#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2foo n SER 64 N 0.00 0.43 -0.28 3.42 3.41 -1.26 -1.59 113.62 117.74 2foo n SER 64 Ca 0.00 0.64 0.14 0.00 -0.26 0.00 0.00 58.87 59.39 2foo n SER 64 Cb 0.00 -0.72 0.64 0.00 -0.26 0.00 0.00 64.21 63.87 2foo n SER 64 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2foo n TRP 65 N -2.01 0.00 -1.43 7.33 7.02 -1.26 0.88 117.44 127.97 2foo n TRP 65 Ca 0.01 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.09 2foo n TRP 65 Cb 0.13 -0.04 0.02 0.00 -2.42 0.00 0.00 31.31 29.00 2foo n TRP 65 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 2foo n ARG 66 N -0.37 0.47 0.00 -0.99 1.85 -0.62 -3.99 116.66 113.00 2foo n ARG 66 Ca 0.19 0.18 0.13 0.00 -1.00 0.00 0.00 57.85 57.34 2foo n ARG 66 Cb 0.28 -1.51 0.34 0.00 -1.05 0.00 0.00 32.46 30.52 2foo n ARG 66 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2foo n SER 67 N 1.17 0.93 -3.56 2.89 3.41 -1.26 -0.11 113.62 117.08 2foo n SER 67 Ca 0.11 -0.76 -0.09 0.00 -0.26 0.00 0.00 58.87 57.87 2foo n SER 67 Cb 0.43 0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 2foo n SER 67 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2foo s GLU 68 N -2.61 1.26 -0.10 4.33 -1.05 -1.26 -1.61 118.70 117.65 2foo s GLU 68 Ca 0.21 -0.55 -0.33 0.00 -0.15 0.00 0.00 54.97 54.15 2foo s GLU 68 Cb 0.19 0.52 0.12 0.00 -0.44 0.00 0.00 34.13 34.53 2foo s GLU 68 CO 0.56 -0.56 1.16 0.00 0.95 0.00 0.00 175.26 177.37 2foo s ALA 69 N -3.58 -2.04 -0.09 -0.84 0.00 -0.92 -5.02 121.76 109.26 2foo s ALA 69 Ca 0.05 1.23 0.03 0.00 0.00 0.00 0.00 51.96 53.27 2foo s ALA 69 Cb -0.02 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.22 2foo s ALA 69 CO -0.06 -0.73 -0.18 0.99 0.00 0.00 0.00 175.76 175.77 2foo s THR 70 N -2.59 1.66 0.06 0.00 2.01 -1.26 -1.87 115.64 113.65 2foo s THR 70 Ca 0.10 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.31 2foo s THR 70 Cb 0.00 -1.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 2foo s THR 70 CO -0.05 0.47 -0.02 0.72 -0.69 0.00 0.00 174.62 175.06 2foo s PHE 71 N 0.60 0.55 0.13 4.92 -0.71 -0.80 -5.00 117.98 117.67 2foo s PHE 71 Ca -0.14 -1.08 0.04 0.00 -1.04 0.00 0.00 56.93 54.71 2foo s PHE 71 Cb -0.17 -0.39 -0.04 0.00 -1.21 0.00 0.00 43.02 41.21 2foo s PHE 71 CO 0.04 -0.40 -0.10 -0.65 -1.34 0.00 0.00 175.22 172.77 2foo s GLN 72 N -3.93 1.00 -0.10 1.99 -0.21 -1.26 -1.51 119.66 115.63 2foo s GLN 72 Ca 0.09 -1.36 -0.03 0.00 0.02 0.00 0.00 55.36 54.08 2foo s GLN 72 Cb 0.08 -0.61 0.05 0.00 1.00 0.00 0.00 33.01 33.53 2foo s GLN 72 CO -0.09 0.08 0.16 0.12 -2.12 0.00 0.00 175.29 173.44 2foo s PHE 73 N -3.02 -0.15 -0.27 0.91 5.36 -0.24 -4.99 117.98 115.59 2foo s PHE 73 Ca 0.13 0.46 -0.15 0.00 -0.96 0.00 0.00 56.93 56.42 2foo s PHE 73 Cb 0.01 -0.32 -0.04 0.00 -0.34 0.00 0.00 43.02 42.33 2foo s PHE 73 CO 0.00 -0.33 0.37 0.99 -1.46 0.00 0.00 175.22 174.80 2foo s THR 74 N 2.28 5.18 -0.21 0.12 2.01 -1.26 -1.55 115.64 122.20 2foo s THR 74 Ca 0.04 0.56 -0.19 0.00 0.31 0.00 0.00 61.69 62.41 2foo s THR 74 Cb -0.13 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 2foo s THR 74 CO -0.07 0.16 0.55 -0.69 -0.69 0.00 0.00 174.62 173.88 2foo s VAL 75 N 2.06 5.08 0.34 3.82 1.01 -0.12 -4.91 120.40 127.67 2foo s VAL 75 Ca 0.15 1.00 0.00 0.00 0.00 0.00 0.00 61.98 63.13 2foo s VAL 75 Cb -0.16 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 2foo s VAL 75 CO 0.10 0.14 0.54 -1.61 0.00 0.00 0.00 175.10 174.28 2foo s GLU 76 N 1.83 3.49 -1.52 2.72 2.02 -1.26 -1.85 118.70 124.13 2foo s GLU 76 Ca 0.25 -0.32 -0.14 0.00 0.02 0.00 0.00 54.97 54.78 2foo s GLU 76 Cb -0.16 -2.67 0.10 0.00 0.10 0.00 0.00 34.13 31.51 2foo s GLU 76 CO 0.10 0.16 0.80 0.54 0.02 0.00 0.00 175.26 176.88 2foo n ARG 77 N -1.70 -4.42 -0.17 1.61 1.74 -0.35 -4.84 116.66 108.52 2foo n ARG 77 Ca -0.05 0.53 -0.02 0.00 -0.77 0.00 0.00 57.85 57.54 2foo n ARG 77 Cb 0.56 -5.34 0.05 0.00 -1.02 0.00 0.00 32.46 26.71 2foo n ARG 77 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2foo h PHE 78 N -1.64 -0.23 -0.11 -1.55 3.57 -1.09 -0.58 116.94 115.31 2foo h PHE 78 Ca -0.54 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.03 2foo h PHE 78 Cb 1.36 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 40.27 2foo h PHE 78 CO 0.61 -0.21 0.30 0.66 -2.23 0.00 0.00 178.31 177.44 2foo h SER 79 N 0.02 0.00 -0.51 0.41 4.64 -1.89 0.99 113.55 117.22 2foo h SER 79 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2foo h SER 79 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2foo h SER 79 CO -0.52 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 175.98 2foo n ARG 80 N -3.21 2.57 -1.69 4.77 1.74 -0.24 -4.93 116.66 115.67 2foo n ARG 80 Ca 0.00 -2.38 -0.44 0.00 -0.77 0.00 0.00 57.85 54.26 2foo n ARG 80 Cb 0.38 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.29 2foo n ARG 80 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2foo n LEU 81 N 1.42 3.51 0.00 0.55 7.94 0.34 -4.86 117.00 125.90 2foo n LEU 81 Ca 0.20 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.17 2foo n LEU 81 Cb 0.58 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 43.04 2foo n LEU 81 CO 0.15 -0.07 -0.17 -1.54 -1.11 0.00 0.00 177.39 174.65 2foo n SER 82 N 3.88 1.66 -4.44 1.96 3.41 -1.26 -4.81 113.62 114.02 2foo n SER 82 Ca 0.17 -0.03 -0.26 0.00 -0.26 0.00 0.00 58.87 58.49 2foo n SER 82 Cb 0.32 0.39 -0.09 0.00 -0.26 0.00 0.00 64.21 64.57 2foo n SER 82 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2foo s GLU 83 N -0.72 1.88 0.28 4.33 0.41 -1.26 -4.88 118.70 118.73 2foo s GLU 83 Ca 0.00 -2.11 -0.25 0.00 -0.41 0.00 0.00 54.97 52.20 2foo s GLU 83 Cb 0.00 -1.03 -0.09 0.00 -1.78 0.00 0.00 34.13 31.23 2foo s GLU 83 CO 0.00 -0.28 0.87 -1.54 -0.49 0.00 0.00 175.26 173.82 2foo s SER 84 N -3.63 7.30 0.08 -0.19 1.04 -1.26 -4.63 113.70 112.41 2foo s SER 84 Ca 0.27 1.72 0.09 0.00 0.48 0.00 0.00 55.95 58.51 2foo s SER 84 Cb 0.06 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.61 2foo s SER 84 CO 0.13 -0.00 -0.21 0.68 0.98 0.00 0.00 173.24 174.82 2foo s VAL 85 N -1.52 2.58 -0.02 5.02 -7.23 -0.08 -4.98 120.40 114.17 2foo s VAL 85 Ca 0.46 -1.42 0.07 0.00 -1.81 0.00 0.00 61.98 59.29 2foo s VAL 85 Cb -0.19 -2.11 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 2foo s VAL 85 CO 0.24 0.24 -0.22 -0.22 -0.31 0.00 0.00 175.10 174.82 2foo s LEU 86 N -1.70 2.04 0.59 1.32 2.96 -1.26 -1.89 118.68 120.75 2foo s LEU 86 Ca 0.15 -0.40 -0.05 0.00 -0.22 0.00 0.00 54.13 53.61 2foo s LEU 86 Cb -0.10 -1.14 0.02 0.00 0.50 0.00 0.00 46.19 45.47 2foo s LEU 86 CO 0.06 0.27 0.89 -0.94 -1.32 0.00 0.00 176.35 175.31 2foo s SER 87 N -0.53 5.45 0.93 3.68 1.04 -0.81 -4.99 113.70 118.47 2foo s SER 87 Ca 0.09 0.57 -0.12 0.00 0.48 0.00 0.00 55.95 56.97 2foo s SER 87 Cb -0.09 -1.51 0.15 0.00 0.10 0.00 0.00 66.02 64.67 2foo s SER 87 CO -0.01 -1.13 1.09 -2.84 0.98 0.00 0.00 173.24 171.33 2foo s PRO 88 N -4.98 0.94 0.44 4.02 0.02 -1.26 -4.64 135.00 129.54 2foo s PRO 88 Ca 0.55 0.87 -0.22 0.00 0.02 0.00 0.00 61.00 62.22 2foo s PRO 88 Cb -0.10 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.56 2foo s PRO 88 CO 0.44 -2.47 1.03 -1.25 -0.33 0.00 0.00 177.00 174.41 2foo s PRO 89 N -4.85 4.03 -0.18 5.54 0.04 -1.26 -4.71 135.00 133.60 2foo s PRO 89 Ca 0.64 1.39 0.01 0.00 0.04 0.00 0.00 61.00 63.08 2foo s PRO 89 Cb -0.19 -2.30 0.03 0.00 0.04 0.00 0.00 34.50 32.07 2foo s PRO 89 CO 0.58 -0.24 -0.15 0.00 0.04 0.00 0.00 177.00 177.22 2foo s PHE 91 N 1.36 3.58 -0.02 0.00 0.40 -1.26 -1.51 117.98 120.53 2foo s PHE 91 Ca 0.03 1.49 -0.00 0.00 -0.60 0.00 0.00 56.93 57.84 2foo s PHE 91 Cb -0.14 -3.03 0.02 0.00 0.51 0.00 0.00 43.02 40.38 2foo s PHE 91 CO -0.11 -0.05 0.03 0.08 0.70 0.00 0.00 175.22 175.88 2foo s VAL 92 N 1.27 -0.04 -1.29 -0.44 1.01 -0.83 -4.74 120.40 115.34 2foo s VAL 92 Ca 0.45 0.13 -0.08 0.00 0.00 0.00 0.00 61.98 62.49 2foo s VAL 92 Cb -0.19 -0.07 0.05 0.00 0.00 0.00 0.00 36.38 36.17 2foo s VAL 92 CO 0.21 0.05 0.45 0.54 0.00 0.00 0.00 175.10 176.36 2foo n ARG 93 N 3.76 -3.50 -1.70 2.72 5.12 0.85 -0.44 116.66 123.47 2foo n ARG 93 Ca -0.22 0.55 -0.19 0.00 -1.93 0.00 0.00 57.85 56.06 2foo n ARG 93 Cb 0.54 -5.27 -0.07 0.00 -1.16 0.00 0.00 32.46 26.50 2foo n ARG 93 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2foo n ASN 94 N -2.27 -5.17 -4.47 0.55 4.05 0.25 -4.85 115.26 103.35 2foo n ASN 94 Ca -0.05 0.40 -0.30 0.00 0.45 0.00 0.00 54.58 55.09 2foo n ASN 94 Cb 0.56 -4.55 -0.12 0.00 1.23 0.00 0.00 39.78 36.90 2foo n ASN 94 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2foo s LEU 95 N -4.80 2.65 -0.34 1.20 1.43 0.42 -5.05 118.68 114.20 2foo s LEU 95 Ca 0.00 -0.52 -0.28 0.00 -1.03 0.00 0.00 54.13 52.30 2foo s LEU 95 Cb 0.00 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.71 2foo s LEU 95 CO 0.00 0.20 1.02 -2.16 0.23 0.00 0.00 176.35 175.64 2foo s PRO 96 N -1.89 3.99 -0.06 1.29 0.04 -1.26 -1.96 135.00 135.14 2foo s PRO 96 Ca 0.17 0.89 -0.01 0.00 0.04 0.00 0.00 61.00 62.09 2foo s PRO 96 Cb -0.11 -3.76 -0.03 0.00 0.04 0.00 0.00 34.50 30.64 2foo s PRO 96 CO 0.08 -0.91 -0.00 -1.58 0.04 0.00 0.00 177.00 174.63 2foo s TRP 97 N 3.58 3.12 0.03 0.56 0.52 -0.57 -1.44 118.94 124.74 2foo s TRP 97 Ca 0.43 0.15 0.01 0.00 0.02 0.00 0.00 56.10 56.70 2foo s TRP 97 Cb -0.12 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.43 2foo s TRP 97 CO 0.17 0.46 -0.05 0.15 0.02 0.00 0.00 176.95 177.70 2foo s LYS 98 N -1.06 0.40 0.03 4.98 1.02 -0.15 -1.09 119.74 123.88 2foo s LYS 98 Ca 0.15 -0.70 -0.20 0.00 0.02 0.00 0.00 55.97 55.23 2foo s LYS 98 Cb -0.11 -0.01 -0.06 0.00 -0.52 0.00 0.00 37.83 37.12 2foo s LYS 98 CO 0.04 -0.02 0.60 0.42 -0.92 0.00 0.00 175.35 175.47 2foo s ILE 99 N -1.61 4.82 -0.11 2.17 1.01 -1.26 -0.60 121.20 125.62 2foo s ILE 99 Ca -0.12 1.27 0.02 0.00 0.00 0.00 0.00 60.65 61.81 2foo s ILE 99 Cb -0.09 -3.94 0.01 0.00 0.01 0.00 0.00 42.46 38.46 2foo s ILE 99 CO -0.01 0.47 -0.16 -0.32 0.00 0.00 0.00 174.94 174.92 2foo s MET 100 N -0.56 2.31 0.01 2.79 1.75 0.68 -1.92 119.30 124.36 2foo s MET 100 Ca 0.31 -0.60 0.06 0.00 -1.25 0.00 0.00 55.69 54.22 2foo s MET 100 Cb -0.19 -1.94 -0.02 0.00 2.84 0.00 0.00 34.83 35.53 2foo s MET 100 CO 0.18 -0.04 -0.20 0.08 -0.65 0.00 0.00 175.02 174.40 2foo s VAL 101 N 0.93 1.55 -0.17 10.11 1.01 -0.79 0.23 120.40 133.28 2foo s VAL 101 Ca -0.08 -0.97 -0.28 0.00 0.00 0.00 0.00 61.98 60.65 2foo s VAL 101 Cb -0.15 -1.32 0.09 0.00 0.00 0.00 0.00 36.38 35.00 2foo s VAL 101 CO -0.01 0.33 0.79 0.00 0.00 0.00 0.00 175.10 176.21 2foo s MET 102 N -0.75 0.85 0.26 2.72 0.23 0.15 -0.90 119.30 121.86 2foo s MET 102 Ca 0.07 0.51 -0.30 0.00 -1.03 0.00 0.00 55.69 54.95 2foo s MET 102 Cb -0.08 0.40 -0.09 0.00 -1.53 0.00 0.00 34.83 33.53 2foo s MET 102 CO 0.00 -0.20 1.06 -1.25 -2.03 0.00 0.00 175.02 172.60 2foo s PRO 103 N -0.51 4.69 0.20 3.16 0.04 -1.26 0.14 135.00 141.46 2foo s PRO 103 Ca -0.04 1.73 0.03 0.00 0.04 0.00 0.00 61.00 62.75 2foo s PRO 103 Cb -0.02 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.25 2foo s PRO 103 CO 0.04 0.27 -0.00 1.03 0.04 0.00 0.00 177.00 178.38 2foo s ARG 104 N -1.31 1.23 -0.25 4.56 1.81 -0.09 -4.82 118.95 120.08 2foo s ARG 104 Ca 0.44 -1.61 -0.03 0.00 -1.72 0.00 0.00 55.73 52.81 2foo s ARG 104 Cb -0.30 -0.45 0.08 0.00 -0.45 0.00 0.00 34.95 33.82 2foo s ARG 104 CO 0.39 -0.11 0.08 -0.06 -0.68 0.00 0.00 175.30 174.92 2foo s PHE 105 N -3.53 0.90 0.00 -0.53 0.40 -1.26 -1.42 117.98 112.54 2foo s PHE 105 Ca 0.26 -1.01 0.00 0.00 -0.60 0.00 0.00 56.93 55.58 2foo s PHE 105 Cb 0.06 -1.12 0.00 0.00 0.51 0.00 0.00 43.02 42.46 2foo s PHE 105 CO 0.06 -0.72 0.00 1.04 0.70 0.00 0.00 175.22 176.30 2foo n GLN 112 N 5.08 0.00 0.00 0.44 6.02 -1.26 -5.06 117.38 122.60 2foo n GLN 112 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 2foo n GLN 112 Cb 0.45 -0.23 0.00 0.00 1.02 0.00 0.00 30.24 31.48 2foo n GLN 112 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2foo n LYS 113 N -0.71 0.00 -4.18 -1.09 3.00 -1.26 -4.83 118.16 109.08 2foo n LYS 113 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.31 58.20 2foo n LYS 113 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 34.93 2foo n LYS 113 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2foo s SER 114 N -4.00 0.58 -0.24 3.14 1.04 -0.51 0.11 113.70 113.82 2foo s SER 114 Ca 0.00 -1.21 -0.13 0.00 0.48 0.00 0.00 55.95 55.09 2foo s SER 114 Cb 0.00 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 2foo s SER 114 CO 0.00 -0.69 0.26 -0.69 0.98 0.00 0.00 173.24 173.10 2foo s VAL 115 N -3.94 5.28 -0.17 5.02 1.01 0.03 -0.91 120.40 126.71 2foo s VAL 115 Ca 0.25 0.38 -0.19 0.00 0.00 0.00 0.00 61.98 62.43 2foo s VAL 115 Cb 0.07 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 2foo s VAL 115 CO 0.03 0.27 0.53 -0.83 0.00 0.00 0.00 175.10 175.10 2foo s GLY 116 N 1.30 2.18 -0.18 4.51 0.00 0.37 -1.50 107.32 114.00 2foo s GLY 116 Ca 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 44.72 44.51 2foo s GLY 116 CO 0.08 1.03 0.01 -0.12 0.00 0.00 0.00 173.10 174.09 2foo s PHE 117 N 1.37 1.24 0.17 1.90 2.19 -0.85 -0.68 117.98 123.32 2foo s PHE 117 Ca 0.26 -0.92 0.06 0.00 0.33 0.00 0.00 56.93 56.66 2foo s PHE 117 Cb -0.15 -1.11 -0.04 0.00 -1.31 0.00 0.00 43.02 40.41 2foo s PHE 117 CO 0.10 -0.60 -0.13 -0.06 1.83 0.00 0.00 175.22 176.36 2foo s PHE 118 N 1.79 1.53 -0.15 10.12 0.40 0.14 -1.93 117.98 129.86 2foo s PHE 118 Ca -0.01 -0.62 -0.02 0.00 -0.60 0.00 0.00 56.93 55.68 2foo s PHE 118 Cb -0.16 -0.74 -0.01 0.00 0.51 0.00 0.00 43.02 42.61 2foo s PHE 118 CO -0.07 0.24 -0.10 -1.17 0.70 0.00 0.00 175.22 174.82 2foo s LEU 119 N -3.11 2.83 0.02 -0.37 2.96 0.13 -0.23 118.68 120.91 2foo s LEU 119 Ca 0.18 -0.31 0.06 0.00 -0.22 0.00 0.00 54.13 53.84 2foo s LEU 119 Cb -0.01 -1.67 -0.03 0.00 0.50 0.00 0.00 46.19 44.99 2foo s LEU 119 CO 0.04 0.12 -0.15 -1.58 -1.32 0.00 0.00 176.35 173.47 2foo s GLN 120 N 0.61 2.23 -0.07 1.98 0.74 0.23 -0.56 119.66 124.82 2foo s GLN 120 Ca -0.06 -0.89 0.01 0.00 0.05 0.00 0.00 55.36 54.47 2foo s GLN 120 Cb -0.15 -2.28 0.02 0.00 1.10 0.00 0.00 33.01 31.70 2foo s GLN 120 CO 0.03 0.56 -0.07 0.00 -0.55 0.00 0.00 175.29 175.26 2foo n ASN 122 N 4.37 -3.71 0.03 0.00 4.05 -0.52 -4.81 115.26 114.67 2foo n ASN 122 Ca -0.19 -0.96 -0.04 0.00 0.45 0.00 0.00 54.58 53.85 2foo n ASN 122 Cb 0.51 -3.02 0.19 0.00 1.23 0.00 0.00 39.78 38.69 2foo n ASN 122 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2foo h ALA 123 N 0.93 1.06 -0.37 5.20 0.00 -1.87 -3.20 119.26 121.02 2foo h ALA 123 Ca -0.59 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 53.85 2foo h ALA 123 Cb 1.38 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2foo h ALA 123 CO 0.76 0.58 -0.18 0.93 0.00 0.00 0.00 179.25 181.34 2foo h GLU 124 N 0.38 0.69 -6.61 0.00 3.07 -1.95 -3.45 114.58 106.70 2foo h GLU 124 Ca 0.05 -0.25 -0.59 0.00 -0.50 0.00 0.00 59.36 58.07 2foo h GLU 124 Cb 0.74 -0.05 0.10 0.00 -0.84 0.00 0.00 28.75 28.70 2foo h GLU 124 CO 0.06 0.82 0.47 0.45 -1.40 0.00 0.00 179.01 179.41 2foo n SER 125 N -4.14 2.41 -0.57 1.42 2.88 -1.21 -4.88 113.62 109.53 2foo n SER 125 Ca 0.01 1.17 0.10 0.00 -1.33 0.00 0.00 58.87 58.82 2foo n SER 125 Cb 0.39 -1.41 0.37 0.00 -0.75 0.00 0.00 64.21 62.81 2foo n SER 125 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2foo n ASP 126 N 1.50 1.71 -4.79 -3.46 5.75 -1.26 -4.90 116.55 111.10 2foo n ASP 126 Ca 0.09 -1.72 -0.36 0.00 -0.01 0.00 0.00 54.79 52.79 2foo n ASP 126 Cb 0.33 -0.11 -0.03 0.00 -1.03 0.00 0.00 41.12 40.28 2foo n ASP 126 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2foo s SER 127 N -1.55 6.44 -0.06 -1.12 0.15 -1.26 -4.95 113.70 111.35 2foo s SER 127 Ca 0.32 2.05 0.09 0.00 0.70 0.00 0.00 55.95 59.11 2foo s SER 127 Cb 0.17 -2.58 0.14 0.00 -1.71 0.00 0.00 66.02 62.04 2foo s SER 127 CO 0.26 -0.71 1.02 0.35 1.20 0.00 0.00 173.24 175.36 2foo n THR 128 N -0.54 1.15 0.43 6.45 -2.24 -1.26 -4.69 114.28 113.58 2foo n THR 128 Ca 0.07 -1.33 0.07 0.00 -2.27 0.00 0.00 64.05 60.59 2foo n THR 128 Cb 0.50 0.20 -0.09 0.00 -2.10 0.00 0.00 70.33 68.84 2foo n THR 128 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2foo n SER 129 N -0.81 1.02 -4.86 3.42 3.41 -1.26 -4.87 113.62 109.67 2foo n SER 129 Ca 0.08 -0.54 -0.31 0.00 -0.26 0.00 0.00 58.87 57.83 2foo n SER 129 Cb 0.53 1.24 -0.01 0.00 -0.26 0.00 0.00 64.21 65.71 2foo n SER 129 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 2foo s TRP 130 N -2.58 3.54 -0.20 7.33 1.48 -1.24 -4.19 118.94 123.08 2foo s TRP 130 Ca 0.02 1.37 -0.27 0.00 -1.06 0.00 0.00 56.10 56.15 2foo s TRP 130 Cb 0.10 -2.76 0.09 0.00 -1.16 0.00 0.00 33.47 29.74 2foo s TRP 130 CO 0.59 -0.58 0.79 -1.54 -4.06 0.00 0.00 176.95 172.16 2foo s SER 131 N -3.70 -0.63 -0.20 -2.66 1.04 -0.61 -4.29 113.70 102.64 2foo s SER 131 Ca 0.57 1.05 -0.08 0.00 0.48 0.00 0.00 55.95 57.97 2foo s SER 131 Cb -0.11 1.01 0.09 0.00 0.10 0.00 0.00 66.02 67.10 2foo s SER 131 CO 0.45 -0.33 0.43 0.00 0.98 0.00 0.00 173.24 174.77 2foo s HIS 133 N 2.34 3.61 0.05 0.00 2.46 -1.26 -0.87 115.29 121.62 2foo s HIS 133 Ca -0.04 0.95 -0.11 0.00 0.47 0.00 0.00 55.06 56.33 2foo s HIS 133 Cb -0.11 -2.45 0.01 0.00 -0.13 0.00 0.00 32.58 29.90 2foo s HIS 133 CO -0.13 0.38 0.24 0.00 -2.47 0.00 0.00 174.74 172.76 2foo s ALA 134 N -0.14 -0.49 0.18 1.58 0.00 -0.66 -1.01 121.76 121.23 2foo s ALA 134 Ca 0.25 -0.20 0.11 0.00 0.00 0.00 0.00 51.96 52.12 2foo s ALA 134 Cb -0.16 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.25 2foo s ALA 134 CO 0.12 -0.41 -0.22 -0.65 0.00 0.00 0.00 175.76 174.60 2foo s GLN 135 N -2.77 1.59 0.09 0.00 -0.21 0.00 -1.45 119.66 116.91 2foo s GLN 135 Ca -0.03 -1.47 -0.26 0.00 0.02 0.00 0.00 55.36 53.62 2foo s GLN 135 Cb -0.00 -1.90 0.08 0.00 1.00 0.00 0.00 33.01 32.19 2foo s GLN 135 CO -0.05 0.41 0.70 0.00 -2.12 0.00 0.00 175.29 174.23 2foo s ALA 136 N -1.62 -1.69 -0.22 6.09 0.00 -0.23 -0.35 121.76 123.75 2foo s ALA 136 Ca 0.21 0.75 -0.03 0.00 0.00 0.00 0.00 51.96 52.88 2foo s ALA 136 Cb -0.08 0.62 -0.00 0.00 0.00 0.00 0.00 23.12 23.66 2foo s ALA 136 CO 0.10 -0.69 -0.06 0.08 0.00 0.00 0.00 175.76 175.19 2foo s VAL 137 N -3.24 3.19 -0.27 0.00 1.01 0.86 -1.02 120.40 120.94 2foo s VAL 137 Ca 0.01 -0.58 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 2foo s VAL 137 Cb -0.01 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 2foo s VAL 137 CO -0.09 0.42 0.21 -0.76 0.00 0.00 0.00 175.10 174.88 2foo s LEU 138 N 1.45 4.05 -0.01 3.92 1.02 0.25 -1.40 118.68 127.96 2foo s LEU 138 Ca 0.05 0.07 0.03 0.00 0.02 0.00 0.00 54.13 54.30 2foo s LEU 138 Cb -0.14 -2.16 -0.01 0.00 0.02 0.00 0.00 46.19 43.90 2foo s LEU 138 CO -0.04 -0.04 -0.09 -0.75 0.02 0.00 0.00 176.35 175.45 2foo s LYS 139 N 1.61 0.75 -0.37 1.70 2.20 0.63 -1.25 119.74 125.02 2foo s LYS 139 Ca 0.08 -0.32 -0.11 0.00 -0.36 0.00 0.00 55.97 55.26 2foo s LYS 139 Cb -0.15 -0.73 0.02 0.00 -1.51 0.00 0.00 37.83 35.46 2foo s LYS 139 CO 0.09 0.19 0.20 0.42 -0.36 0.00 0.00 175.35 175.90 2foo s ILE 140 N -0.18 4.61 0.29 5.43 1.01 0.01 0.01 121.20 132.37 2foo s ILE 140 Ca 0.03 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.59 2foo s ILE 140 Cb -0.04 -3.54 -0.11 0.00 0.01 0.00 0.00 42.46 38.78 2foo s ILE 140 CO -0.00 -0.20 1.57 -0.63 0.00 0.00 0.00 174.94 175.67 2foo s ILE 141 N 1.57 2.17 -0.37 2.92 -1.09 0.07 -2.56 121.20 123.91 2foo s ILE 141 Ca 0.02 0.15 -0.10 0.00 -2.23 0.00 0.00 60.65 58.49 2foo s ILE 141 Cb -0.19 -3.09 0.03 0.00 -1.58 0.00 0.00 42.46 37.63 2foo s ILE 141 CO 0.07 0.02 0.20 0.21 -1.23 0.00 0.00 174.94 174.21 2foo s ASN 142 N 0.46 5.68 0.55 3.58 3.84 -1.26 -4.59 114.94 123.21 2foo s ASN 142 Ca 0.62 -1.06 0.32 0.00 0.21 0.00 0.00 52.86 52.96 2foo s ASN 142 Cb -0.47 -2.00 1.55 0.00 -0.55 0.00 0.00 41.25 39.78 2foo s ASN 142 CO 0.47 -0.39 2.07 0.10 -2.79 0.00 0.00 177.10 176.56 2foo h TYR 143 N 8.41 0.00 0.00 0.43 -0.00 -1.16 -3.06 116.97 121.60 2foo h TYR 143 Ca -0.25 0.00 -0.21 0.00 0.00 0.00 0.00 58.73 58.27 2foo h TYR 143 Cb 1.10 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.80 2foo h TYR 143 CO 0.58 0.08 -1.13 0.00 -0.00 0.00 0.00 178.16 177.69 2foo h ARG 144 N 0.00 0.00 -0.89 0.10 3.08 -1.92 -3.45 114.38 111.31 2foo h ARG 144 Ca -0.00 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.13 2foo h ARG 144 Cb 0.37 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.21 2foo h ARG 144 CO 0.01 0.72 -0.27 0.34 -1.07 0.00 0.00 179.97 179.70 2foo s ASP 145 N -6.43 -1.36 0.53 7.04 3.68 -1.16 -5.04 116.67 113.93 2foo s ASP 145 Ca -0.00 0.42 0.28 0.00 2.13 0.00 0.00 52.55 55.39 2foo s ASP 145 Cb 0.09 1.97 1.55 0.00 -1.45 0.00 0.00 42.92 45.08 2foo s ASP 145 CO 0.81 -0.25 1.85 -0.78 0.13 0.00 0.00 175.17 176.93 2foo h ASP 146 N 7.93 0.00 1.15 -0.34 1.82 -1.87 0.25 116.42 125.36 2foo h ASP 146 Ca -0.10 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.54 2foo h ASP 146 Cb 1.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.19 2foo h ASP 146 CO 0.15 0.00 0.00 -0.62 -1.61 0.00 0.00 179.24 177.16 2foo n GLU 147 N -2.63 0.23 0.00 0.28 1.02 -1.26 -2.24 120.64 116.04 2foo n GLU 147 Ca -0.02 0.31 0.13 0.00 -0.02 0.00 0.00 57.16 57.56 2foo n GLU 147 Cb 0.22 -1.84 0.30 0.00 -0.02 0.00 0.00 31.44 30.10 2foo n GLU 147 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2foo n LYS 148 N -2.26 1.54 -1.94 3.49 4.76 0.88 -4.92 118.16 119.73 2foo n LYS 148 Ca 0.04 -1.08 -0.40 0.00 -2.87 0.00 0.00 58.31 53.99 2foo n LYS 148 Cb 0.34 -1.48 -0.00 0.00 -1.84 0.00 0.00 35.03 32.05 2foo n LYS 148 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2foo s SER 149 N -2.20 6.36 -0.17 4.39 0.01 -0.95 -4.75 113.70 116.38 2foo s SER 149 Ca 0.29 2.85 -0.06 0.00 1.31 0.00 0.00 55.95 60.33 2foo s SER 149 Cb 0.20 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2foo s SER 149 CO 0.41 -0.84 0.04 0.12 0.41 0.00 0.00 173.24 173.38 2foo s PHE 150 N -1.17 3.19 0.04 2.43 5.36 -1.06 -4.94 117.98 121.82 2foo s PHE 150 Ca 0.54 -0.02 -0.00 0.00 -0.96 0.00 0.00 56.93 56.48 2foo s PHE 150 Cb -0.42 -2.04 -0.03 0.00 -0.34 0.00 0.00 43.02 40.18 2foo s PHE 150 CO 0.56 0.11 -0.03 -1.54 -1.46 0.00 0.00 175.22 172.86 2foo s SER 151 N 0.35 0.41 0.06 6.13 1.04 -1.26 -0.81 113.70 119.62 2foo s SER 151 Ca 0.01 -0.78 0.03 0.00 0.48 0.00 0.00 55.95 55.69 2foo s SER 151 Cb -0.13 0.15 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 2foo s SER 151 CO 0.01 -0.46 -0.09 -0.13 0.98 0.00 0.00 173.24 173.55 2foo s ARG 152 N -2.81 0.65 0.10 4.02 0.52 -0.38 -4.97 118.95 116.08 2foo s ARG 152 Ca -0.03 -0.91 0.04 0.00 -0.52 0.00 0.00 55.73 54.32 2foo s ARG 152 Cb -0.00 -0.40 -0.04 0.00 0.52 0.00 0.00 34.95 35.03 2foo s ARG 152 CO -0.06 0.07 0.04 -0.98 0.02 0.00 0.00 175.30 174.39 2foo s ARG 153 N -2.02 2.69 0.07 3.54 1.70 -1.26 -0.58 118.95 123.08 2foo s ARG 153 Ca -0.04 -0.81 0.00 0.00 -0.47 0.00 0.00 55.73 54.41 2foo s ARG 153 Cb -0.07 -2.60 -0.04 0.00 -0.57 0.00 0.00 34.95 31.67 2foo s ARG 153 CO 0.00 0.54 -0.04 0.96 -1.08 0.00 0.00 175.30 175.67 2foo s ILE 154 N -1.42 0.40 -0.10 4.99 -4.36 -0.19 -4.98 121.20 115.54 2foo s ILE 154 Ca 0.28 -1.80 -0.04 0.00 -0.26 0.00 0.00 60.65 58.82 2foo s ILE 154 Cb -0.11 -1.51 0.05 0.00 1.25 0.00 0.00 42.46 42.14 2foo s ILE 154 CO 0.20 -0.92 0.21 -0.55 0.24 0.00 0.00 174.94 174.12 2foo s SER 155 N -2.87 0.13 -0.08 4.36 0.15 -1.26 -1.07 113.70 113.07 2foo s SER 155 Ca 0.07 0.45 -0.30 0.00 0.70 0.00 0.00 55.95 56.87 2foo s SER 155 Cb 0.06 0.40 0.07 0.00 -1.71 0.00 0.00 66.02 64.84 2foo s SER 155 CO -0.07 -0.20 0.70 -2.28 1.20 0.00 0.00 173.24 172.59 2foo s HIS 156 N 1.74 -0.66 -0.58 3.44 5.04 -0.52 -5.01 115.29 118.73 2foo s HIS 156 Ca -0.04 1.19 -0.18 0.00 -1.54 0.00 0.00 55.06 54.49 2foo s HIS 156 Cb -0.11 0.40 0.11 0.00 0.04 0.00 0.00 32.58 33.02 2foo s HIS 156 CO -0.07 -0.58 0.65 -1.17 -2.34 0.00 0.00 174.74 171.23 2foo s LEU 157 N -1.02 5.62 0.17 8.88 1.98 -1.26 -1.65 118.68 131.39 2foo s LEU 157 Ca -0.09 -1.55 -0.30 0.00 -2.89 0.00 0.00 54.13 49.30 2foo s LEU 157 Cb -0.01 -2.28 -0.07 0.00 0.66 0.00 0.00 46.19 44.50 2foo s LEU 157 CO 0.09 -1.04 1.03 -0.36 -1.89 0.00 0.00 176.35 174.18 2foo s PHE 158 N 2.37 3.72 0.32 5.38 0.40 -0.05 -4.88 117.98 125.24 2foo s PHE 158 Ca 0.09 1.72 -0.17 0.00 -0.60 0.00 0.00 56.93 57.97 2foo s PHE 158 Cb -0.26 -3.16 0.03 0.00 0.51 0.00 0.00 43.02 40.14 2foo s PHE 158 CO 0.05 -0.18 0.70 -0.59 0.70 0.00 0.00 175.22 175.91 2foo s PHE 159 N -0.33 0.06 0.38 0.36 -0.71 -1.16 -0.93 117.98 115.65 2foo s PHE 159 Ca 0.47 -0.58 0.14 0.00 -1.04 0.00 0.00 56.93 55.92 2foo s PHE 159 Cb -0.27 0.65 0.97 0.00 -1.21 0.00 0.00 43.02 43.16 2foo s PHE 159 CO 0.33 -1.33 1.84 1.12 -1.34 0.00 0.00 175.22 175.84 2foo h HIS 160 N 2.03 0.70 0.00 3.49 2.07 -1.86 -0.85 115.15 120.74 2foo h HIS 160 Ca -0.25 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.29 2foo h HIS 160 Cb 1.25 -0.21 0.00 0.00 2.57 0.00 0.00 27.41 31.02 2foo h HIS 160 CO 0.84 0.19 -0.14 1.63 -3.07 0.00 0.00 177.93 177.38 2foo n LYS 161 N -4.57 0.28 -3.19 5.12 5.02 -1.26 -4.05 118.16 115.51 2foo n LYS 161 Ca 0.20 0.19 -0.22 0.00 -2.02 0.00 0.00 58.31 56.47 2foo n LYS 161 Cb 0.64 -1.79 -0.05 0.00 -0.02 0.00 0.00 35.03 33.81 2foo n LYS 161 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2foo n GLU 162 N -2.26 0.85 0.00 1.97 1.02 -0.44 -4.97 120.64 116.81 2foo n GLU 162 Ca 0.05 -3.31 0.16 0.00 -0.02 0.00 0.00 57.16 54.04 2foo n GLU 162 Cb 0.44 -1.43 0.88 0.00 -0.02 0.00 0.00 31.44 31.30 2foo n GLU 162 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2foo n ASN 163 N 0.93 0.20 -3.98 1.62 0.23 -0.52 -2.97 115.26 110.77 2foo n ASN 163 Ca 0.23 -1.00 -0.08 0.00 -0.53 0.00 0.00 54.58 53.19 2foo n ASN 163 Cb 0.58 -0.02 -0.09 0.00 -2.08 0.00 0.00 39.78 38.17 2foo n ASN 163 CO 0.00 0.00 0.00 1.51 -0.93 0.00 0.00 177.26 177.84 2foo s ASP 164 N -2.05 0.29 -0.16 0.53 1.47 -1.26 0.23 116.67 115.72 2foo s ASP 164 Ca 0.45 -0.72 -0.17 0.00 1.18 0.00 0.00 52.55 53.28 2foo s ASP 164 Cb 0.22 0.23 0.05 0.00 -0.34 0.00 0.00 42.92 43.07 2foo s ASP 164 CO 0.37 -0.56 0.48 0.86 0.68 0.00 0.00 175.17 177.00 2foo s TRP 165 N -3.21 -0.50 -2.99 2.11 -0.11 0.27 -4.94 118.94 109.57 2foo s TRP 165 Ca 0.00 1.19 0.00 0.00 1.22 0.00 0.00 56.10 58.51 2foo s TRP 165 Cb 0.02 0.19 0.00 0.00 -1.50 0.00 0.00 33.47 32.18 2foo s TRP 165 CO -0.07 -0.29 0.00 0.41 -4.62 0.00 0.00 176.95 172.38 2foo n GLY 166 N 2.55 -0.59 3.07 5.86 0.00 -1.26 -0.69 105.19 114.13 2foo n GLY 166 Ca -0.15 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 2foo n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2foo s PHE 167 N -3.66 2.38 0.37 1.61 0.40 -0.81 -4.97 117.98 113.30 2foo s PHE 167 Ca 0.00 -1.32 0.21 0.00 -0.60 0.00 0.00 56.93 55.22 2foo s PHE 167 Cb 0.00 -1.69 1.13 0.00 0.51 0.00 0.00 43.02 42.97 2foo s PHE 167 CO 0.00 -0.68 1.97 0.66 0.70 0.00 0.00 175.22 177.87 2foo h SER 168 N 7.84 0.00 -2.19 1.36 4.64 -1.85 -2.25 113.55 121.10 2foo h SER 168 Ca -0.39 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.34 2foo h SER 168 Cb 1.15 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 62.82 2foo h SER 168 CO 0.56 0.21 -0.68 0.59 -0.87 0.00 0.00 176.83 176.64 2foo n ASN 169 N -3.82 3.50 -0.10 4.97 4.13 -1.26 -3.60 115.26 119.08 2foo n ASN 169 Ca -0.02 -3.43 -0.14 0.00 1.68 0.00 0.00 54.58 52.68 2foo n ASN 169 Cb 0.31 -0.63 -0.03 0.00 -1.54 0.00 0.00 39.78 37.88 2foo n ASN 169 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2foo h PHE 170 N 3.75 1.04 -3.12 3.10 3.04 -1.20 -3.47 116.94 120.09 2foo h PHE 170 Ca 0.16 -0.33 -0.08 0.00 3.98 0.00 0.00 57.97 61.70 2foo h PHE 170 Cb 0.65 -0.21 -0.16 0.00 2.56 0.00 0.00 35.95 38.78 2foo h PHE 170 CO 0.71 1.14 -0.14 -1.64 -2.02 0.00 0.00 178.31 176.36 2foo s MET 171 N -4.31 0.90 0.21 1.11 -1.94 -1.25 -5.00 119.30 109.02 2foo s MET 171 Ca -0.11 -0.42 -0.30 0.00 -1.71 0.00 0.00 55.69 53.15 2foo s MET 171 Cb 0.10 0.40 -0.09 0.00 2.01 0.00 0.00 34.83 37.25 2foo s MET 171 CO 0.87 -0.31 1.29 0.00 -0.01 0.00 0.00 175.02 176.86 2foo s ALA 172 N -2.57 3.51 0.23 3.03 0.00 -1.26 -0.79 121.76 123.90 2foo s ALA 172 Ca -0.05 1.09 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 2foo s ALA 172 Cb -0.01 -3.47 0.20 0.00 0.00 0.00 0.00 23.12 19.84 2foo s ALA 172 CO -0.03 -0.51 1.89 2.35 0.00 0.00 0.00 175.76 179.45 2foo h TRP 173 N 5.21 1.11 -0.09 0.00 2.91 0.55 -2.05 115.95 123.59 2foo h TRP 173 Ca -0.45 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 59.56 2foo h TRP 173 Cb 1.21 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 29.49 2foo h TRP 173 CO 0.62 0.72 -0.04 0.66 -1.03 0.00 0.00 178.44 179.36 2foo h SER 174 N 1.17 0.12 0.00 2.65 4.64 -1.92 -1.86 113.55 118.36 2foo h SER 174 Ca 0.31 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2foo h SER 174 Cb -0.09 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 2foo h SER 174 CO -0.06 0.18 -0.00 -0.08 -0.87 0.00 0.00 176.83 176.00 2foo h GLU 175 N 0.13 -0.01 -0.63 4.77 4.81 -1.76 -2.95 114.58 118.94 2foo h GLU 175 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2foo h GLU 175 Cb 0.16 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2foo h GLU 175 CO 0.01 0.76 0.40 0.28 -0.73 0.00 0.00 179.01 179.72 2foo h VAL 176 N -0.78 1.17 -0.22 0.32 2.07 -1.24 -2.27 116.25 115.31 2foo h VAL 176 Ca -0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2foo h VAL 176 Cb 0.77 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 2foo h VAL 176 CO 0.00 0.17 0.00 0.35 0.02 0.00 0.00 177.57 178.11 2foo n THR 177 N -4.42 0.28 -2.40 2.57 -2.24 -0.72 -3.88 114.28 103.48 2foo n THR 177 Ca 0.06 -0.40 -0.42 0.00 -2.27 0.00 0.00 64.05 61.03 2foo n THR 177 Cb 0.06 0.37 -0.02 0.00 -2.10 0.00 0.00 70.33 68.64 2foo n THR 177 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2foo s ASP 178 N -1.45 6.24 0.25 3.42 -1.08 -0.85 -4.87 116.67 118.33 2foo s ASP 178 Ca 0.31 0.48 0.12 0.00 -0.52 0.00 0.00 52.55 52.94 2foo s ASP 178 Cb 0.17 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.72 2foo s ASP 178 CO 0.25 -1.58 1.26 -0.81 0.52 0.00 0.00 175.17 174.81 2foo n PRO 179 N 8.39 0.08 0.00 4.34 -0.04 -1.26 -0.85 135.00 145.66 2foo n PRO 179 Ca 0.14 0.53 0.12 0.00 -0.04 0.00 0.00 63.50 64.24 2foo n PRO 179 Cb 0.49 -1.97 0.12 0.00 -0.04 0.00 0.00 33.50 32.09 2foo n PRO 179 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2foo n GLU 180 N -1.93 1.40 0.06 0.54 -0.58 -1.26 -4.35 120.64 114.53 2foo n GLU 180 Ca -0.01 -1.10 0.03 0.00 -0.42 0.00 0.00 57.16 55.66 2foo n GLU 180 Cb 0.23 -1.48 -0.05 0.00 -0.57 0.00 0.00 31.44 29.57 2foo n GLU 180 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2foo h LYS 181 N 2.69 0.00 0.00 3.49 1.79 -1.31 -3.49 116.57 119.74 2foo h LYS 181 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2foo h LYS 181 Cb 0.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2foo h LYS 181 CO 0.00 0.25 0.00 0.41 -1.08 0.00 0.00 179.45 179.03 2foo n GLY 182 N 1.33 0.76 0.08 3.86 0.00 -1.26 -4.94 105.19 105.02 2foo n GLY 182 Ca -0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.99 2foo n GLY 182 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2foo n PHE 183 N -2.09 0.58 -5.23 1.61 3.01 -1.26 -0.61 117.46 113.47 2foo n PHE 183 Ca 0.00 0.19 -0.31 0.00 1.01 0.00 0.00 57.45 58.33 2foo n PHE 183 Cb 0.00 -0.91 -0.16 0.00 -0.01 0.00 0.00 39.48 38.40 2foo n PHE 183 CO 0.00 0.00 0.00 -1.50 1.01 0.00 0.00 176.76 176.27 2foo s ILE 184 N -3.07 2.23 -0.13 4.37 2.07 -1.25 -4.44 121.20 120.97 2foo s ILE 184 Ca -0.05 -1.04 -0.06 0.00 -1.41 0.00 0.00 60.65 58.10 2foo s ILE 184 Cb 0.10 -1.79 0.06 0.00 0.13 0.00 0.00 42.46 40.96 2foo s ILE 184 CO 0.83 0.58 0.29 -0.62 -1.91 0.00 0.00 174.94 174.11 2foo s ASP 185 N -0.60 0.03 -1.46 4.50 2.15 -0.89 -4.84 116.67 115.57 2foo s ASP 185 Ca 0.09 0.64 -0.07 0.00 0.43 0.00 0.00 52.55 53.64 2foo s ASP 185 Cb -0.10 0.69 0.03 0.00 -0.30 0.00 0.00 42.92 43.24 2foo s ASP 185 CO -0.00 -0.21 0.64 -0.67 -0.17 0.00 0.00 175.17 174.76 2foo n ASP 186 N 4.93 -5.33 -2.46 -0.34 4.64 -1.26 -1.00 116.55 115.73 2foo n ASP 186 Ca -0.14 -0.37 -0.20 0.00 -1.38 0.00 0.00 54.79 52.70 2foo n ASP 186 Cb 0.51 -4.31 0.01 0.00 -1.04 0.00 0.00 41.12 36.28 2foo n ASP 186 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 2foo n ASP 187 N -2.51 -5.75 -4.24 1.67 4.64 -1.26 -4.68 116.55 104.42 2foo n ASP 187 Ca -0.06 -0.10 -0.30 0.00 -1.38 0.00 0.00 54.79 52.95 2foo n ASP 187 Cb 0.59 -4.71 -0.16 0.00 -1.04 0.00 0.00 41.12 35.80 2foo n ASP 187 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 2foo s LYS 188 N -5.20 2.25 -0.07 -0.67 1.02 -0.17 -0.71 119.74 116.19 2foo s LYS 188 Ca 0.10 -0.83 0.02 0.00 0.02 0.00 0.00 55.97 55.28 2foo s LYS 188 Cb -0.04 -1.96 0.01 0.00 -0.52 0.00 0.00 37.83 35.32 2foo s LYS 188 CO 0.12 0.38 -0.12 0.08 -0.92 0.00 0.00 175.35 174.89 2foo s VAL 189 N -0.20 1.10 -0.22 3.17 1.01 -0.77 -2.08 120.40 122.40 2foo s VAL 189 Ca -0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 61.98 61.42 2foo s VAL 189 Cb -0.12 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 2foo s VAL 189 CO 0.02 0.35 0.14 -0.89 0.00 0.00 0.00 175.10 174.72 2foo s THR 190 N 0.73 5.24 0.01 3.92 2.01 -1.26 -0.94 115.64 125.34 2foo s THR 190 Ca -0.14 0.14 0.01 0.00 0.31 0.00 0.00 61.69 62.02 2foo s THR 190 Cb -0.16 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 2foo s THR 190 CO 0.03 0.38 0.02 -0.36 -0.69 0.00 0.00 174.62 174.00 2foo s PHE 191 N 0.85 3.11 0.01 4.92 0.08 -0.59 -0.75 117.98 125.61 2foo s PHE 191 Ca 0.07 0.09 0.01 0.00 0.12 0.00 0.00 56.93 57.23 2foo s PHE 191 Cb -0.13 -1.67 -0.01 0.00 -0.57 0.00 0.00 43.02 40.64 2foo s PHE 191 CO 0.03 0.48 -0.05 -2.00 -0.10 0.00 0.00 175.22 173.58 2foo s GLU 192 N -1.71 0.38 -0.05 0.44 2.12 0.10 -1.08 118.70 118.91 2foo s GLU 192 Ca 0.21 -0.36 0.02 0.00 0.36 0.00 0.00 54.97 55.20 2foo s GLU 192 Cb -0.12 -0.27 0.02 0.00 0.26 0.00 0.00 34.13 34.02 2foo s GLU 192 CO 0.12 0.06 -0.09 0.08 -0.54 0.00 0.00 175.26 174.90 2foo s VAL 193 N -0.58 0.86 -0.29 3.70 1.01 -0.57 -0.27 120.40 124.27 2foo s VAL 193 Ca -0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 2foo s VAL 193 Cb -0.05 -0.82 0.04 0.00 0.00 0.00 0.00 36.38 35.56 2foo s VAL 193 CO -0.00 0.29 -0.01 0.12 0.00 0.00 0.00 175.10 175.50 2foo s PHE 194 N 0.72 3.22 -0.06 5.22 5.36 -0.49 -1.90 117.98 130.05 2foo s PHE 194 Ca -0.13 -1.80 0.05 0.00 -0.96 0.00 0.00 56.93 54.09 2foo s PHE 194 Cb -0.15 -2.10 -0.02 0.00 -0.34 0.00 0.00 43.02 40.42 2foo s PHE 194 CO 0.02 -0.79 -0.20 0.54 -1.46 0.00 0.00 175.22 173.34 2foo s VAL 195 N 1.27 2.55 -0.24 3.12 0.11 -0.78 -0.10 120.40 126.32 2foo s VAL 195 Ca -0.04 -0.90 0.02 0.00 -2.93 0.00 0.00 61.98 58.13 2foo s VAL 195 Cb -0.19 -1.97 0.06 0.00 -1.53 0.00 0.00 36.38 32.75 2foo s VAL 195 CO -0.02 0.57 -0.08 -1.10 -3.33 0.00 0.00 175.10 171.15 2foo s GLN 196 N -0.38 1.89 0.04 1.54 -0.21 0.52 -2.17 119.66 120.89 2foo s GLN 196 Ca 0.03 -1.13 0.07 0.00 0.02 0.00 0.00 55.36 54.35 2foo s GLN 196 Cb -0.12 -2.71 -0.03 0.00 1.00 0.00 0.00 33.01 31.15 2foo s GLN 196 CO 0.02 -0.58 -0.17 0.00 -2.12 0.00 0.00 175.29 172.44 2foo s ALA 197 N 1.28 2.65 0.90 6.09 0.00 -0.64 -0.82 121.76 131.22 2foo s ALA 197 Ca -0.07 -1.18 -0.14 0.00 0.00 0.00 0.00 51.96 50.57 2foo s ALA 197 Cb -0.19 -0.78 0.16 0.00 0.00 0.00 0.00 23.12 22.31 2foo s ALA 197 CO -0.06 0.58 1.25 -0.51 0.00 0.00 0.00 175.76 177.02 2foo s ASP 198 N -1.49 3.63 0.31 0.00 1.01 -0.18 -4.77 116.67 115.18 2foo s ASP 198 Ca 0.15 0.37 -0.29 0.00 0.71 0.00 0.00 52.55 53.49 2foo s ASP 198 Cb -0.11 -0.57 -0.10 0.00 1.01 0.00 0.00 42.92 43.15 2foo s ASP 198 CO 0.06 -2.42 1.39 0.00 0.21 0.00 0.00 175.17 174.42 2foo s ALA 199 N -3.74 3.56 0.76 5.23 0.00 -1.26 -4.69 121.76 121.62 2foo s ALA 199 Ca 0.70 1.35 -0.11 0.00 0.00 0.00 0.00 51.96 53.90 2foo s ALA 199 Cb -0.06 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.57 2foo s ALA 199 CO 0.51 -0.76 1.09 -2.14 0.00 0.00 0.00 175.76 174.46 2foo s PRO 200 N -1.34 2.44 0.14 0.00 0.02 -1.26 -4.74 135.00 130.26 2foo s PRO 200 Ca 0.54 0.62 0.09 0.00 0.02 0.00 0.00 61.00 62.26 2foo s PRO 200 Cb -0.42 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.10 2foo s PRO 200 CO 0.51 -1.36 -0.21 -1.01 -0.33 0.00 0.00 177.00 174.60 2foo s HIS 201 N -3.21 1.92 -1.64 6.54 3.76 0.15 -4.77 115.29 118.04 2foo s HIS 201 Ca 0.60 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 55.08 2foo s HIS 201 Cb -0.13 -1.00 0.00 0.00 1.11 0.00 0.00 32.58 32.56 2foo s HIS 201 CO 0.54 0.30 0.00 0.41 -0.85 0.00 0.00 174.74 175.14 2foo n GLY 202 N 0.67 0.85 0.20 -2.22 0.00 -1.26 -1.58 105.19 101.86 2foo n GLY 202 Ca -0.16 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2foo n GLY 202 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2foo n VAL 203 N -3.13 0.00 -3.21 1.61 0.31 -1.26 -3.59 118.33 109.06 2foo n VAL 203 Ca -0.18 0.01 -0.45 0.00 -0.01 0.00 0.00 64.34 63.71 2foo n VAL 203 Cb 0.59 -0.67 -0.05 0.00 -0.91 0.00 0.00 33.84 32.80 2foo n VAL 203 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2foo s ALA 204 N -2.31 3.50 -2.18 3.52 0.00 -1.26 -5.11 121.76 117.93 2foo s ALA 204 Ca 0.00 -2.25 0.31 0.00 0.00 0.00 0.00 51.96 50.01 2foo s ALA 204 Cb 0.00 -3.38 1.61 0.00 0.00 0.00 0.00 23.12 21.35 2foo s ALA 204 CO 0.00 -2.14 2.06 0.91 0.00 0.00 0.00 175.76 176.59