.00 0.00 0.00 175.10 174.85 3ind s ASP 290 N 1.52 3.06 0.50 3.32 2.15 -0.57 -4.53 116.67 122.12 3ind s ASP 290 Ca 0.07 -1.03 0.33 0.00 0.43 0.00 0.00 52.55 52.36 3ind s ASP 290 Cb -0.15 -0.29 1.52 0.00 -0.30 0.00 0.00 42.92 43.70 3ind s ASP 290 CO 0.09 -0.41 1.99 0.77 -0.17 0.00 0.00 175.17 177.44 3ind h SER 291 N 8.41 0.00 0.03 -0.34 4.64 -1.84 -2.28 113.55 122.17 3ind h SER 291 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3ind h SER 291 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3ind h SER 291 CO 0.38 0.00 -0.01 0.61 -0.87 0.00 0.00 176.83 176.94 3ind n GLY 292 N -0.31 -0.65 3.45 -0.77 0.00 -1.26 -4.54 105.19 101.10 3ind n GLY 292 Ca -0.00 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 3ind n GLY 292 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ind s THR 293 N -2.04 3.44 -0.05 2.61 2.01 -0.86 -5.00 115.64 115.75 3ind s THR 293 Ca 0.43 -0.53 -0.27 0.00 0.31 0.00 0.00 61.69 61.63 3ind s THR 293 Cb 0.21 -2.46 -0.22 0.00 0.01 0.00 0.00 72.50 70.05 3ind s THR 293 CO 0.37 0.52 1.13 0.74 -0.69 0.00 0.00 174.62 176.69 3ind h THR 294 N 5.14 1.49 -3.88 -0.82 2.02 -1.85 0.66 112.91 115.67 3ind h THR 294 Ca -0.31 -1.47 -0.48 0.00 0.77 0.00 0.00 66.41 64.92 3ind h THR 294 Cb 1.20 2.49 0.06 0.00 -1.74 0.00 0.00 68.15 70.16 3ind h THR 294 CO 0.58 0.38 0.24 0.20 0.37 0.00 0.00 175.52 177.29 3ind s ASN 295 N -5.83 5.56 -0.33 4.18 0.01 -1.26 -0.92 114.94 116.35 3ind s ASN 295 Ca -0.17 0.83 -0.28 0.00 -0.71 0.00 0.00 52.86 52.53 3ind s ASN 295 Cb 0.00 -1.77 0.01 0.00 0.41 0.00 0.00 41.25 39.91 3ind s ASN 295 CO 0.68 -1.13 1.02 -0.22 -1.51 0.00 0.00 177.10 175.93 3ind s LEU 296 N -5.09 3.96 -0.14 0.60 2.96 -0.63 -2.43 118.68 117.90 3ind s LEU 296 Ca 0.55 0.93 -0.03 0.00 -0.22 0.00 0.00 54.13 55.36 3ind s LEU 296 Cb -0.11 -3.45 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 3ind s LEU 296 CO 0.47 -0.85 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.48 3ind s ARG 297 N 3.55 3.57 0.06 1.98 0.52 0.64 -1.66 118.95 127.61 3ind s ARG 297 Ca 0.43 -0.51 0.08 0.00 -0.52 0.00 0.00 55.73 55.21 3ind s ARG 297 Cb -0.12 -2.89 -0.03 0.00 0.52 0.00 0.00 34.95 32.43 3ind s ARG 297 CO 0.16 0.30 -0.22 -0.51 0.02 0.00 0.00 175.30 175.05 3ind s LEU 298 N 0.19 2.20 0.60 2.53 1.43 -0.62 0.17 118.68 125.18 3ind s LEU 298 Ca -0.02 -0.57 -0.19 0.00 -1.03 0.00 0.00 54.13 52.32 3ind s LEU 298 Cb -0.14 -1.03 -0.05 0.00 0.03 0.00 0.00 46.19 45.01 3ind s LEU 298 CO 0.03 0.16 0.98 -2.65 0.23 0.00 0.00 176.35 175.10 3ind n PRO 299 N 1.65 0.92 -0.33 1.29 -0.02 -1.26 0.28 135.00 137.53 3ind n PRO 299 Ca -0.18 0.36 -0.03 0.00 -2.02 0.00 0.00 63.50 61.64 3ind n PRO 299 Cb 0.53 -2.19 0.03 0.00 -0.02 0.00 0.00 33.50 31.85 3ind n PRO 299 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3ind h LYS 300 N 0.51 -0.05 -0.53 -0.52 3.64 -1.87 0.29 116.57 118.04 3ind h LYS 300 Ca -0.49 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.85 3ind h LYS 300 Cb 1.36 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.17 3ind h LYS 300 CO 0.51 -0.03 0.14 -0.22 -2.27 0.00 0.00 179.45 177.58 3ind h LYS 301 N -0.05 0.80 0.03 1.90 3.64 -1.92 -1.82 116.57 119.16 3ind h LYS 301 Ca 0.31 -0.15 -0.25 0.00 -1.27 0.00 0.00 60.65 59.28 3ind h LYS 301 Cb 0.58 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 32.29 3ind h LYS 301 CO -0.90 0.71 -1.05 0.28 -2.27 0.00 0.00 179.45 176.22 3ind h VAL 302 N 0.78 1.35 -0.05 2.00 2.07 -1.35 -2.96 116.25 118.09 3ind h VAL 302 Ca 0.18 -2.45 0.01 0.00 0.82 0.00 0.00 66.70 65.26 3ind h VAL 302 Cb 0.26 2.50 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 3ind h VAL 302 CO -0.00 0.74 -0.00 0.15 0.02 0.00 0.00 177.57 178.47 3ind h PHE 303 N 0.27 -0.01 -0.54 1.57 3.04 -0.16 0.34 116.94 121.46 3ind h PHE 303 Ca -0.12 0.00 0.01 0.00 3.98 0.00 0.00 57.97 61.84 3ind h PHE 303 Cb 1.70 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 40.20 3ind h PHE 303 CO 0.08 -0.01 0.35 0.93 -2.02 0.00 0.00 178.31 177.64 3ind h GLU 304 N 0.01 0.70 -0.33 1.11 5.08 -1.42 0.13 114.58 119.87 3ind h GLU 304 Ca 0.03 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3ind h GLU 304 Cb 0.03 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3ind h GLU 304 CO -0.05 0.46 -0.04 0.00 -1.00 0.00 0.00 179.01 178.39 3ind h ALA 305 N 1.20 1.33 0.05 3.43 0.00 -1.33 -0.61 119.26 123.32 3ind h ALA 305 Ca 0.20 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ind h ALA 305 Cb -0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3ind h ALA 305 CO -0.04 0.46 -0.02 0.00 0.00 0.00 0.00 179.25 179.64 3ind h ALA 306 N 1.47 -0.06 -0.62 0.00 0.00 -0.14 -2.71 119.26 117.20 3ind h ALA 306 Ca 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ind h ALA 306 Cb 0.38 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3ind h ALA 306 CO 0.02 -0.30 0.40 0.28 0.00 0.00 0.00 179.25 179.64 3ind h VAL 307 N -0.53 1.17 -0.41 0.00 2.07 -0.64 -0.65 116.25 117.26 3ind h VAL 307 Ca -0.01 -0.34 0.08 0.00 0.82 0.00 0.00 66.70 67.25 3ind h VAL 307 Cb 0.47 0.28 -0.07 0.00 -1.52 0.00 0.00 31.29 30.45 3ind h VAL 307 CO 0.01 0.17 -0.04 0.50 0.02 0.00 0.00 177.57 178.23 3ind h LYS 308 N 0.84 0.06 -0.45 1.57 3.64 -1.16 0.39 116.57 121.46 3ind h LYS 308 Ca 0.23 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.53 3ind h LYS 308 Cb -0.07 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3ind h LYS 308 CO -0.05 0.04 -0.02 1.03 -2.27 0.00 0.00 179.45 178.18 3ind h SER 309 N 0.06 0.72 0.02 4.20 0.87 -1.07 -1.77 113.55 116.57 3ind h SER 309 Ca 0.20 -0.18 -0.22 0.00 -1.23 0.00 0.00 61.79 60.36 3ind h SER 309 Cb 0.30 -0.19 0.01 0.00 -0.44 0.00 0.00 62.40 62.08 3ind h SER 309 CO -0.37 0.80 -0.84 0.40 -0.53 0.00 0.00 176.83 176.29 3ind h ILE 310 N 0.70 1.31 -0.89 2.23 2.04 -0.42 -2.10 117.51 120.38 3ind h ILE 310 Ca 0.13 -2.11 0.02 0.00 1.00 0.00 0.00 64.86 63.91 3ind h ILE 310 Cb 0.46 2.13 -0.05 0.00 -0.74 0.00 0.00 36.82 38.62 3ind h ILE 310 CO 0.02 0.65 0.58 0.11 0.00 0.00 0.00 178.15 179.52 3ind h LYS 311 N 0.43 1.13 0.02 2.37 1.57 -0.03 -2.29 116.57 119.77 3ind h LYS 311 Ca -0.07 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3ind h LYS 311 Cb 1.46 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3ind h LYS 311 CO 0.16 0.75 -0.01 0.00 -0.57 0.00 0.00 179.45 179.78 3ind h ALA 312 N 1.34 -0.03 -0.35 3.86 0.00 -1.26 -2.31 119.26 120.52 3ind h ALA 312 Ca 0.34 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3ind h ALA 312 Cb -0.07 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3ind h ALA 312 CO -0.09 -0.35 0.24 0.00 0.00 0.00 0.00 179.25 179.04 3ind h ALA 313 N 0.61 1.91 -0.61 0.00 0.00 -1.25 -0.86 119.26 119.06 3ind h ALA 313 Ca -0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 3ind h ALA 313 Cb 0.34 -0.09 -0.13 0.00 0.00 0.00 0.00 17.79 17.92 3ind h ALA 313 CO 0.01 0.04 0.21 -1.13 0.00 0.00 0.00 179.25 178.37 3ind n SER 314 N -4.49 4.02 -0.24 0.00 3.41 -0.87 -4.71 113.62 110.74 3ind n SER 314 Ca 0.03 -3.36 0.05 0.00 -0.26 0.00 0.00 58.87 55.33 3ind n SER 314 Cb 0.18 -0.70 0.17 0.00 -0.26 0.00 0.00 64.21 63.60 3ind n SER 314 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3ind h SER 315 N 1.92 0.05 -0.72 4.04 4.64 -0.56 -3.40 113.55 119.54 3ind h SER 315 Ca 0.26 0.13 -0.52 0.00 -0.47 0.00 0.00 61.79 61.20 3ind h SER 315 Cb 2.12 0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 64.34 3ind h SER 315 CO 0.63 -0.01 1.65 0.35 -0.87 0.00 0.00 176.83 178.59 3ind n THR 316 N -5.13 -0.01 -2.11 2.95 -2.24 -1.26 -3.53 114.28 102.95 3ind n THR 316 Ca 0.13 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3ind n THR 316 Cb 0.43 -1.48 0.00 0.00 -2.10 0.00 0.00 70.33 67.18 3ind n THR 316 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ind n GLU 317 N 8.60 -4.63 -3.35 -0.78 1.02 -1.26 -5.06 120.64 115.18 3ind n GLU 317 Ca 0.52 3.40 -0.22 0.00 -0.02 0.00 0.00 57.16 60.84 3ind n GLU 317 Cb 0.24 -4.09 0.03 0.00 -0.02 0.00 0.00 31.44 27.60 3ind n GLU 317 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3ind s LYS 318 N -0.83 2.34 0.31 3.49 1.02 -1.23 -5.03 119.74 119.80 3ind s LYS 318 Ca 0.00 -1.73 0.06 0.00 0.02 0.00 0.00 55.97 54.32 3ind s LYS 318 Cb 0.00 -2.46 -0.06 0.00 -0.52 0.00 0.00 37.83 34.79 3ind s LYS 318 CO 0.00 -0.70 -0.02 -0.06 -0.92 0.00 0.00 175.35 173.65 3ind s PHE 319 N -2.67 2.04 0.34 3.18 0.40 -1.26 -5.13 117.98 114.88 3ind s PHE 319 Ca 0.51 -0.75 -0.28 0.00 -0.60 0.00 0.00 56.93 55.81 3ind s PHE 319 Cb -0.05 -1.25 -0.10 0.00 0.51 0.00 0.00 43.02 42.14 3ind s PHE 319 CO 0.32 0.24 1.21 -2.14 0.70 0.00 0.00 175.22 175.55 3ind s PRO 320 N -3.76 4.36 0.24 0.24 0.02 -1.26 -4.90 135.00 129.94 3ind s PRO 320 Ca 0.32 1.99 0.18 0.00 0.02 0.00 0.00 61.00 63.52 3ind s PRO 320 Cb 0.06 -3.00 0.93 0.00 0.02 0.00 0.00 34.50 32.51 3ind s PRO 320 CO 0.14 -0.11 1.56 -0.40 -0.33 0.00 0.00 177.00 177.87 3ind n ASP 321 N 0.71 0.47 0.23 2.53 5.75 -1.26 -0.16 116.55 124.83 3ind n ASP 321 Ca 0.01 0.69 0.09 0.00 -0.01 0.00 0.00 54.79 55.57 3ind n ASP 321 Cb 0.44 -0.76 0.56 0.00 -1.03 0.00 0.00 41.12 40.32 3ind n ASP 321 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3ind h GLY 322 N 0.64 0.00 0.58 6.12 0.00 -1.94 -2.05 103.07 106.41 3ind h GLY 322 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 3ind h GLY 322 CO 0.00 0.00 -0.34 -2.75 0.00 0.00 0.00 176.54 173.45 3ind h PHE 323 N 0.00 0.37 0.00 5.60 3.57 -0.72 0.24 116.94 126.00 3ind h PHE 323 Ca -0.00 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.30 3ind h PHE 323 Cb 0.52 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 3ind h PHE 323 CO 0.00 0.98 -0.05 -1.49 -2.23 0.00 0.00 178.31 175.52 3ind h TRP 324 N -0.34 0.00 -0.18 0.41 4.06 -1.52 -0.92 115.95 117.46 3ind h TRP 324 Ca -0.04 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.91 3ind h TRP 324 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.22 3ind h TRP 324 CO 0.16 0.05 0.00 1.28 -3.56 0.00 0.00 178.44 176.37 3ind n LEU 325 N -3.41 1.42 0.00 -4.49 4.77 -0.79 -4.89 117.00 109.62 3ind n LEU 325 Ca -0.02 -0.63 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 3ind n LEU 325 Cb 0.18 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 3ind n LEU 325 CO 0.26 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 3ind n GLY 326 N 1.04 0.40 0.00 -0.72 0.00 -0.35 -4.91 105.19 100.65 3ind n GLY 326 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3ind n GLY 326 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ind n GLU 327 N -1.78 0.00 -1.48 1.61 1.02 -0.45 -4.81 120.64 114.75 3ind n GLU 327 Ca 0.00 0.09 -0.32 0.00 -0.02 0.00 0.00 57.16 56.91 3ind n GLU 327 Cb 0.13 -0.48 0.08 0.00 -0.02 0.00 0.00 31.44 31.14 3ind n GLU 327 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 3ind s GLN 328 N -0.27 2.42 0.29 3.49 0.74 0.72 -4.93 119.66 122.13 3ind s GLN 328 Ca 0.00 1.36 0.07 0.00 0.05 0.00 0.00 55.36 56.85 3ind s GLN 328 Cb 0.00 -1.90 -0.03 0.00 1.10 0.00 0.00 33.01 32.17 3ind s GLN 328 CO 0.00 -1.54 0.22 -0.48 -0.55 0.00 0.00 175.29 172.94 3ind s LEU 329 N -5.37 3.66 -0.05 3.68 0.05 -1.26 -4.22 118.68 115.17 3ind s LEU 329 Ca 0.66 -0.40 0.05 0.00 0.05 0.00 0.00 54.13 54.49 3ind s LEU 329 Cb -0.20 -2.22 -0.01 0.00 -2.05 0.00 0.00 46.19 41.71 3ind s LEU 329 CO 0.48 -0.18 -0.20 0.54 -0.55 0.00 0.00 176.35 176.44 3ind s VAL 330 N -2.23 1.66 -0.06 1.48 0.11 -0.02 -4.92 120.40 116.41 3ind s VAL 330 Ca 0.36 -0.85 0.03 0.00 -2.93 0.00 0.00 61.98 58.60 3ind s VAL 330 Cb -0.07 -1.41 0.01 0.00 -1.53 0.00 0.00 36.38 33.38 3ind s VAL 330 CO 0.25 0.47 -0.14 0.00 -3.33 0.00 0.00 175.10 172.35 3ind n TRP 332 N 3.60 0.00 -3.74 0.00 8.01 -1.26 -4.95 117.44 119.10 3ind n TRP 332 Ca -0.21 0.00 -0.13 0.00 -1.31 0.00 0.00 57.50 55.85 3ind n TRP 332 Cb 0.52 0.00 -0.14 0.00 -2.01 0.00 0.00 31.31 29.69 3ind n TRP 332 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.69 176.03 3ind s GLN 333 N 1.84 0.16 -0.53 -0.99 -0.21 -1.26 -4.49 119.66 114.17 3ind s GLN 333 Ca 0.00 0.45 -0.25 0.00 0.02 0.00 0.00 55.36 55.58 3ind s GLN 333 Cb 0.00 -0.14 0.04 0.00 1.00 0.00 0.00 33.01 33.91 3ind s GLN 333 CO 0.00 -0.16 0.64 0.00 -2.12 0.00 0.00 175.29 173.66 3ind n ALA 334 N 4.18 -2.55 -2.75 6.09 0.00 -1.26 -3.05 120.51 121.16 3ind n ALA 334 Ca -0.25 0.41 -0.21 0.00 0.00 0.00 0.00 53.44 53.38 3ind n ALA 334 Cb 0.53 -2.29 0.01 0.00 0.00 0.00 0.00 19.45 17.69 3ind n ALA 334 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ind n GLY 335 N -0.55 -0.51 0.52 0.00 0.00 -1.26 -4.85 105.19 98.54 3ind n GLY 335 Ca -0.07 0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.11 3ind n GLY 335 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ind n THR 336 N -4.20 0.00 -1.69 2.61 -2.24 -1.17 -4.98 114.28 102.61 3ind n THR 336 Ca -0.16 -0.33 -0.52 0.00 -2.27 0.00 0.00 64.05 60.76 3ind n THR 336 Cb 0.64 1.27 -0.06 0.00 -2.10 0.00 0.00 70.33 70.08 3ind n THR 336 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3ind n THR 337 N 0.17 0.46 -1.41 4.28 -1.04 -1.26 -4.83 114.28 110.64 3ind n THR 337 Ca 0.09 -0.09 -0.40 0.00 -2.04 0.00 0.00 64.05 61.61 3ind n THR 337 Cb 0.44 -1.60 -0.02 0.00 -1.82 0.00 0.00 70.33 67.33 3ind n THR 337 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3ind n PRO 338 N 6.18 3.58 -0.30 -2.82 -0.04 -1.26 -4.75 135.00 135.59 3ind n PRO 338 Ca 0.25 -2.31 0.13 0.00 -0.04 0.00 0.00 63.50 61.52 3ind n PRO 338 Cb 0.22 -2.88 0.28 0.00 -0.04 0.00 0.00 33.50 31.08 3ind n PRO 338 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3ind h TRP 339 N 5.17 0.23 -0.16 0.54 4.06 -1.95 -0.09 115.95 123.75 3ind h TRP 339 Ca 0.82 0.05 0.05 0.00 2.06 0.00 0.00 58.89 61.87 3ind h TRP 339 Cb 0.35 0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.54 3ind h TRP 339 CO 1.80 -0.26 0.33 -0.91 -3.56 0.00 0.00 178.44 175.84 3ind h ASN 340 N 0.15 0.00 0.74 -3.49 2.35 -2.01 -0.16 115.58 113.16 3ind h ASN 340 Ca 0.55 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 56.16 3ind h ASN 340 Cb 1.11 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.46 3ind h ASN 340 CO -0.71 0.00 -0.64 0.40 -1.65 0.00 0.00 177.43 174.83 3ind h ILE 341 N 0.00 1.39 -3.29 2.81 2.04 -1.35 -3.43 117.51 115.67 3ind h ILE 341 Ca 0.08 -2.25 -0.57 0.00 1.00 0.00 0.00 64.86 63.12 3ind h ILE 341 Cb 0.75 2.24 -0.05 0.00 -0.74 0.00 0.00 36.82 39.01 3ind h ILE 341 CO -0.00 0.63 -0.00 -0.36 0.00 0.00 0.00 178.15 178.41 3ind s PHE 342 N -3.44 3.75 0.77 1.37 0.08 -0.08 -3.25 117.98 117.19 3ind s PHE 342 Ca -0.01 1.27 -0.11 0.00 0.12 0.00 0.00 56.93 58.20 3ind s PHE 342 Cb 0.12 -2.58 0.05 0.00 -0.57 0.00 0.00 43.02 40.04 3ind s PHE 342 CO 0.76 0.46 1.09 -1.25 -0.10 0.00 0.00 175.22 176.18 3ind s PRO 343 N -0.63 2.31 0.45 0.24 0.04 -1.26 -4.75 135.00 131.40 3ind s PRO 343 Ca 0.31 0.63 -0.05 0.00 0.04 0.00 0.00 61.00 61.92 3ind s PRO 343 Cb -0.19 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 3ind s PRO 343 CO 0.19 -1.46 0.75 0.14 0.04 0.00 0.00 177.00 176.66 3ind s VAL 344 N -3.19 4.92 -0.12 -0.36 -7.23 -1.26 -4.32 120.40 108.84 3ind s VAL 344 Ca 0.60 0.18 0.01 0.00 -1.81 0.00 0.00 61.98 60.96 3ind s VAL 344 Cb -0.14 -3.84 0.02 0.00 0.56 0.00 0.00 36.38 32.98 3ind s VAL 344 CO 0.54 -0.76 -0.15 -0.63 -0.31 0.00 0.00 175.10 173.79 3ind s ILE 345 N -2.63 1.51 -0.24 -0.62 1.01 -0.67 -0.74 121.20 118.82 3ind s ILE 345 Ca 0.47 -0.64 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 3ind s ILE 345 Cb -0.10 -1.39 -0.00 0.00 0.01 0.00 0.00 42.46 40.97 3ind s ILE 345 CO 0.42 0.45 -0.02 -0.44 0.00 0.00 0.00 174.94 175.34 3ind s SER 346 N 1.10 4.45 -0.28 3.58 0.01 0.15 -0.48 113.70 122.24 3ind s SER 346 Ca -0.04 -0.51 -0.14 0.00 1.31 0.00 0.00 55.95 56.57 3ind s SER 346 Cb -0.14 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 3ind s SER 346 CO -0.04 -0.06 0.34 -0.76 0.41 0.00 0.00 173.24 173.13 3ind s LEU 347 N 1.46 4.09 -0.19 2.44 1.43 -0.12 -1.23 118.68 126.55 3ind s LEU 347 Ca 0.04 0.17 -0.21 0.00 -1.03 0.00 0.00 54.13 53.10 3ind s LEU 347 Cb -0.15 -2.36 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 3ind s LEU 347 CO -0.02 -0.18 0.64 -0.31 0.23 0.00 0.00 176.35 176.71 3ind s TYR 348 N 2.01 3.38 -0.02 0.29 1.51 0.10 -1.02 117.35 123.61 3ind s TYR 348 Ca 0.13 0.96 0.01 0.00 -1.01 0.00 0.00 57.07 57.16 3ind s TYR 348 Cb -0.16 -2.81 -0.04 0.00 -0.11 0.00 0.00 41.96 38.84 3ind s TYR 348 CO 0.10 -0.17 0.01 -0.51 -1.11 0.00 0.00 175.55 173.87 3ind s LEU 349 N 1.89 3.56 0.19 -1.29 1.43 0.15 -0.45 118.68 124.17 3ind s LEU 349 Ca 0.30 0.03 -0.33 0.00 -1.03 0.00 0.00 54.13 53.10 3ind s LEU 349 Cb -0.16 -2.01 -0.14 0.00 0.03 0.00 0.00 46.19 43.92 3ind s LEU 349 CO 0.11 0.30 1.48 0.80 0.23 0.00 0.00 176.35 179.26 3ind n MET 350 N 1.50 2.02 -2.00 1.70 0.00 -0.06 -1.72 117.12 118.56 3ind n MET 350 Ca -0.15 0.72 -0.29 0.00 -0.00 0.00 0.00 57.70 57.98 3ind n MET 350 Cb 0.53 -2.43 0.17 0.00 0.00 0.00 0.00 33.22 31.48 3ind n MET 350 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3ind s GLY 351 N 0.60 1.76 0.45 -5.12 0.00 0.26 -4.04 107.32 101.24 3ind s GLY 351 Ca 0.74 -1.21 0.24 0.00 0.00 0.00 0.00 44.72 44.50 3ind s GLY 351 CO 0.44 -0.49 1.85 0.83 0.00 0.00 0.00 173.10 175.73 3ind h GLU 352 N -1.46 0.00 -5.05 2.90 5.08 -1.84 -3.42 114.58 110.80 3ind h GLU 352 Ca -0.44 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.30 3ind h GLU 352 Cb 1.25 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.35 3ind h GLU 352 CO 0.41 0.22 -0.50 0.08 -1.00 0.00 0.00 179.01 178.22 3ind s VAL 353 N -3.71 5.34 0.00 3.13 1.01 -1.26 -5.02 120.40 119.88 3ind s VAL 353 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.17 3ind s VAL 353 Cb 0.11 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.97 3ind s VAL 353 CO 0.63 0.32 0.00 0.41 0.00 0.00 0.00 175.10 176.46 3ind n THR 354 N 4.49 0.00 0.96 3.92 -1.04 -1.26 -0.07 114.28 121.28 3ind n THR 354 Ca -0.15 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 61.87 3ind n THR 354 Cb 0.52 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 69.08 3ind n THR 354 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3ind n ASN 355 N -0.27 1.34 -4.82 8.00 6.94 -1.26 -4.66 115.26 120.52 3ind n ASN 355 Ca 0.00 -2.09 -0.24 0.00 -0.02 0.00 0.00 54.58 52.23 3ind n ASN 355 Cb 0.00 -0.43 -0.05 0.00 -2.36 0.00 0.00 39.78 36.94 3ind n ASN 355 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 3ind s GLN 356 N -1.34 2.96 0.31 -3.83 -0.21 0.89 -1.09 119.66 117.35 3ind s GLN 356 Ca 0.06 -0.95 -0.09 0.00 0.02 0.00 0.00 55.36 54.40 3ind s GLN 356 Cb 0.04 -2.63 0.01 0.00 1.00 0.00 0.00 33.01 31.44 3ind s GLN 356 CO 0.02 0.44 0.54 -1.54 -2.12 0.00 0.00 175.29 172.64 3ind s SER 357 N -3.51 0.33 0.08 5.90 1.04 -0.13 -0.57 113.70 116.83 3ind s SER 357 Ca 0.32 -1.19 -0.08 0.00 0.48 0.00 0.00 55.95 55.48 3ind s SER 357 Cb -0.09 0.67 -0.00 0.00 0.10 0.00 0.00 66.02 66.70 3ind s SER 357 CO 0.25 -1.32 0.17 0.72 0.98 0.00 0.00 173.24 174.04 3ind s PHE 358 N -3.30 0.17 0.08 5.02 -0.12 -0.70 -0.41 117.98 118.71 3ind s PHE 358 Ca 0.24 -0.60 0.08 0.00 -0.05 0.00 0.00 56.93 56.61 3ind s PHE 358 Cb -0.02 -0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.26 3ind s PHE 358 CO 0.14 -0.53 -0.20 -0.98 -0.05 0.00 0.00 175.22 173.60 3ind s ARG 359 N -3.79 1.85 -0.11 1.99 1.70 0.55 0.33 118.95 121.47 3ind s ARG 359 Ca 0.04 -1.11 0.01 0.00 -0.47 0.00 0.00 55.73 54.20 3ind s ARG 359 Cb 0.05 -2.10 -0.02 0.00 -0.57 0.00 0.00 34.95 32.31 3ind s ARG 359 CO -0.11 0.51 -0.12 0.96 -1.08 0.00 0.00 175.30 175.45 3ind s ILE 360 N -0.99 3.14 -0.19 4.99 -4.36 -0.18 -1.02 121.20 122.59 3ind s ILE 360 Ca 0.15 -0.65 -0.01 0.00 -0.26 0.00 0.00 60.65 59.88 3ind s ILE 360 Cb -0.10 -2.30 0.01 0.00 1.25 0.00 0.00 42.46 41.32 3ind s ILE 360 CO 0.06 0.54 -0.13 -0.89 0.24 0.00 0.00 174.94 174.76 3ind s THR 361 N 0.01 2.65 0.03 8.37 2.01 0.13 -0.95 115.64 127.89 3ind s THR 361 Ca -0.04 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.26 3ind s THR 361 Cb -0.14 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 3ind s THR 361 CO 0.04 0.49 -0.06 0.27 -0.69 0.00 0.00 174.62 174.67 3ind s ILE 362 N 1.28 3.66 0.54 1.82 -4.36 0.37 -1.43 121.20 123.08 3ind s ILE 362 Ca 0.04 -0.86 0.00 0.00 -0.26 0.00 0.00 60.65 59.57 3ind s ILE 362 Cb -0.14 -2.63 0.03 0.00 1.25 0.00 0.00 42.46 40.97 3ind s ILE 362 CO -0.07 0.33 0.77 -0.76 0.24 0.00 0.00 174.94 175.45 3ind s LEU 363 N -1.62 3.32 0.54 0.37 1.43 -1.26 -1.67 118.68 119.79 3ind s LEU 363 Ca 0.19 0.11 0.21 0.00 -1.03 0.00 0.00 54.13 53.61 3ind s LEU 363 Cb -0.11 -2.97 1.45 0.00 0.03 0.00 0.00 46.19 44.59 3ind s LEU 363 CO 0.10 -1.08 2.17 -0.65 0.23 0.00 0.00 176.35 177.12 3ind h PRO 364 N 0.08 0.00 0.00 1.29 0.11 -1.86 -1.30 132.00 130.32 3ind h PRO 364 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3ind h PRO 364 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3ind h PRO 364 CO 0.54 0.00 0.01 1.96 -0.21 0.00 0.00 178.00 180.30 3ind h GLN 365 N 0.00 0.00 0.04 1.05 7.50 -1.89 0.11 115.11 121.92 3ind h GLN 365 Ca 0.02 0.00 -0.37 0.00 0.50 0.00 0.00 58.65 58.80 3ind h GLN 365 Cb 0.08 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 27.56 3ind h GLN 365 CO -0.00 0.00 -2.15 1.04 -1.50 0.00 0.00 178.83 176.22 3ind n GLN 366 N -2.94 0.67 -0.02 1.46 6.02 -0.50 -4.47 117.38 117.59 3ind n GLN 366 Ca -0.03 0.27 0.13 0.00 -0.01 0.00 0.00 57.00 57.36 3ind n GLN 366 Cb 0.07 -1.61 0.39 0.00 1.02 0.00 0.00 30.24 30.10 3ind n GLN 366 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 3ind n TYR 367 N -3.67 0.06 -3.81 1.08 0.18 -1.04 -4.47 117.16 105.49 3ind n TYR 367 Ca -0.41 -0.03 -0.36 0.00 1.88 0.00 0.00 57.90 58.99 3ind n TYR 367 Cb 0.95 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.79 3ind n TYR 367 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3ind s LEU 368 N -1.91 4.85 -0.11 -3.48 1.43 0.36 0.25 118.68 120.07 3ind s LEU 368 Ca 0.35 -1.78 -0.06 0.00 -1.03 0.00 0.00 54.13 51.61 3ind s LEU 368 Cb 0.20 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 3ind s LEU 368 CO 0.32 -0.46 0.12 0.00 0.23 0.00 0.00 176.35 176.56 3ind s ARG 369 N 1.19 3.36 0.52 1.70 1.70 -0.40 -4.73 118.95 122.29 3ind s ARG 369 Ca 0.04 -0.18 -0.17 0.00 -0.47 0.00 0.00 55.73 54.95 3ind s ARG 369 Cb -0.22 -3.12 -0.07 0.00 -0.57 0.00 0.00 34.95 30.97 3ind s ARG 369 CO -0.03 0.76 1.01 -1.25 -1.08 0.00 0.00 175.30 174.72 3ind s PRO 370 N -1.03 3.76 0.00 3.89 0.04 -1.26 0.21 135.00 140.61 3ind s PRO 370 Ca 0.15 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.31 3ind s PRO 370 Cb -0.12 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.32 3ind s PRO 370 CO 0.04 -0.43 0.00 0.00 0.04 0.00 0.00 177.00 176.65 3ind s TYR 382 N -0.37 0.91 0.05 0.00 2.02 0.20 -4.94 117.35 115.22 3ind s TYR 382 Ca 0.00 -0.68 0.07 0.00 -0.37 0.00 0.00 57.07 56.09 3ind s TYR 382 Cb 0.00 -0.52 -0.03 0.00 -0.40 0.00 0.00 41.96 41.01 3ind s TYR 382 CO 0.00 -0.06 -0.16 0.15 -1.57 0.00 0.00 175.55 173.91 3ind s LYS 383 N -2.70 2.10 -0.42 -0.62 1.02 0.13 -0.84 119.74 118.40 3ind s LYS 383 Ca 0.03 -0.98 -0.28 0.00 0.02 0.00 0.00 55.97 54.75 3ind s LYS 383 Cb -0.03 -2.23 -0.00 0.00 -0.52 0.00 0.00 37.83 35.05 3ind s LYS 383 CO -0.01 0.54 1.59 0.12 -0.92 0.00 0.00 175.35 176.67 3ind s PHE 384 N -1.00 2.10 -0.25 3.18 5.36 -1.26 -1.28 117.98 124.84 3ind s PHE 384 Ca 0.16 0.64 0.02 0.00 -0.96 0.00 0.00 56.93 56.79 3ind s PHE 384 Cb -0.11 -4.24 0.37 0.00 -0.34 0.00 0.00 43.02 38.70 3ind s PHE 384 CO 0.07 -2.35 1.50 0.00 -1.46 0.00 0.00 175.22 172.98 3ind n ALA 385 N 9.83 4.20 -3.67 11.12 0.00 0.14 -4.39 120.51 137.74 3ind n ALA 385 Ca 0.19 -1.59 -0.33 0.00 0.00 0.00 0.00 53.44 51.70 3ind n ALA 385 Cb 0.48 -1.25 -0.16 0.00 0.00 0.00 0.00 19.45 18.52 3ind n ALA 385 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ind s ILE 386 N -1.82 2.25 0.20 0.00 1.01 -1.26 -1.61 121.20 119.97 3ind s ILE 386 Ca 0.31 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 60.07 3ind s ILE 386 Cb 0.26 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 3ind s ILE 386 CO 0.06 0.54 0.05 -0.94 0.00 0.00 0.00 174.94 174.65 3ind s SER 387 N 0.89 1.04 0.40 3.58 1.04 -0.67 -4.73 113.70 115.25 3ind s SER 387 Ca -0.05 -1.26 -0.16 0.00 0.48 0.00 0.00 55.95 54.97 3ind s SER 387 Cb -0.15 0.17 -0.09 0.00 0.10 0.00 0.00 66.02 66.05 3ind s SER 387 CO -0.03 -0.66 0.83 -1.58 0.98 0.00 0.00 173.24 172.78 3ind s GLN 388 N -3.99 3.99 0.01 4.02 0.74 -1.26 -1.59 119.66 121.59 3ind s GLN 388 Ca 0.30 0.77 0.02 0.00 0.05 0.00 0.00 55.36 56.49 3ind s GLN 388 Cb 0.07 -2.32 -0.01 0.00 1.10 0.00 0.00 33.01 31.85 3ind s GLN 388 CO 0.08 0.00 -0.05 0.45 -0.55 0.00 0.00 175.29 175.21 3ind s SER 389 N -2.59 0.59 0.00 6.67 0.15 0.14 -4.71 113.70 113.96 3ind s SER 389 Ca 0.56 -0.24 0.07 0.00 0.70 0.00 0.00 55.95 57.04 3ind s SER 389 Cb -0.10 -0.02 0.19 0.00 -1.71 0.00 0.00 66.02 64.38 3ind s SER 389 CO 0.22 -0.04 1.14 -1.20 1.20 0.00 0.00 173.24 174.56 3ind n SER 390 N 2.45 2.55 -0.73 5.45 7.64 -1.26 -2.68 113.62 127.04 3ind n SER 390 Ca -0.16 -1.96 0.05 0.00 1.01 0.00 0.00 58.87 57.82 3ind n SER 390 Cb 0.57 -0.14 0.11 0.00 -1.01 0.00 0.00 64.21 63.74 3ind n SER 390 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3ind n THR 391 N 0.19 1.22 -0.10 0.44 -2.24 -1.26 -4.87 114.28 107.66 3ind n THR 391 Ca 0.07 -1.97 0.00 0.00 -2.27 0.00 0.00 64.05 59.89 3ind n THR 391 Cb 0.35 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 3ind n THR 391 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ind n GLY 392 N -0.57 -3.69 3.72 3.38 0.00 -1.23 -4.52 105.19 102.27 3ind n GLY 392 Ca 0.12 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 3ind n GLY 392 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ind s THR 393 N -0.90 4.04 -0.27 2.61 2.01 0.63 -4.30 115.64 119.47 3ind s THR 393 Ca 0.00 1.50 0.01 0.00 0.31 0.00 0.00 61.69 63.50 3ind s THR 393 Cb 0.00 -3.96 0.05 0.00 0.01 0.00 0.00 72.50 68.61 3ind s THR 393 CO 0.00 0.13 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.31 3ind s VAL 394 N 0.90 2.51 -0.90 3.82 1.01 0.13 -1.04 120.40 126.83 3ind s VAL 394 Ca 0.57 -1.49 -0.20 0.00 0.00 0.00 0.00 61.98 60.86 3ind s VAL 394 Cb -0.29 -2.45 0.10 0.00 0.00 0.00 0.00 36.38 33.75 3ind s VAL 394 CO 0.30 -0.03 1.17 -0.04 0.00 0.00 0.00 175.10 176.49 3ind s MET 395 N 1.17 3.51 0.00 2.72 -1.94 0.11 -0.26 119.30 124.61 3ind s MET 395 Ca -0.07 -1.46 0.00 0.00 -1.71 0.00 0.00 55.69 52.45 3ind s MET 395 Cb -0.20 -4.88 0.00 0.00 2.01 0.00 0.00 34.83 31.77 3ind s MET 395 CO -0.04 -1.87 0.00 0.41 -0.01 0.00 0.00 175.02 173.51 3ind n GLY 396 N 5.74 1.11 0.28 -0.03 0.00 -1.02 -1.51 105.19 109.76 3ind n GLY 396 Ca 0.21 -1.94 -0.00 0.00 0.00 0.00 0.00 46.02 44.28 3ind n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ind h ALA 397 N -0.98 0.37 0.00 4.61 0.00 0.61 -1.36 119.26 122.51 3ind h ALA 397 Ca 0.00 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3ind h ALA 397 Cb 0.00 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 3ind h ALA 397 CO 0.00 -0.47 -0.04 -0.39 0.00 0.00 0.00 179.25 178.35 3ind h VAL 398 N -0.03 0.39 0.03 0.00 -1.51 -1.28 0.65 116.25 114.50 3ind h VAL 398 Ca 0.32 -0.20 -0.31 0.00 -1.23 0.00 0.00 66.70 65.28 3ind h VAL 398 Cb 0.53 1.14 -0.04 0.00 -2.13 0.00 0.00 31.29 30.78 3ind h VAL 398 CO -0.72 0.04 -1.76 0.00 -1.23 0.00 0.00 177.57 173.90 3ind n ILE 399 N -3.57 1.65 0.16 7.19 3.06 -0.61 -4.08 119.36 123.16 3ind n ILE 399 Ca -0.02 -0.77 0.02 0.00 -2.50 0.00 0.00 62.75 59.48 3ind n ILE 399 Cb 0.14 -1.19 0.25 0.00 0.54 0.00 0.00 39.64 39.39 3ind n ILE 399 CO 0.00 0.00 0.00 0.24 -2.50 0.00 0.00 176.55 174.29 3ind h MET 400 N 0.02 0.00 0.00 9.51 2.86 -0.02 -3.27 114.93 124.02 3ind h MET 400 Ca -0.31 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 3ind h MET 400 Cb 2.02 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.68 3ind h MET 400 CO 0.08 0.50 -0.04 0.93 1.06 0.00 0.00 176.91 179.44 3ind h GLU 401 N 0.00 0.00 0.00 1.72 5.08 0.08 -0.32 114.58 121.13 3ind h GLU 401 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3ind h GLU 401 Cb 0.99 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 3ind h GLU 401 CO 0.06 0.04 -0.06 0.78 -1.00 0.00 0.00 179.01 178.84 3ind h GLY 402 N 0.53 0.00 -2.23 -3.84 0.00 -1.77 -3.40 103.07 92.36 3ind h GLY 402 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 3ind h GLY 402 CO 0.01 0.00 -0.63 -1.36 0.00 0.00 0.00 176.54 174.55 3ind s PHE 403 N -3.33 1.79 -0.32 5.60 0.40 -0.13 -1.76 117.98 120.22 3ind s PHE 403 Ca 0.05 -0.93 -0.14 0.00 -0.60 0.00 0.00 56.93 55.31 3ind s PHE 403 Cb 0.07 -1.10 -0.03 0.00 0.51 0.00 0.00 43.02 42.47 3ind s PHE 403 CO 0.64 -0.01 0.29 -0.47 0.70 0.00 0.00 175.22 176.38 3ind s TYR 404 N -3.35 3.22 -0.25 0.36 5.04 0.29 -4.40 117.35 118.27 3ind s TYR 404 Ca 0.33 0.02 -0.06 0.00 -2.44 0.00 0.00 57.07 54.93 3ind s TYR 404 Cb 0.07 -2.54 -0.01 0.00 0.35 0.00 0.00 41.96 39.83 3ind s TYR 404 CO 0.13 -0.32 0.03 0.08 -1.34 0.00 0.00 175.55 174.12 3ind s VAL 405 N 1.89 3.88 -0.33 3.14 1.01 -0.86 -1.80 120.40 127.33 3ind s VAL 405 Ca 0.10 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 3ind s VAL 405 Cb -0.17 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 33.37 3ind s VAL 405 CO 0.11 0.32 0.20 -0.69 0.00 0.00 0.00 175.10 175.04 3ind s VAL 406 N 1.54 4.97 -1.18 2.92 1.01 0.51 -0.85 120.40 129.30 3ind s VAL 406 Ca 0.05 -0.33 -0.13 0.00 0.00 0.00 0.00 61.98 61.57 3ind s VAL 406 Cb -0.15 -3.55 0.19 0.00 0.00 0.00 0.00 36.38 32.87 3ind s VAL 406 CO 0.01 0.01 1.37 -0.36 0.00 0.00 0.00 175.10 176.13 3ind s PHE 407 N 1.67 3.65 -1.28 5.22 0.40 0.11 -0.59 117.98 127.16 3ind s PHE 407 Ca 0.05 -2.24 -0.18 0.00 -0.60 0.00 0.00 56.93 53.97 3ind s PHE 407 Cb -0.17 -4.22 0.08 0.00 0.51 0.00 0.00 43.02 39.22 3ind s PHE 407 CO 0.09 -1.31 1.69 0.34 0.70 0.00 0.00 175.22 176.73 3ind s ASP 408 N 2.54 6.86 0.29 1.36 -1.08 -0.28 -2.83 116.67 123.53 3ind s ASP 408 Ca 0.40 -2.49 0.03 0.00 -0.52 0.00 0.00 52.55 49.97 3ind s ASP 408 Cb -0.04 -2.56 0.45 0.00 -1.46 0.00 0.00 42.92 39.31 3ind s ASP 408 CO -0.02 -1.12 1.75 0.03 0.52 0.00 0.00 175.17 176.32 3ind h ARG 409 N 7.58 0.47 -0.00 4.34 3.08 -1.75 -1.29 114.38 126.81 3ind h ARG 409 Ca 0.43 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 3ind h ARG 409 Cb 0.87 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.89 3ind h ARG 409 CO 1.43 0.67 -0.06 0.00 -1.07 0.00 0.00 179.97 180.94 3ind h ALA 410 N 1.35 1.90 -0.11 0.04 0.00 -1.58 -2.61 119.26 118.24 3ind h ALA 410 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3ind h ALA 410 Cb 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3ind h ALA 410 CO 0.04 0.08 0.00 0.54 0.00 0.00 0.00 179.25 179.91 3ind n ARG 411 N -4.47 2.10 -4.03 0.00 1.74 -1.02 -5.01 116.66 105.97 3ind n ARG 411 Ca -0.03 -2.56 -0.38 0.00 -0.77 0.00 0.00 57.85 54.12 3ind n ARG 411 Cb 0.14 -1.57 -0.01 0.00 -1.02 0.00 0.00 32.46 30.01 3ind n ARG 411 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3ind n LYS 412 N -0.92 -0.99 -3.73 5.56 5.02 -0.58 -4.90 118.16 117.62 3ind n LYS 412 Ca 0.16 0.20 -0.10 0.00 -2.02 0.00 0.00 58.31 56.55 3ind n LYS 412 Cb 0.69 -3.32 -0.04 0.00 -0.02 0.00 0.00 35.03 32.33 3ind n LYS 412 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3ind s ARG 413 N -7.03 1.35 -0.09 1.97 1.70 -0.67 -1.49 118.95 114.69 3ind s ARG 413 Ca 0.32 -0.85 0.01 0.00 -0.47 0.00 0.00 55.73 54.74 3ind s ARG 413 Cb -0.16 0.52 0.02 0.00 -0.57 0.00 0.00 34.95 34.76 3ind s ARG 413 CO 0.95 -0.57 -0.09 0.42 -1.08 0.00 0.00 175.30 174.93 3ind s ILE 414 N -3.87 1.03 -0.00 4.99 1.01 0.44 -1.12 121.20 123.67 3ind s ILE 414 Ca 0.09 -0.34 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 3ind s ILE 414 Cb -0.01 -1.01 -0.05 0.00 0.01 0.00 0.00 42.46 41.40 3ind s ILE 414 CO -0.04 0.35 0.33 -0.83 0.00 0.00 0.00 174.94 174.75 3ind s GLY 415 N 1.32 2.34 -0.03 6.18 0.00 0.24 -0.84 107.32 116.53 3ind s GLY 415 Ca -0.02 -0.41 0.06 0.00 0.00 0.00 0.00 44.72 44.35 3ind s GLY 415 CO -0.04 -0.13 -0.21 -1.36 0.00 0.00 0.00 173.10 171.36 3ind s PHE 416 N -1.19 1.98 -0.01 1.90 0.08 0.10 -0.37 117.98 120.47 3ind s PHE 416 Ca 0.25 -0.44 -0.16 0.00 0.12 0.00 0.00 56.93 56.70 3ind s PHE 416 Cb -0.14 -1.28 0.03 0.00 -0.57 0.00 0.00 43.02 41.05 3ind s PHE 416 CO 0.13 -0.08 0.35 0.00 -0.10 0.00 0.00 175.22 175.52 3ind s ALA 417 N -0.37 -0.88 0.10 5.36 0.00 -0.75 -0.72 121.76 124.51 3ind s ALA 417 Ca 0.05 0.40 -0.34 0.00 0.00 0.00 0.00 51.96 52.06 3ind s ALA 417 Cb -0.10 0.09 -0.13 0.00 0.00 0.00 0.00 23.12 22.98 3ind s ALA 417 CO 0.00 -0.29 1.65 0.28 0.00 0.00 0.00 175.76 177.40 3ind n VAL 418 N 1.17 0.14 -2.69 0.00 0.31 -1.24 0.11 118.33 116.14 3ind n VAL 418 Ca -0.21 -0.03 -0.35 0.00 -0.01 0.00 0.00 64.34 63.74 3ind n VAL 418 Cb 0.56 -1.61 -0.05 0.00 -0.91 0.00 0.00 33.84 31.83 3ind n VAL 418 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3ind s SER 419 N 1.68 6.93 0.12 4.52 0.15 -0.72 -1.29 113.70 125.08 3ind s SER 419 Ca 0.82 1.87 0.20 0.00 0.70 0.00 0.00 55.95 59.55 3ind s SER 419 Cb -0.69 -2.57 0.83 0.00 -1.71 0.00 0.00 66.02 61.89 3ind s SER 419 CO 0.41 -0.37 1.62 0.00 1.20 0.00 0.00 173.24 176.11 3ind n ALA 420 N -0.15 1.76 0.07 5.45 0.00 -0.47 -3.22 120.51 123.94 3ind n ALA 420 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.51 3ind n ALA 420 Cb 0.51 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.65 3ind n ALA 420 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ind s HIS 422 N -0.46 2.43 -0.02 0.00 -0.00 -1.20 -4.93 115.29 111.13 3ind s HIS 422 Ca 0.04 1.39 -0.21 0.00 -0.00 0.00 0.00 55.06 56.28 3ind s HIS 422 Cb 0.03 -3.73 -0.05 0.00 -0.00 0.00 0.00 32.58 28.82 3ind s HIS 422 CO 0.04 -2.62 0.60 0.08 -0.00 0.00 0.00 174.74 172.84 3ind s VAL 423 N -1.33 4.93 0.07 -5.38 1.01 -1.26 -5.04 120.40 113.40 3ind s VAL 423 Ca 0.68 1.26 -0.26 0.00 0.00 0.00 0.00 61.98 63.66 3ind s VAL 423 Cb -0.39 -3.94 0.07 0.00 0.00 0.00 0.00 36.38 32.12 3ind s VAL 423 CO 0.46 0.39 0.64 -1.38 0.00 0.00 0.00 175.10 175.22 3ind s HIS 424 N -0.04 -0.58 0.00 5.22 -0.00 -1.26 -4.73 115.29 113.90 3ind s HIS 424 Ca 0.32 0.63 0.00 0.00 -0.00 0.00 0.00 55.06 56.01 3ind s HIS 424 Cb -0.18 0.50 0.00 0.00 -0.00 0.00 0.00 32.58 32.90 3ind s HIS 424 CO 0.17 -0.75 0.00 -0.40 -0.00 0.00 0.00 174.74 173.76 3ind n ASP 425 N 0.12 0.00 -1.53 7.38 3.85 -1.23 -5.01 116.55 120.13 3ind n ASP 425 Ca -0.17 0.00 -0.05 0.00 -0.71 0.00 0.00 54.79 53.86 3ind n ASP 425 Cb 0.62 0.00 0.25 0.00 -1.35 0.00 0.00 41.12 40.64 3ind n ASP 425 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3ind n GLU 426 N 0.00 2.79 0.00 0.11 -0.58 -1.26 -4.39 120.64 117.31 3ind n GLU 426 Ca 0.00 -3.05 0.00 0.00 -0.42 0.00 0.00 57.16 53.69 3ind n GLU 426 Cb 0.00 -2.01 0.00 0.00 -0.57 0.00 0.00 31.44 28.86 3ind n GLU 426 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 3ind n PHE 427 N -0.66 0.00 -4.12 -0.32 3.01 -1.26 -5.12 117.46 108.99 3ind n PHE 427 Ca 0.37 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.74 3ind n PHE 427 Cb 1.21 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 40.59 3ind n PHE 427 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3ind s ARG 428 N -0.93 0.81 -0.07 -1.08 0.52 -1.26 -5.17 118.95 111.78 3ind s ARG 428 Ca 0.00 -1.34 -0.17 0.00 -0.52 0.00 0.00 55.73 53.69 3ind s ARG 428 Cb 0.00 0.24 0.04 0.00 0.52 0.00 0.00 34.95 35.74 3ind s ARG 428 CO 0.00 -0.21 0.40 0.95 0.02 0.00 0.00 175.30 176.47 3ind s THR 429 N -4.00 0.03 0.52 0.02 -4.23 -1.26 -3.51 115.64 103.21 3ind s THR 429 Ca 0.17 -0.25 -0.21 0.00 -1.18 0.00 0.00 61.69 60.23 3ind s THR 429 Cb 0.08 -0.67 -0.08 0.00 1.34 0.00 0.00 72.50 73.17 3ind s THR 429 CO -0.03 -0.14 0.93 0.00 -0.54 0.00 0.00 174.62 174.84 3ind n ALA 430 N 1.73 0.02 -2.95 3.99 0.00 -1.26 -4.91 120.51 117.14 3ind n ALA 430 Ca -0.18 0.09 -0.10 0.00 0.00 0.00 0.00 53.44 53.25 3ind n ALA 430 Cb 0.56 -2.06 -0.10 0.00 0.00 0.00 0.00 19.45 17.85 3ind n ALA 430 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ind s ALA 431 N -1.45 -0.13 -0.19 0.00 0.00 -0.51 -4.95 121.76 114.54 3ind s ALA 431 Ca 0.70 -0.38 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 3ind s ALA 431 Cb -0.47 0.16 0.05 0.00 0.00 0.00 0.00 23.12 22.86 3ind s ALA 431 CO 0.52 -0.23 -0.06 0.08 0.00 0.00 0.00 175.76 176.08 3ind s VAL 432 N -1.78 1.28 -0.02 0.00 1.01 -1.26 0.18 120.40 119.81 3ind s VAL 432 Ca -0.12 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.02 3ind s VAL 432 Cb -0.06 -1.48 0.01 0.00 0.00 0.00 0.00 36.38 34.84 3ind s VAL 432 CO -0.01 0.05 -0.03 -1.61 0.00 0.00 0.00 175.10 173.50 3ind s GLU 433 N 1.54 0.42 0.23 2.72 2.02 -0.19 -4.86 118.70 120.59 3ind s GLU 433 Ca -0.01 -0.09 -0.22 0.00 0.02 0.00 0.00 54.97 54.66 3ind s GLU 433 Cb -0.16 -0.46 0.04 0.00 0.10 0.00 0.00 34.13 33.65 3ind s GLU 433 CO -0.07 0.01 0.75 0.20 0.02 0.00 0.00 175.26 176.17 3ind s GLY 434 N 0.34 -0.21 0.60 -1.39 0.00 -1.26 -0.33 107.32 105.06 3ind s GLY 434 Ca -0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 44.72 44.61 3ind s GLY 434 CO -0.00 -0.02 0.86 2.56 0.00 0.00 0.00 173.10 176.50 3ind s PRO 435 N -3.75 2.44 -0.05 2.90 0.05 -1.26 -5.08 135.00 130.25 3ind s PRO 435 Ca 0.09 -0.57 -0.00 0.00 0.05 0.00 0.00 61.00 60.57 3ind s PRO 435 Cb -0.04 -2.37 0.03 0.00 0.05 0.00 0.00 34.50 32.16 3ind s PRO 435 CO 0.02 -0.89 -0.01 -0.06 0.05 0.00 0.00 177.00 176.12 3ind s PHE 436 N -2.93 0.51 0.38 0.56 0.40 0.45 -4.95 117.98 112.39 3ind s PHE 436 Ca 0.58 -0.08 -0.04 0.00 -0.60 0.00 0.00 56.93 56.79 3ind s PHE 436 Cb -0.10 -0.60 -0.04 0.00 0.51 0.00 0.00 43.02 42.78 3ind s PHE 436 CO 0.41 -0.21 0.64 0.08 0.70 0.00 0.00 175.22 176.84 3ind s VAL 437 N 1.40 5.00 0.27 -0.44 1.01 -1.26 -0.95 120.40 125.42 3ind s VAL 437 Ca -0.04 -0.03 0.05 0.00 0.00 0.00 0.00 61.98 61.96 3ind s VAL 437 Cb -0.13 -3.82 -0.06 0.00 0.00 0.00 0.00 36.38 32.37 3ind s VAL 437 CO -0.03 -0.58 -0.02 0.42 0.00 0.00 0.00 175.10 174.90 3ind s THR 438 N -2.39 1.34 -2.13 3.92 -4.23 -0.25 -4.95 115.64 106.94 3ind s THR 438 Ca 0.44 -2.06 0.26 0.00 -1.18 0.00 0.00 61.69 59.14 3ind s THR 438 Cb -0.10 -2.48 0.25 0.00 1.34 0.00 0.00 72.50 71.51 3ind s THR 438 CO 0.37 -0.25 1.45 0.00 -0.54 0.00 0.00 174.62 175.65 3ind n LEU 439 N -0.55 1.61 0.00 4.79 -0.00 -1.26 -4.89 117.00 116.70 3ind n LEU 439 Ca -0.05 -0.52 0.00 0.00 -0.00 0.00 0.00 56.01 55.44 3ind n LEU 439 Cb 0.64 -0.05 0.00 0.00 -0.00 0.00 0.00 43.42 44.01 3ind n LEU 439 CO 0.39 0.29 0.00 -0.90 -0.00 0.00 0.00 177.39 177.17 3ind n ASP 443 N -0.08 -0.00 0.12 1.45 5.75 -1.26 -5.15 116.55 117.38 3ind n ASP 443 Ca 0.13 0.00 0.12 0.00 -0.01 0.00 0.00 54.79 55.03 3ind n ASP 443 Cb 0.41 -0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.61 3ind n ASP 443 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ind s GLY 445 N -4.10 2.44 -0.80 0.00 0.00 -1.26 -3.91 107.32 99.69 3ind s GLY 445 Ca 0.04 0.75 -0.04 0.00 0.00 0.00 0.00 44.72 45.46 3ind s GLY 445 CO 0.73 1.11 0.67 -0.47 0.00 0.00 0.00 173.10 175.15 3ind s TYR 446 N -1.98 3.71 0.72 1.90 5.04 -1.26 -4.94 117.35 120.54 3ind s TYR 446 Ca 0.71 -2.76 -0.14 0.00 -2.44 0.00 0.00 57.07 52.44 3ind s TYR 446 Cb -0.24 -3.34 -0.12 0.00 0.35 0.00 0.00 41.96 38.62 3ind s TYR 446 CO 0.35 -0.82 -0.72 0.09 -1.34 0.00 0.00 175.55 173.10 3ind n ASN 447 N 3.00 -3.77 0.00 4.32 4.13 -1.26 -4.87 115.26 116.81 3ind n ASN 447 Ca 0.16 0.10 0.00 0.00 1.68 0.00 0.00 54.58 56.51 3ind n ASN 447 Cb 0.39 -0.50 0.00 0.00 -1.54 0.00 0.00 39.78 38.13 3ind n ASN 447 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16