#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f1w n SER 64 N 0.00 0.06 -0.81 1.09 3.41 -1.26 -1.72 113.62 114.40 2f1w n SER 64 Ca 0.00 0.52 0.07 0.00 -0.26 0.00 0.00 58.87 59.20 2f1w n SER 64 Cb 0.00 -0.53 0.19 0.00 -0.26 0.00 0.00 64.21 63.61 2f1w n SER 64 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2f1w n TRP 65 N -1.57 0.59 -1.29 7.33 7.02 -1.26 -0.24 117.44 128.01 2f1w n TRP 65 Ca 0.02 -0.29 -0.35 0.00 -1.02 0.00 0.00 57.50 55.86 2f1w n TRP 65 Cb 0.12 -0.01 0.10 0.00 -2.42 0.00 0.00 31.31 29.09 2f1w n TRP 65 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 2f1w n ARG 66 N 0.74 0.43 0.05 -0.99 1.85 -0.70 -4.07 116.66 113.97 2f1w n ARG 66 Ca 0.14 0.20 0.13 0.00 -1.00 0.00 0.00 57.85 57.32 2f1w n ARG 66 Cb 0.38 -2.25 0.32 0.00 -1.05 0.00 0.00 32.46 29.85 2f1w n ARG 66 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2f1w n SER 67 N -1.95 0.58 -3.57 2.89 3.41 -1.26 -0.40 113.62 113.32 2f1w n SER 67 Ca 0.13 0.23 -0.11 0.00 -0.26 0.00 0.00 58.87 58.86 2f1w n SER 67 Cb 0.50 -0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 64.25 2f1w n SER 67 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2f1w s GLU 68 N -3.09 1.38 -0.02 4.33 -1.05 -1.26 -1.60 118.70 117.39 2f1w s GLU 68 Ca 0.09 -0.65 -0.29 0.00 -0.15 0.00 0.00 54.97 53.97 2f1w s GLU 68 Cb 0.15 0.58 0.10 0.00 -0.44 0.00 0.00 34.13 34.52 2f1w s GLU 68 CO 0.65 -0.60 0.95 0.00 0.95 0.00 0.00 175.26 177.21 2f1w s ALA 69 N -3.81 -1.85 -0.09 -0.84 0.00 -0.71 -5.00 121.76 109.45 2f1w s ALA 69 Ca 0.04 1.00 0.02 0.00 0.00 0.00 0.00 51.96 53.02 2f1w s ALA 69 Cb -0.02 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.48 2f1w s ALA 69 CO -0.08 -0.72 -0.16 0.99 0.00 0.00 0.00 175.76 175.80 2f1w s THR 70 N -3.02 1.46 0.03 0.00 2.01 -1.26 -0.88 115.64 113.98 2f1w s THR 70 Ca 0.07 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.43 2f1w s THR 70 Cb -0.01 -1.32 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 2f1w s THR 70 CO -0.07 0.43 -0.04 0.72 -0.69 0.00 0.00 174.62 174.97 2f1w s PHE 71 N 0.79 0.42 0.26 4.92 -0.12 -0.27 -4.99 117.98 119.00 2f1w s PHE 71 Ca -0.11 -0.64 0.11 0.00 -0.05 0.00 0.00 56.93 56.25 2f1w s PHE 71 Cb -0.16 -0.29 -0.05 0.00 -0.63 0.00 0.00 43.02 41.90 2f1w s PHE 71 CO 0.02 -0.20 -0.18 -0.65 -0.05 0.00 0.00 175.22 174.16 2f1w s GLN 72 N -2.04 1.75 -0.14 1.99 1.11 -1.26 -1.14 119.66 119.93 2f1w s GLN 72 Ca -0.09 -1.66 -0.04 0.00 0.01 0.00 0.00 55.36 53.58 2f1w s GLN 72 Cb -0.06 -1.85 0.06 0.00 -1.01 0.00 0.00 33.01 30.16 2f1w s GLN 72 CO -0.02 0.35 0.17 0.12 0.01 0.00 0.00 175.29 175.92 2f1w s PHE 73 N -2.31 -0.16 -0.31 0.91 5.36 0.52 -4.96 117.98 117.04 2f1w s PHE 73 Ca 0.28 0.35 -0.13 0.00 -0.96 0.00 0.00 56.93 56.48 2f1w s PHE 73 Cb -0.06 -0.36 -0.03 0.00 -0.34 0.00 0.00 43.02 42.23 2f1w s PHE 73 CO 0.15 -0.42 0.25 0.99 -1.46 0.00 0.00 175.22 174.73 2f1w s THR 74 N 2.28 5.27 -0.34 0.12 2.01 -1.26 -0.60 115.64 123.13 2f1w s THR 74 Ca 0.04 0.05 -0.18 0.00 0.31 0.00 0.00 61.69 61.91 2f1w s THR 74 Cb -0.14 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 2f1w s THR 74 CO -0.08 0.11 0.51 -0.69 -0.69 0.00 0.00 174.62 173.77 2f1w s VAL 75 N 1.80 5.03 0.54 3.82 1.01 0.01 -4.93 120.40 127.68 2f1w s VAL 75 Ca 0.08 0.42 -0.05 0.00 0.00 0.00 0.00 61.98 62.43 2f1w s VAL 75 Cb -0.17 -3.94 -0.00 0.00 0.00 0.00 0.00 36.38 32.27 2f1w s VAL 75 CO 0.11 -0.17 0.84 -1.61 0.00 0.00 0.00 175.10 174.27 2f1w s GLU 76 N 2.38 3.09 -1.59 2.72 2.02 -1.26 -1.97 118.70 124.07 2f1w s GLU 76 Ca 0.19 -0.03 -0.10 0.00 0.02 0.00 0.00 54.97 55.05 2f1w s GLU 76 Cb -0.15 -2.34 0.09 0.00 0.10 0.00 0.00 34.13 31.82 2f1w s GLU 76 CO 0.13 -0.52 0.51 0.54 0.02 0.00 0.00 175.26 175.94 2f1w n ARG 77 N -2.43 -2.62 -0.26 1.61 1.74 -0.48 -4.82 116.66 109.40 2f1w n ARG 77 Ca 0.03 0.32 0.02 0.00 -0.77 0.00 0.00 57.85 57.45 2f1w n ARG 77 Cb 0.57 -4.62 0.15 0.00 -1.02 0.00 0.00 32.46 27.55 2f1w n ARG 77 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2f1w h PHE 78 N -1.61 0.69 -0.01 -1.55 3.57 -1.27 -1.34 116.94 115.41 2f1w h PHE 78 Ca -0.62 0.03 0.00 0.00 3.53 0.00 0.00 57.97 60.92 2f1w h PHE 78 Cb 1.38 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.93 2f1w h PHE 78 CO 0.57 0.24 0.09 0.66 -2.23 0.00 0.00 178.31 177.65 2f1w h SER 79 N 0.64 0.00 -0.03 0.41 4.64 -1.88 -0.83 113.55 116.51 2f1w h SER 79 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 2f1w h SER 79 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2f1w h SER 79 CO -0.28 0.00 -0.07 0.54 -0.87 0.00 0.00 176.83 176.16 2f1w n ARG 80 N -3.14 1.99 -1.68 4.77 1.74 -0.52 -4.97 116.66 114.85 2f1w n ARG 80 Ca -0.02 -1.70 -0.48 0.00 -0.77 0.00 0.00 57.85 54.87 2f1w n ARG 80 Cb 0.16 -1.43 -0.05 0.00 -1.02 0.00 0.00 32.46 30.12 2f1w n ARG 80 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2f1w n LEU 81 N 1.06 3.33 -0.63 0.55 7.94 -0.32 -4.85 117.00 124.08 2f1w n LEU 81 Ca 0.12 1.00 0.05 0.00 -1.11 0.00 0.00 56.01 56.07 2f1w n LEU 81 Cb 0.54 -1.37 0.09 0.00 0.53 0.00 0.00 43.42 43.21 2f1w n LEU 81 CO 0.16 -0.12 0.32 -1.54 -1.11 0.00 0.00 177.39 175.10 2f1w n SER 82 N 5.94 1.29 -3.05 1.96 3.41 -1.26 -4.81 113.62 117.09 2f1w n SER 82 Ca 0.22 -2.76 -0.06 0.00 -0.26 0.00 0.00 58.87 56.01 2f1w n SER 82 Cb 0.29 -0.37 0.02 0.00 -0.26 0.00 0.00 64.21 63.90 2f1w n SER 82 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2f1w n GLU 83 N -0.55 0.86 -3.25 4.33 0.28 -1.26 -5.02 120.64 116.03 2f1w n GLU 83 Ca 0.10 -1.80 -0.39 0.00 -0.16 0.00 0.00 57.16 54.91 2f1w n GLU 83 Cb 0.78 2.34 -0.06 0.00 1.43 0.00 0.00 31.44 35.94 2f1w n GLU 83 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2f1w s SER 84 N -3.26 6.95 0.07 -1.84 0.15 -1.26 -4.33 113.70 110.18 2f1w s SER 84 Ca 0.20 1.13 0.07 0.00 0.70 0.00 0.00 55.95 58.05 2f1w s SER 84 Cb -0.04 -2.35 -0.03 0.00 -1.71 0.00 0.00 66.02 61.90 2f1w s SER 84 CO 0.08 0.14 -0.20 0.68 1.20 0.00 0.00 173.24 175.15 2f1w s VAL 85 N -0.34 1.59 0.02 4.45 -7.23 0.50 -4.95 120.40 114.43 2f1w s VAL 85 Ca 0.30 -1.30 0.06 0.00 -1.81 0.00 0.00 61.98 59.22 2f1w s VAL 85 Cb -0.18 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.31 2f1w s VAL 85 CO 0.17 0.06 -0.16 -0.76 -0.31 0.00 0.00 175.10 174.10 2f1w s LEU 86 N -1.46 2.72 0.73 1.32 2.01 -1.26 -1.37 118.68 121.37 2f1w s LEU 86 Ca 0.06 -0.34 -0.10 0.00 0.01 0.00 0.00 54.13 53.75 2f1w s LEU 86 Cb -0.09 -1.58 0.05 0.00 0.01 0.00 0.00 46.19 44.58 2f1w s LEU 86 CO 0.03 0.27 1.09 -0.94 1.01 0.00 0.00 176.35 177.81 2f1w s SER 87 N -1.33 4.98 0.90 2.29 1.04 -0.61 -4.97 113.70 115.99 2f1w s SER 87 Ca 0.15 0.83 -0.12 0.00 0.48 0.00 0.00 55.95 57.29 2f1w s SER 87 Cb -0.11 -1.50 0.13 0.00 0.10 0.00 0.00 66.02 64.64 2f1w s SER 87 CO 0.05 -1.58 1.09 -2.16 0.98 0.00 0.00 173.24 171.62 2f1w s PRO 88 N -5.38 1.26 0.22 4.02 0.04 -1.26 -4.66 135.00 129.23 2f1w s PRO 88 Ca 0.60 0.79 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 2f1w s PRO 88 Cb -0.11 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.54 2f1w s PRO 88 CO 0.49 -2.23 1.03 -1.25 0.04 0.00 0.00 177.00 175.08 2f1w s PRO 89 N -4.95 4.70 -0.21 0.56 0.04 -1.26 -4.70 135.00 129.19 2f1w s PRO 89 Ca 0.63 1.64 -0.03 0.00 0.04 0.00 0.00 61.00 63.28 2f1w s PRO 89 Cb -0.18 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.09 2f1w s PRO 89 CO 0.57 0.27 -0.07 0.00 0.04 0.00 0.00 177.00 177.81 2f1w s PHE 91 N 1.33 3.48 -0.03 0.00 0.40 -1.26 -0.79 117.98 121.12 2f1w s PHE 91 Ca 0.04 1.07 -0.00 0.00 -0.60 0.00 0.00 56.93 57.44 2f1w s PHE 91 Cb -0.14 -2.77 0.03 0.00 0.51 0.00 0.00 43.02 40.65 2f1w s PHE 91 CO -0.03 -0.01 0.04 0.08 0.70 0.00 0.00 175.22 176.00 2f1w s VAL 92 N 1.24 -0.06 -1.46 -0.44 1.01 -0.85 -4.70 120.40 115.14 2f1w s VAL 92 Ca 0.32 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.45 2f1w s VAL 92 Cb -0.16 -0.10 0.03 0.00 0.00 0.00 0.00 36.38 36.14 2f1w s VAL 92 CO 0.14 0.08 0.58 0.54 0.00 0.00 0.00 175.10 176.44 2f1w n ARG 93 N 4.15 -4.48 -1.70 2.72 5.12 0.47 -1.36 116.66 121.58 2f1w n ARG 93 Ca -0.27 0.76 -0.21 0.00 -1.93 0.00 0.00 57.85 56.20 2f1w n ARG 93 Cb 0.51 -5.58 -0.08 0.00 -1.16 0.00 0.00 32.46 26.15 2f1w n ARG 93 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2f1w n ASN 94 N -2.46 -5.47 -4.43 0.55 5.15 0.66 -4.92 115.26 104.34 2f1w n ASN 94 Ca -0.08 0.45 -0.30 0.00 -0.60 0.00 0.00 54.58 54.05 2f1w n ASN 94 Cb 0.59 -4.80 -0.13 0.00 -0.53 0.00 0.00 39.78 34.91 2f1w n ASN 94 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2f1w s LEU 95 N -4.88 2.51 -0.30 1.20 1.43 -0.47 -5.04 118.68 113.13 2f1w s LEU 95 Ca 0.00 -0.51 -0.25 0.00 -1.03 0.00 0.00 54.13 52.35 2f1w s LEU 95 Cb 0.00 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.77 2f1w s LEU 95 CO 0.00 0.24 0.84 -2.16 0.23 0.00 0.00 176.35 175.50 2f1w s PRO 96 N -1.57 4.01 -0.10 1.29 0.04 -1.26 -2.01 135.00 135.39 2f1w s PRO 96 Ca 0.15 0.71 -0.04 0.00 0.04 0.00 0.00 61.00 61.86 2f1w s PRO 96 Cb -0.10 -3.72 -0.04 0.00 0.04 0.00 0.00 34.50 30.68 2f1w s PRO 96 CO 0.05 -0.70 0.05 -1.58 0.04 0.00 0.00 177.00 174.87 2f1w s TRP 97 N 3.06 3.31 0.06 0.56 0.52 0.03 -1.05 118.94 125.43 2f1w s TRP 97 Ca 0.35 0.29 0.01 0.00 0.02 0.00 0.00 56.10 56.77 2f1w s TRP 97 Cb -0.14 -1.85 -0.03 0.00 -1.15 0.00 0.00 33.47 30.30 2f1w s TRP 97 CO 0.12 0.54 -0.06 0.15 0.02 0.00 0.00 176.95 177.73 2f1w s LYS 98 N -0.86 0.60 -0.13 4.98 1.02 0.16 -0.68 119.74 124.82 2f1w s LYS 98 Ca 0.13 -1.01 -0.12 0.00 0.02 0.00 0.00 55.97 55.00 2f1w s LYS 98 Cb -0.12 -0.09 -0.05 0.00 -0.52 0.00 0.00 37.83 37.06 2f1w s LYS 98 CO 0.03 -0.02 0.24 0.42 -0.92 0.00 0.00 175.35 175.10 2f1w s ILE 99 N -2.63 5.33 -0.13 2.17 1.01 -1.26 -0.51 121.20 125.18 2f1w s ILE 99 Ca -0.01 0.44 -0.01 0.00 0.00 0.00 0.00 60.65 61.08 2f1w s ILE 99 Cb -0.01 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.88 2f1w s ILE 99 CO -0.04 0.49 -0.11 -0.04 0.00 0.00 0.00 174.94 175.24 2f1w s MET 100 N -0.17 3.44 -0.04 2.79 -1.94 0.55 -1.57 119.30 122.36 2f1w s MET 100 Ca 0.16 -0.64 0.02 0.00 -1.71 0.00 0.00 55.69 53.51 2f1w s MET 100 Cb -0.13 -2.69 0.01 0.00 2.01 0.00 0.00 34.83 34.02 2f1w s MET 100 CO 0.04 0.23 -0.09 0.08 -0.01 0.00 0.00 175.02 175.28 2f1w s VAL 101 N 0.33 0.80 -0.07 -6.03 1.01 -0.47 -0.90 120.40 115.06 2f1w s VAL 101 Ca -0.09 -0.33 -0.31 0.00 0.00 0.00 0.00 61.98 61.25 2f1w s VAL 101 Cb -0.15 -0.73 0.08 0.00 0.00 0.00 0.00 36.38 35.57 2f1w s VAL 101 CO 0.05 0.26 0.71 0.00 0.00 0.00 0.00 175.10 176.13 2f1w s MET 102 N 0.43 1.00 0.35 2.72 0.23 -0.85 -0.37 119.30 122.81 2f1w s MET 102 Ca -0.07 0.27 -0.27 0.00 -1.03 0.00 0.00 55.69 54.60 2f1w s MET 102 Cb -0.11 0.47 -0.09 0.00 -1.53 0.00 0.00 34.83 33.57 2f1w s MET 102 CO 0.01 -0.31 1.14 -1.25 -2.03 0.00 0.00 175.02 172.58 2f1w s PRO 103 N -1.12 4.31 0.07 3.16 0.04 -1.26 -0.02 135.00 140.18 2f1w s PRO 103 Ca -0.10 1.81 0.05 0.00 0.04 0.00 0.00 61.00 62.80 2f1w s PRO 103 Cb -0.00 -2.87 -0.03 0.00 0.04 0.00 0.00 34.50 31.64 2f1w s PRO 103 CO 0.09 -0.09 -0.14 1.03 0.04 0.00 0.00 177.00 177.93 2f1w s ARG 104 N -1.98 0.82 -0.26 4.56 1.81 -0.19 -4.82 118.95 118.90 2f1w s ARG 104 Ca 0.52 -0.97 -0.20 0.00 -1.72 0.00 0.00 55.73 53.37 2f1w s ARG 104 Cb -0.31 -0.80 -0.02 0.00 -0.45 0.00 0.00 34.95 33.37 2f1w s ARG 104 CO 0.39 0.18 0.60 0.12 -0.68 0.00 0.00 175.30 175.91 2f1w s PHE 105 N -1.34 3.28 -0.23 -0.53 5.36 -1.26 -0.90 117.98 122.35 2f1w s PHE 105 Ca -0.02 0.77 -0.04 0.00 -0.96 0.00 0.00 56.93 56.69 2f1w s PHE 105 Cb -0.10 -2.82 0.08 0.00 -0.34 0.00 0.00 43.02 39.84 2f1w s PHE 105 CO 0.02 -0.32 0.10 0.71 -1.46 0.00 0.00 175.22 174.27 2f1w s TYR 106 N 2.46 0.49 0.27 10.12 1.51 -0.99 -4.95 117.35 126.26 2f1w s TYR 106 Ca 0.25 -0.71 -0.02 0.00 -1.01 0.00 0.00 57.07 55.58 2f1w s TYR 106 Cb -0.16 -0.90 0.59 0.00 -0.11 0.00 0.00 41.96 41.38 2f1w s TYR 106 CO 0.09 -0.67 1.65 -1.00 -1.11 0.00 0.00 175.55 174.51 2f1w h PRO 107 N 8.36 0.18 -0.00 -1.71 0.13 -1.96 -2.35 132.00 134.65 2f1w h PRO 107 Ca -0.17 -0.01 -0.15 0.00 -0.87 0.00 0.00 66.00 64.80 2f1w h PRO 107 Cb 1.09 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 2f1w h PRO 107 CO 0.36 0.12 -0.72 -0.44 -0.23 0.00 0.00 178.00 177.09 2f1w h ASP 108 N 0.18 0.02 -3.74 1.44 3.45 -1.97 -3.40 116.42 112.39 2f1w h ASP 108 Ca 0.49 -0.01 -0.55 0.00 0.43 0.00 0.00 57.03 57.39 2f1w h ASP 108 Cb 0.93 -0.01 0.19 0.00 -0.56 0.00 0.00 39.33 39.88 2f1w h ASP 108 CO -0.64 0.73 -0.01 -1.14 -1.57 0.00 0.00 179.24 176.61 2f1w n ARG 109 N -3.69 0.26 -0.29 3.56 3.00 -0.88 -4.86 116.66 113.76 2f1w n ARG 109 Ca -0.01 0.15 0.15 0.00 -0.00 0.00 0.00 57.85 58.13 2f1w n ARG 109 Cb 0.70 -2.16 0.28 0.00 0.00 0.00 0.00 32.46 31.29 2f1w n ARG 109 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2f1w n PRO 110 N -2.06 -0.07 -0.15 -0.14 -0.04 -1.26 -0.99 135.00 130.29 2f1w n PRO 110 Ca 0.12 1.25 0.05 0.00 -0.04 0.00 0.00 63.50 64.88 2f1w n PRO 110 Cb 0.50 -2.02 0.07 0.00 -0.04 0.00 0.00 33.50 32.01 2f1w n PRO 110 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2f1w n HIS 111 N -5.17 0.00 -3.01 0.54 8.25 -1.26 -4.99 115.22 109.58 2f1w n HIS 111 Ca 0.22 -0.61 -0.21 0.00 -0.26 0.00 0.00 57.72 56.85 2f1w n HIS 111 Cb 0.71 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.73 2f1w n HIS 111 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2f1w n GLN 112 N -0.85 -3.57 -3.98 -0.41 6.02 -0.16 -4.95 117.38 109.48 2f1w n GLN 112 Ca 0.08 0.68 -0.14 0.00 -0.01 0.00 0.00 57.00 57.61 2f1w n GLN 112 Cb 0.58 -5.42 -0.14 0.00 1.02 0.00 0.00 30.24 26.28 2f1w n GLN 112 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2f1w s LYS 113 N -5.66 0.18 0.17 -1.09 2.20 -1.25 -2.34 119.74 111.95 2f1w s LYS 113 Ca 0.27 -0.06 -0.00 0.00 -0.36 0.00 0.00 55.97 55.81 2f1w s LYS 113 Cb -0.13 -0.19 -0.04 0.00 -1.51 0.00 0.00 37.83 35.95 2f1w s LYS 113 CO 0.33 0.03 0.08 -1.54 -0.36 0.00 0.00 175.35 173.88 2f1w s SER 114 N 0.05 0.50 -0.22 1.43 1.04 -0.08 -1.47 113.70 114.95 2f1w s SER 114 Ca -0.00 -1.28 -0.14 0.00 0.48 0.00 0.00 55.95 55.01 2f1w s SER 114 Cb -0.02 0.28 -0.04 0.00 0.10 0.00 0.00 66.02 66.34 2f1w s SER 114 CO -0.00 -0.74 0.30 -0.69 0.98 0.00 0.00 173.24 173.09 2f1w s VAL 115 N -3.99 5.26 -0.02 5.02 1.01 0.04 -1.02 120.40 126.71 2f1w s VAL 115 Ca 0.30 0.49 -0.17 0.00 0.00 0.00 0.00 61.98 62.60 2f1w s VAL 115 Cb 0.07 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 2f1w s VAL 115 CO 0.07 0.29 0.47 -0.83 0.00 0.00 0.00 175.10 175.10 2f1w s GLY 116 N 1.05 2.50 -0.12 4.51 0.00 0.98 -1.85 107.32 114.38 2f1w s GLY 116 Ca 0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 44.72 44.68 2f1w s GLY 116 CO 0.06 0.43 0.11 -0.12 0.00 0.00 0.00 173.10 173.59 2f1w s PHE 117 N -0.51 0.01 0.11 1.90 5.36 0.27 -2.01 117.98 123.10 2f1w s PHE 117 Ca 0.26 0.13 0.04 0.00 -0.96 0.00 0.00 56.93 56.40 2f1w s PHE 117 Cb -0.17 -0.49 -0.04 0.00 -0.34 0.00 0.00 43.02 41.98 2f1w s PHE 117 CO 0.14 -0.38 -0.11 -0.06 -1.46 0.00 0.00 175.22 173.35 2f1w s PHE 118 N 2.21 1.15 -0.18 10.12 0.40 -0.08 -1.14 117.98 130.46 2f1w s PHE 118 Ca 0.04 -0.67 -0.06 0.00 -0.60 0.00 0.00 56.93 55.64 2f1w s PHE 118 Cb -0.14 -0.61 -0.03 0.00 0.51 0.00 0.00 43.02 42.74 2f1w s PHE 118 CO -0.07 0.03 0.02 -1.17 0.70 0.00 0.00 175.22 174.73 2f1w s LEU 119 N -2.60 3.52 0.00 -0.37 2.96 -0.02 -0.33 118.68 121.84 2f1w s LEU 119 Ca 0.08 -0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.03 2f1w s LEU 119 Cb -0.02 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 2f1w s LEU 119 CO 0.00 0.15 -0.24 -1.58 -1.32 0.00 0.00 176.35 173.37 2f1w s GLN 120 N 0.50 2.07 -0.07 1.98 0.74 0.34 -1.27 119.66 123.94 2f1w s GLN 120 Ca 0.00 -0.96 0.01 0.00 0.05 0.00 0.00 55.36 54.47 2f1w s GLN 120 Cb -0.13 -2.08 0.02 0.00 1.10 0.00 0.00 33.01 31.91 2f1w s GLN 120 CO 0.02 0.55 -0.09 0.00 -0.55 0.00 0.00 175.29 175.22 2f1w n ASN 122 N 4.06 -2.77 0.07 0.00 5.15 -0.21 -4.79 115.26 116.78 2f1w n ASN 122 Ca -0.22 -1.02 -0.03 0.00 -0.60 0.00 0.00 54.58 52.71 2f1w n ASN 122 Cb 0.51 -2.75 0.19 0.00 -0.53 0.00 0.00 39.78 37.20 2f1w n ASN 122 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2f1w h ALA 123 N 0.90 1.02 0.00 5.20 0.00 -1.89 -3.14 119.26 121.35 2f1w h ALA 123 Ca -0.60 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 53.88 2f1w h ALA 123 Cb 1.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2f1w h ALA 123 CO 0.76 0.62 0.00 0.93 0.00 0.00 0.00 179.25 181.56 2f1w h GLU 124 N 0.26 0.00 -6.91 0.00 5.08 -1.96 -3.45 114.58 107.60 2f1w h GLU 124 Ca 0.02 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.87 2f1w h GLU 124 Cb 0.86 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.17 2f1w h GLU 124 CO 0.07 0.00 0.54 0.45 -1.00 0.00 0.00 179.01 179.07 2f1w s SER 125 N -5.40 6.65 0.00 1.42 0.15 -1.19 -4.91 113.70 110.42 2f1w s SER 125 Ca 0.05 2.43 0.26 0.00 0.70 0.00 0.00 55.95 59.39 2f1w s SER 125 Cb 0.08 -2.62 0.85 0.00 -1.71 0.00 0.00 66.02 62.62 2f1w s SER 125 CO 0.57 -0.60 1.63 0.47 1.20 0.00 0.00 173.24 176.51 2f1w n ASP 126 N 0.36 1.82 -4.77 5.45 8.00 -1.26 -4.92 116.55 121.23 2f1w n ASP 126 Ca 0.03 -1.62 -0.40 0.00 0.71 0.00 0.00 54.79 53.50 2f1w n ASP 126 Cb 0.45 -0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.51 2f1w n ASP 126 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2f1w s SER 127 N -1.91 6.58 -0.11 -2.24 0.15 -1.26 -4.93 113.70 109.98 2f1w s SER 127 Ca 0.36 2.61 0.16 0.00 0.70 0.00 0.00 55.95 59.78 2f1w s SER 127 Cb 0.20 -2.64 0.25 0.00 -1.71 0.00 0.00 66.02 62.12 2f1w s SER 127 CO 0.32 -0.66 1.13 0.35 1.20 0.00 0.00 173.24 175.58 2f1w n THR 128 N 0.46 1.65 -2.44 6.45 -2.24 -1.26 -4.74 114.28 112.15 2f1w n THR 128 Ca 0.02 -1.97 -0.14 0.00 -2.27 0.00 0.00 64.05 59.69 2f1w n THR 128 Cb 0.43 -0.13 0.03 0.00 -2.10 0.00 0.00 70.33 68.56 2f1w n THR 128 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2f1w n SER 129 N -1.25 3.32 -4.42 3.42 7.64 -1.26 -4.89 113.62 116.17 2f1w n SER 129 Ca 0.14 -3.00 -0.21 0.00 1.01 0.00 0.00 58.87 56.81 2f1w n SER 129 Cb 0.64 -0.42 -0.10 0.00 -1.01 0.00 0.00 64.21 63.31 2f1w n SER 129 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 2f1w s TRP 130 N -3.62 1.89 -0.05 1.43 1.48 -1.26 -5.14 118.94 113.67 2f1w s TRP 130 Ca 0.39 -0.85 -0.29 0.00 -1.06 0.00 0.00 56.10 54.29 2f1w s TRP 130 Cb 0.38 -1.16 0.09 0.00 -1.16 0.00 0.00 33.47 31.63 2f1w s TRP 130 CO -0.02 0.10 0.80 -1.54 -4.06 0.00 0.00 176.95 172.24 2f1w s SER 131 N -3.44 -0.50 -0.27 -2.66 1.04 -1.26 -4.41 113.70 102.19 2f1w s SER 131 Ca 0.32 0.39 -0.05 0.00 0.48 0.00 0.00 55.95 57.09 2f1w s SER 131 Cb 0.06 0.45 0.14 0.00 0.10 0.00 0.00 66.02 66.77 2f1w s SER 131 CO 0.13 -0.58 0.55 0.00 0.98 0.00 0.00 173.24 174.32 2f1w s HIS 133 N 2.78 3.45 0.05 0.00 2.46 -1.26 -0.43 115.29 122.35 2f1w s HIS 133 Ca 0.06 0.94 0.02 0.00 0.47 0.00 0.00 55.06 56.55 2f1w s HIS 133 Cb -0.14 -2.69 -0.03 0.00 -0.13 0.00 0.00 32.58 29.60 2f1w s HIS 133 CO -0.18 0.00 -0.07 0.00 -2.47 0.00 0.00 174.74 172.02 2f1w s ALA 134 N 1.23 0.62 0.03 1.58 0.00 -0.28 -1.87 121.76 123.07 2f1w s ALA 134 Ca 0.28 -0.91 0.07 0.00 0.00 0.00 0.00 51.96 51.40 2f1w s ALA 134 Cb -0.16 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 2f1w s ALA 134 CO 0.11 -0.10 -0.20 -0.65 0.00 0.00 0.00 175.76 174.92 2f1w s GLN 135 N -2.23 2.07 0.17 0.00 1.11 -0.13 -1.31 119.66 119.33 2f1w s GLN 135 Ca -0.04 -0.97 -0.15 0.00 0.01 0.00 0.00 55.36 54.21 2f1w s GLN 135 Cb -0.05 -2.16 0.02 0.00 -1.01 0.00 0.00 33.01 29.80 2f1w s GLN 135 CO -0.02 0.54 0.43 0.00 0.01 0.00 0.00 175.29 176.26 2f1w s ALA 136 N -0.87 -0.66 -0.18 6.09 0.00 -0.64 -0.69 121.76 124.81 2f1w s ALA 136 Ca 0.14 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.72 2f1w s ALA 136 Cb -0.10 0.81 0.03 0.00 0.00 0.00 0.00 23.12 23.86 2f1w s ALA 136 CO 0.04 -0.72 -0.15 0.08 0.00 0.00 0.00 175.76 175.00 2f1w s VAL 137 N -3.89 1.84 -0.28 0.00 1.01 0.03 -1.18 120.40 117.93 2f1w s VAL 137 Ca 0.10 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 2f1w s VAL 137 Cb 0.01 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.59 2f1w s VAL 137 CO -0.04 0.39 0.19 -0.76 0.00 0.00 0.00 175.10 174.88 2f1w s LEU 138 N 1.36 4.00 0.01 3.92 1.02 0.24 -1.98 118.68 127.25 2f1w s LEU 138 Ca 0.03 -0.02 0.03 0.00 0.02 0.00 0.00 54.13 54.19 2f1w s LEU 138 Cb -0.14 -2.11 -0.01 0.00 0.02 0.00 0.00 46.19 43.94 2f1w s LEU 138 CO -0.11 -0.05 -0.10 -0.75 0.02 0.00 0.00 176.35 175.37 2f1w s LYS 139 N 1.75 0.73 -0.26 1.70 2.20 0.24 -0.75 119.74 125.34 2f1w s LYS 139 Ca 0.07 -0.46 -0.08 0.00 -0.36 0.00 0.00 55.97 55.13 2f1w s LYS 139 Cb -0.16 -0.68 -0.03 0.00 -1.51 0.00 0.00 37.83 35.45 2f1w s LYS 139 CO 0.11 0.18 0.10 0.42 -0.36 0.00 0.00 175.35 175.80 2f1w s ILE 140 N -0.49 4.53 0.20 5.43 1.01 0.03 -0.23 121.20 131.68 2f1w s ILE 140 Ca 0.01 -0.14 -0.30 0.00 0.00 0.00 0.00 60.65 60.22 2f1w s ILE 140 Cb -0.05 -3.15 -0.08 0.00 0.01 0.00 0.00 42.46 39.18 2f1w s ILE 140 CO 0.00 0.29 1.20 -0.63 0.00 0.00 0.00 174.94 175.80 2f1w s ILE 141 N 1.64 3.49 -0.40 2.92 1.01 -0.62 -2.29 121.20 126.95 2f1w s ILE 141 Ca 0.06 1.28 -0.16 0.00 0.00 0.00 0.00 60.65 61.83 2f1w s ILE 141 Cb -0.16 -3.81 0.01 0.00 0.01 0.00 0.00 42.46 38.51 2f1w s ILE 141 CO 0.05 0.22 0.38 0.21 0.00 0.00 0.00 174.94 175.80 2f1w s ASN 142 N 0.03 6.16 0.37 3.58 3.84 -1.26 -4.56 114.94 123.11 2f1w s ASN 142 Ca 0.52 -0.63 0.06 0.00 0.21 0.00 0.00 52.86 53.03 2f1w s ASN 142 Cb -0.33 -2.20 0.77 0.00 -0.55 0.00 0.00 41.25 38.94 2f1w s ASN 142 CO 0.38 -0.48 1.99 1.88 -2.79 0.00 0.00 177.10 178.08 2f1w h TYR 143 N 8.64 0.69 0.16 0.43 -1.99 -1.18 -3.23 116.97 120.50 2f1w h TYR 143 Ca -0.27 0.02 -0.31 0.00 2.00 0.00 0.00 58.73 60.16 2f1w h TYR 143 Cb 1.12 -0.23 0.01 0.00 2.00 0.00 0.00 36.73 39.63 2f1w h TYR 143 CO 0.62 0.39 -1.47 0.00 -0.00 0.00 0.00 178.16 177.70 2f1w h ARG 144 N 0.71 0.34 -3.16 4.88 3.08 -1.93 -3.45 114.38 114.85 2f1w h ARG 144 Ca 0.26 -0.59 -0.39 0.00 0.07 0.00 0.00 59.98 59.34 2f1w h ARG 144 Cb 0.15 0.22 -0.39 0.00 0.08 0.00 0.00 29.97 30.03 2f1w h ARG 144 CO -0.08 1.25 -0.72 0.34 -1.07 0.00 0.00 179.97 179.69 2f1w s ASP 145 N -7.21 1.48 0.18 7.04 -1.08 -1.22 -5.00 116.67 110.86 2f1w s ASP 145 Ca -0.08 -0.12 0.18 0.00 -0.52 0.00 0.00 52.55 52.00 2f1w s ASP 145 Cb 0.06 -0.09 0.81 0.00 -1.46 0.00 0.00 42.92 42.24 2f1w s ASP 145 CO 0.88 -0.28 1.55 -0.90 0.52 0.00 0.00 175.17 176.94 2f1w n ASP 146 N 5.30 0.41 0.04 -0.34 3.85 -1.26 -1.06 116.55 123.49 2f1w n ASP 146 Ca -0.05 0.63 0.13 0.00 -0.71 0.00 0.00 54.79 54.79 2f1w n ASP 146 Cb 0.50 -0.71 0.36 0.00 -1.35 0.00 0.00 41.12 39.92 2f1w n ASP 146 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2f1w n GLU 147 N -1.98 0.13 -0.33 0.11 -0.58 -1.26 -3.82 120.64 112.92 2f1w n GLU 147 Ca 0.01 0.07 0.08 0.00 -0.42 0.00 0.00 57.16 56.90 2f1w n GLU 147 Cb 0.14 -1.61 0.23 0.00 -0.57 0.00 0.00 31.44 29.62 2f1w n GLU 147 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2f1w n LYS 148 N -1.82 3.02 -1.69 3.49 5.02 -0.22 -4.99 118.16 120.96 2f1w n LYS 148 Ca 0.05 -2.42 -0.32 0.00 -2.02 0.00 0.00 58.31 53.60 2f1w n LYS 148 Cb 0.38 -1.52 0.05 0.00 -0.02 0.00 0.00 35.03 33.93 2f1w n LYS 148 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2f1w s SER 149 N -1.15 5.14 -0.14 4.39 0.01 -1.24 -4.68 113.70 116.03 2f1w s SER 149 Ca 0.35 1.89 0.00 0.00 1.31 0.00 0.00 55.95 59.50 2f1w s SER 149 Cb 0.21 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.90 2f1w s SER 149 CO 0.18 -1.61 -0.15 0.12 0.41 0.00 0.00 173.24 172.20 2f1w s PHE 150 N -2.55 2.77 0.04 2.43 5.36 -0.97 -4.95 117.98 120.12 2f1w s PHE 150 Ca 0.64 -0.86 -0.05 0.00 -0.96 0.00 0.00 56.93 55.71 2f1w s PHE 150 Cb -0.18 -1.85 -0.02 0.00 -0.34 0.00 0.00 43.02 40.63 2f1w s PHE 150 CO 0.45 -0.35 0.08 -1.54 -1.46 0.00 0.00 175.22 172.39 2f1w s SER 151 N 0.57 0.23 -0.00 6.13 1.04 -1.26 -0.79 113.70 119.62 2f1w s SER 151 Ca -0.09 -0.63 0.01 0.00 0.48 0.00 0.00 55.95 55.72 2f1w s SER 151 Cb -0.16 0.23 -0.00 0.00 0.10 0.00 0.00 66.02 66.18 2f1w s SER 151 CO 0.04 -0.54 -0.04 -0.13 0.98 0.00 0.00 173.24 173.55 2f1w s ARG 152 N -2.92 0.31 0.02 4.02 0.52 0.07 -4.97 118.95 116.01 2f1w s ARG 152 Ca -0.02 -0.16 -0.03 0.00 -0.52 0.00 0.00 55.73 54.99 2f1w s ARG 152 Cb 0.01 -0.28 -0.04 0.00 0.52 0.00 0.00 34.95 35.15 2f1w s ARG 152 CO -0.06 0.08 0.23 1.03 0.02 0.00 0.00 175.30 176.60 2f1w s ARG 153 N -0.15 3.50 0.14 3.54 0.52 -1.26 -0.59 118.95 124.64 2f1w s ARG 153 Ca 0.01 -0.25 0.01 0.00 -0.52 0.00 0.00 55.73 54.97 2f1w s ARG 153 Cb -0.02 -3.06 -0.04 0.00 0.52 0.00 0.00 34.95 32.35 2f1w s ARG 153 CO -0.00 0.63 0.00 0.96 0.02 0.00 0.00 175.30 176.92 2f1w s ILE 154 N -1.39 0.48 -0.08 1.52 -4.36 -0.33 -4.99 121.20 112.06 2f1w s ILE 154 Ca 0.30 -1.94 -0.03 0.00 -0.26 0.00 0.00 60.65 58.72 2f1w s ILE 154 Cb -0.13 -1.99 0.04 0.00 1.25 0.00 0.00 42.46 41.64 2f1w s ILE 154 CO 0.20 -0.57 0.16 -0.55 0.24 0.00 0.00 174.94 174.42 2f1w s SER 155 N -3.10 0.41 -0.14 4.36 0.15 -1.26 -1.62 113.70 112.50 2f1w s SER 155 Ca 0.21 0.33 -0.25 0.00 0.70 0.00 0.00 55.95 56.94 2f1w s SER 155 Cb 0.07 0.25 0.06 0.00 -1.71 0.00 0.00 66.02 64.69 2f1w s SER 155 CO 0.01 -0.21 0.61 -2.28 1.20 0.00 0.00 173.24 172.57 2f1w s HIS 156 N 1.87 -0.62 -0.55 3.44 5.04 -0.43 -5.01 115.29 119.03 2f1w s HIS 156 Ca -0.02 1.31 -0.21 0.00 -1.54 0.00 0.00 55.06 54.61 2f1w s HIS 156 Cb -0.12 0.29 0.06 0.00 0.04 0.00 0.00 32.58 32.85 2f1w s HIS 156 CO -0.06 -0.45 0.77 -1.17 -2.34 0.00 0.00 174.74 171.49 2f1w s LEU 157 N -0.44 4.72 0.09 8.88 1.98 -1.26 -1.13 118.68 131.51 2f1w s LEU 157 Ca -0.06 -0.86 -0.29 0.00 -2.89 0.00 0.00 54.13 50.03 2f1w s LEU 157 Cb -0.03 -2.52 -0.05 0.00 0.66 0.00 0.00 46.19 44.25 2f1w s LEU 157 CO 0.05 -1.09 0.91 -0.36 -1.89 0.00 0.00 176.35 173.96 2f1w s PHE 158 N 3.19 3.78 0.34 5.38 0.40 0.43 -4.89 117.98 126.62 2f1w s PHE 158 Ca 0.19 1.71 -0.18 0.00 -0.60 0.00 0.00 56.93 58.06 2f1w s PHE 158 Cb -0.18 -3.00 0.04 0.00 0.51 0.00 0.00 43.02 40.39 2f1w s PHE 158 CO 0.13 0.21 0.76 -0.59 0.70 0.00 0.00 175.22 176.42 2f1w s PHE 159 N 0.06 0.00 0.36 0.36 -0.12 -1.13 -1.26 117.98 116.26 2f1w s PHE 159 Ca 0.45 -0.60 0.12 0.00 -0.05 0.00 0.00 56.93 56.85 2f1w s PHE 159 Cb -0.22 0.78 0.91 0.00 -0.63 0.00 0.00 43.02 43.86 2f1w s PHE 159 CO 0.28 -1.44 1.80 1.12 -0.05 0.00 0.00 175.22 176.93 2f1w h HIS 160 N 2.00 0.83 0.00 3.49 2.07 -1.85 -1.43 115.15 120.26 2f1w h HIS 160 Ca -0.27 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.28 2f1w h HIS 160 Cb 1.25 -0.25 0.00 0.00 2.57 0.00 0.00 27.41 30.98 2f1w h HIS 160 CO 1.01 0.18 -0.20 0.87 -3.07 0.00 0.00 177.93 176.72 2f1w h LYS 161 N 0.59 0.00 -2.07 5.12 1.57 -1.96 -3.37 116.57 116.45 2f1w h LYS 161 Ca 0.54 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.76 2f1w h LYS 161 Cb 1.08 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 33.00 2f1w h LYS 161 CO -0.30 0.00 -1.05 0.39 -0.57 0.00 0.00 179.45 177.93 2f1w n GLU 162 N -2.74 0.82 -0.04 3.15 1.02 -0.60 -4.96 120.64 117.30 2f1w n GLU 162 Ca 0.04 -3.35 0.12 0.00 -0.02 0.00 0.00 57.16 53.95 2f1w n GLU 162 Cb 0.50 -1.36 0.49 0.00 -0.02 0.00 0.00 31.44 31.05 2f1w n GLU 162 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2f1w n ASN 163 N 1.51 1.34 -4.03 1.62 2.04 -0.84 -2.83 115.26 114.08 2f1w n ASN 163 Ca 0.23 -1.55 -0.08 0.00 -0.44 0.00 0.00 54.58 52.74 2f1w n ASN 163 Cb 0.51 -0.05 -0.10 0.00 -2.53 0.00 0.00 39.78 37.61 2f1w n ASN 163 CO 0.00 0.00 0.00 1.51 -0.44 0.00 0.00 177.26 178.33 2f1w s ASP 164 N -1.78 0.35 -0.23 0.53 3.84 -1.26 -0.31 116.67 117.81 2f1w s ASP 164 Ca 0.35 -0.72 -0.20 0.00 -0.00 0.00 0.00 52.55 51.98 2f1w s ASP 164 Cb 0.19 0.15 0.06 0.00 -1.38 0.00 0.00 42.92 41.94 2f1w s ASP 164 CO 0.30 -0.45 0.61 0.86 -0.00 0.00 0.00 175.17 176.49 2f1w s TRP 165 N -2.63 -0.70 -2.09 2.11 -0.11 -0.40 -4.97 118.94 110.15 2f1w s TRP 165 Ca -0.05 1.67 0.00 0.00 1.22 0.00 0.00 56.10 58.94 2f1w s TRP 165 Cb -0.01 0.27 0.00 0.00 -1.50 0.00 0.00 33.47 32.22 2f1w s TRP 165 CO -0.05 -0.34 0.00 0.41 -4.62 0.00 0.00 176.95 172.35 2f1w n GLY 166 N 2.94 -0.65 3.02 5.86 0.00 -1.26 -0.84 105.19 114.26 2f1w n GLY 166 Ca -0.15 -0.54 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 2f1w n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2f1w s PHE 167 N -3.81 1.72 -0.42 1.61 0.40 -0.29 -4.99 117.98 112.21 2f1w s PHE 167 Ca 0.00 -0.77 0.23 0.00 -0.60 0.00 0.00 56.93 55.79 2f1w s PHE 167 Cb 0.00 -1.28 0.30 0.00 0.51 0.00 0.00 43.02 42.55 2f1w s PHE 167 CO 0.00 -0.42 1.51 0.66 0.70 0.00 0.00 175.22 177.66 2f1w h SER 168 N 7.43 0.00 -1.71 1.36 4.64 -1.85 0.80 113.55 124.22 2f1w h SER 168 Ca -0.31 -0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.47 2f1w h SER 168 Cb 1.17 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.85 2f1w h SER 168 CO 0.47 0.00 -0.85 -3.20 -0.87 0.00 0.00 176.83 172.38 2f1w n ASN 169 N -2.97 3.57 -0.11 4.97 5.15 -1.26 -3.85 115.26 120.76 2f1w n ASN 169 Ca 0.03 -3.44 -0.09 0.00 -0.60 0.00 0.00 54.58 50.49 2f1w n ASN 169 Cb 0.53 -0.52 -0.01 0.00 -0.53 0.00 0.00 39.78 39.25 2f1w n ASN 169 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2f1w h PHE 170 N 2.82 0.47 -2.50 1.20 3.57 -1.47 -3.46 116.94 117.57 2f1w h PHE 170 Ca 0.15 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.57 2f1w h PHE 170 Cb 0.85 -0.16 -0.19 0.00 2.79 0.00 0.00 35.95 39.24 2f1w h PHE 170 CO 0.72 0.33 -0.04 1.41 -2.23 0.00 0.00 178.31 178.51 2f1w s MET 171 N -6.04 0.87 0.33 1.11 0.00 -1.24 -4.99 119.30 109.33 2f1w s MET 171 Ca -0.13 0.04 -0.29 0.00 0.00 0.00 0.00 55.69 55.31 2f1w s MET 171 Cb 0.10 0.40 -0.11 0.00 0.00 0.00 0.00 34.83 35.23 2f1w s MET 171 CO 0.72 -0.26 1.43 0.00 0.00 0.00 0.00 175.02 176.91 2f1w s ALA 172 N -1.26 3.58 0.35 4.11 0.00 -1.26 -0.78 121.76 126.49 2f1w s ALA 172 Ca -0.12 1.42 0.03 0.00 0.00 0.00 0.00 51.96 53.28 2f1w s ALA 172 Cb -0.03 -3.56 0.64 0.00 0.00 0.00 0.00 23.12 20.18 2f1w s ALA 172 CO 0.07 -0.84 1.98 2.35 0.00 0.00 0.00 175.76 179.32 2f1w h TRP 173 N 3.72 0.74 0.00 0.00 2.91 -1.54 -1.68 115.95 120.08 2f1w h TRP 173 Ca -0.49 -0.00 -0.07 0.00 1.13 0.00 0.00 58.89 59.46 2f1w h TRP 173 Cb 1.23 -0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 29.63 2f1w h TRP 173 CO 0.56 0.50 -0.33 0.66 -1.03 0.00 0.00 178.44 178.80 2f1w h SER 174 N 0.77 0.00 0.05 2.65 4.64 -1.90 -2.40 113.55 117.35 2f1w h SER 174 Ca 0.20 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.45 2f1w h SER 174 Cb -0.01 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.09 2f1w h SER 174 CO -0.04 0.33 -0.29 -0.08 -0.87 0.00 0.00 176.83 175.89 2f1w h GLU 175 N 0.00 0.11 -0.24 4.77 4.81 -1.70 -2.88 114.58 119.45 2f1w h GLU 175 Ca -0.00 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 2f1w h GLU 175 Cb 0.67 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 2f1w h GLU 175 CO 0.04 1.07 0.05 -0.24 -0.73 0.00 0.00 179.01 179.20 2f1w h VAL 176 N -0.74 1.13 -0.10 0.32 3.04 -1.38 -2.43 116.25 116.08 2f1w h VAL 176 Ca -0.05 -0.45 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 2f1w h VAL 176 Cb 1.20 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.38 2f1w h VAL 176 CO 0.05 0.16 0.00 0.35 -1.01 0.00 0.00 177.57 177.12 2f1w n THR 177 N -4.39 0.12 -2.19 3.17 -2.24 -0.91 -3.85 114.28 103.99 2f1w n THR 177 Ca 0.01 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 60.98 2f1w n THR 177 Cb 0.16 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.10 2f1w n THR 177 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2f1w s ASP 178 N -1.82 6.02 0.00 3.42 -1.08 -0.92 -4.84 116.67 117.45 2f1w s ASP 178 Ca 0.34 0.86 0.00 0.00 -0.52 0.00 0.00 52.55 53.24 2f1w s ASP 178 Cb 0.20 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.13 2f1w s ASP 178 CO 0.31 -1.69 0.42 -0.81 0.52 0.00 0.00 175.17 173.92 2f1w n PRO 179 N 8.42 0.00 -0.00 4.34 -0.04 -1.26 -1.25 135.00 145.21 2f1w n PRO 179 Ca 0.19 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.70 2f1w n PRO 179 Cb 0.48 -1.46 -0.07 0.00 -0.04 0.00 0.00 33.50 32.41 2f1w n PRO 179 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2f1w n GLU 180 N -0.91 2.73 0.03 0.54 2.13 -1.26 -4.57 120.64 119.34 2f1w n GLU 180 Ca 0.00 -0.02 0.12 0.00 0.66 0.00 0.00 57.16 57.92 2f1w n GLU 180 Cb 0.00 -1.06 0.26 0.00 0.27 0.00 0.00 31.44 30.90 2f1w n GLU 180 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2f1w n LYS 181 N -1.40 0.15 -0.62 5.31 5.02 -0.38 -4.98 118.16 121.25 2f1w n LYS 181 Ca 0.01 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2f1w n LYS 181 Cb 0.19 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2f1w n LYS 181 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f1w n GLY 182 N 1.41 0.69 0.32 0.72 0.00 -1.26 -4.93 105.19 102.14 2f1w n GLY 182 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.17 2f1w n GLY 182 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2f1w n PHE 183 N -2.60 0.00 -4.13 1.61 3.01 -1.26 -0.58 117.46 113.51 2f1w n PHE 183 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.31 2f1w n PHE 183 Cb 0.00 -0.01 -0.14 0.00 -0.01 0.00 0.00 39.48 39.32 2f1w n PHE 183 CO 0.00 0.00 0.00 -1.50 1.01 0.00 0.00 176.76 176.27 2f1w s ILE 184 N -2.66 0.38 -0.16 4.37 2.07 -1.25 -4.41 121.20 119.54 2f1w s ILE 184 Ca 0.15 -0.21 -0.07 0.00 -1.41 0.00 0.00 60.65 59.11 2f1w s ILE 184 Cb 0.17 -0.32 0.07 0.00 0.13 0.00 0.00 42.46 42.51 2f1w s ILE 184 CO 0.67 0.10 0.35 -0.62 -1.91 0.00 0.00 174.94 173.53 2f1w s ASP 185 N -0.13 -0.20 -1.47 4.50 -1.08 -0.80 -4.84 116.67 112.66 2f1w s ASP 185 Ca 0.02 0.79 -0.08 0.00 -0.52 0.00 0.00 52.55 52.75 2f1w s ASP 185 Cb -0.02 0.85 0.03 0.00 -1.46 0.00 0.00 42.92 42.31 2f1w s ASP 185 CO -0.00 -0.21 0.84 -0.67 0.52 0.00 0.00 175.17 175.65 2f1w n ASP 186 N 4.82 -5.82 -2.98 -0.34 2.03 -1.26 -1.29 116.55 111.71 2f1w n ASP 186 Ca -0.16 -0.45 -0.22 0.00 0.52 0.00 0.00 54.79 54.48 2f1w n ASP 186 Cb 0.52 -4.65 0.03 0.00 -0.72 0.00 0.00 41.12 36.30 2f1w n ASP 186 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2f1w n ASP 187 N -2.71 -6.02 -4.11 1.67 4.64 -1.26 -4.68 116.55 104.08 2f1w n ASP 187 Ca -0.04 -0.27 -0.27 0.00 -1.38 0.00 0.00 54.79 52.83 2f1w n ASP 187 Cb 0.58 -4.88 -0.17 0.00 -1.04 0.00 0.00 41.12 35.62 2f1w n ASP 187 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 2f1w s LYS 188 N -5.66 2.12 -0.08 -0.67 1.02 -0.41 -1.10 119.74 114.94 2f1w s LYS 188 Ca 0.28 -0.60 0.05 0.00 0.02 0.00 0.00 55.97 55.72 2f1w s LYS 188 Cb -0.13 -1.71 -0.00 0.00 -0.52 0.00 0.00 37.83 35.47 2f1w s LYS 188 CO 0.35 0.13 -0.24 0.08 -0.92 0.00 0.00 175.35 174.75 2f1w s VAL 189 N 0.40 2.04 -0.20 3.17 1.01 -0.83 -1.90 120.40 124.09 2f1w s VAL 189 Ca -0.13 -1.02 -0.05 0.00 0.00 0.00 0.00 61.98 60.77 2f1w s VAL 189 Cb -0.15 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 2f1w s VAL 189 CO 0.05 0.56 0.01 -0.89 0.00 0.00 0.00 175.10 174.83 2f1w s THR 190 N 0.17 4.08 -0.01 3.92 2.01 -1.26 -0.81 115.64 123.75 2f1w s THR 190 Ca -0.14 -0.27 -0.01 0.00 0.31 0.00 0.00 61.69 61.58 2f1w s THR 190 Cb -0.16 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 2f1w s THR 190 CO 0.07 0.43 0.10 -0.36 -0.69 0.00 0.00 174.62 174.17 2f1w s PHE 191 N 0.96 3.33 0.01 4.92 0.40 0.23 -1.59 117.98 126.24 2f1w s PHE 191 Ca 0.02 0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.60 2f1w s PHE 191 Cb -0.14 -1.76 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 2f1w s PHE 191 CO 0.02 0.57 -0.04 -2.00 0.70 0.00 0.00 175.22 174.47 2f1w s GLU 192 N -1.76 0.31 -0.04 0.44 2.12 0.68 -0.35 118.70 120.10 2f1w s GLU 192 Ca 0.23 -0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.30 2f1w s GLU 192 Cb -0.12 -0.22 0.02 0.00 0.26 0.00 0.00 34.13 34.07 2f1w s GLU 192 CO 0.15 0.05 -0.06 0.08 -0.54 0.00 0.00 175.26 174.94 2f1w s VAL 193 N -0.45 0.63 -0.21 3.70 1.01 -0.29 -0.59 120.40 124.19 2f1w s VAL 193 Ca -0.03 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 61.70 2f1w s VAL 193 Cb -0.04 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 2f1w s VAL 193 CO -0.00 0.24 -0.01 0.12 0.00 0.00 0.00 175.10 175.45 2f1w s PHE 194 N 0.70 3.01 -0.02 5.22 5.36 -0.84 -1.11 117.98 130.31 2f1w s PHE 194 Ca -0.10 -0.59 0.04 0.00 -0.96 0.00 0.00 56.93 55.31 2f1w s PHE 194 Cb -0.13 -2.10 -0.01 0.00 -0.34 0.00 0.00 43.02 40.44 2f1w s PHE 194 CO 0.01 -0.34 -0.14 0.54 -1.46 0.00 0.00 175.22 173.83 2f1w s VAL 195 N 1.20 1.11 -0.11 3.12 0.11 -0.06 -0.79 120.40 124.98 2f1w s VAL 195 Ca 0.03 -0.58 0.02 0.00 -2.93 0.00 0.00 61.98 58.51 2f1w s VAL 195 Cb -0.15 -0.94 0.01 0.00 -1.53 0.00 0.00 36.38 33.78 2f1w s VAL 195 CO 0.01 0.32 -0.15 -1.10 -3.33 0.00 0.00 175.10 170.84 2f1w s GLN 196 N -0.20 2.23 0.08 1.54 -0.21 0.14 -1.74 119.66 121.49 2f1w s GLN 196 Ca 0.03 -0.56 0.03 0.00 0.02 0.00 0.00 55.36 54.87 2f1w s GLN 196 Cb -0.07 -1.91 -0.03 0.00 1.00 0.00 0.00 33.01 32.00 2f1w s GLN 196 CO -0.00 -0.07 -0.09 0.00 -2.12 0.00 0.00 175.29 173.01 2f1w s ALA 197 N 1.01 0.91 0.27 6.09 0.00 -0.63 -0.96 121.76 128.45 2f1w s ALA 197 Ca -0.06 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.89 2f1w s ALA 197 Cb -0.15 0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.06 2f1w s ALA 197 CO -0.02 -0.05 0.33 -0.40 0.00 0.00 0.00 175.76 175.62 2f1w n ASP 198 N 0.83 1.19 -3.50 0.00 5.75 -0.78 -4.79 116.55 115.24 2f1w n ASP 198 Ca -0.18 -1.76 -0.11 0.00 -0.01 0.00 0.00 54.79 52.73 2f1w n ASP 198 Cb 0.57 -0.15 -0.03 0.00 -1.03 0.00 0.00 41.12 40.48 2f1w n ASP 198 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2f1w s ALA 199 N -2.33 -1.78 0.78 2.12 0.00 -1.26 -4.43 121.76 114.86 2f1w s ALA 199 Ca 0.25 1.02 -0.11 0.00 0.00 0.00 0.00 51.96 53.12 2f1w s ALA 199 Cb -0.02 0.29 0.06 0.00 0.00 0.00 0.00 23.12 23.45 2f1w s ALA 199 CO 0.16 -0.60 1.08 -1.25 0.00 0.00 0.00 175.76 175.15 2f1w s PRO 200 N -2.66 2.24 0.37 0.00 0.04 -1.26 -5.05 135.00 128.68 2f1w s PRO 200 Ca 0.00 0.89 -0.13 0.00 0.04 0.00 0.00 61.00 61.80 2f1w s PRO 200 Cb -0.01 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.67 2f1w s PRO 200 CO -0.05 -1.57 0.73 -2.39 0.04 0.00 0.00 177.00 173.75 2f1w n HIS 201 N -3.44 -2.24 -1.14 0.56 1.44 -1.26 -5.07 115.22 104.07 2f1w n HIS 201 Ca 0.08 -1.76 0.05 0.00 -2.01 0.00 0.00 57.72 54.07 2f1w n HIS 201 Cb 0.54 0.85 0.23 0.00 0.12 0.00 0.00 29.99 31.73 2f1w n HIS 201 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2f1w n GLY 202 N -0.50 4.41 3.49 -1.39 0.00 -1.26 -4.90 105.19 105.03 2f1w n GLY 202 Ca -0.08 -1.11 -0.43 0.00 0.00 0.00 0.00 46.02 44.40 2f1w n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f1w s VAL 203 N -2.96 4.43 0.19 1.61 1.01 -1.26 -4.92 120.40 118.49 2f1w s VAL 203 Ca 0.42 -1.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.15 2f1w s VAL 203 Cb 0.35 -4.87 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 2f1w s VAL 203 CO 0.05 -1.65 0.14 0.00 0.00 0.00 0.00 175.10 173.64 2f1w s ALA 204 N 3.54 1.01 0.07 5.51 0.00 -1.26 -5.18 121.76 125.45 2f1w s ALA 204 Ca 0.36 -1.59 -0.12 0.00 0.00 0.00 0.00 51.96 50.61 2f1w s ALA 204 Cb -0.04 1.26 0.01 0.00 0.00 0.00 0.00 23.12 24.35 2f1w s ALA 204 CO -0.08 -0.58 0.27 1.67 0.00 0.00 0.00 175.76 177.03 2f1w s TRP 205 N -4.13 -0.02 -2.00 0.00 -2.14 -1.26 -5.30 118.94 104.10 2f1w s TRP 205 Ca 0.35 -0.25 0.12 0.00 2.66 0.00 0.00 56.10 58.97 2f1w s TRP 205 Cb 0.07 0.06 0.69 0.00 -3.10 0.00 0.00 33.47 31.19 2f1w s TRP 205 CO 0.09 -0.54 1.13 -3.47 -2.66 0.00 0.00 176.95 171.51