# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 V C C 67.88 11.88 12.28 24.74 121.76 -166.53 -114.48 132.82 97.65 2.34 0.00 97.92 0.07 0.01 0.00 0.00 0.00 1.96 0.04 1 Q E E 117.79 3.36 14.80 19.45 120.00 -159.64 -111.48 133.98 48.78 50.96 0.25 48.27 0.54 0.19 0.10 0.09 0.00 49.08 1.73 2 I E E 87.97 9.83 9.40 20.28 114.63 -145.66 -99.26 123.46 33.40 66.08 0.52 31.00 1.63 0.35 0.20 0.27 0.00 63.98 2.58 3 V E E 85.95 4.32 13.46 19.11 114.02 -171.08 -105.01 127.02 43.46 56.07 0.47 35.88 6.00 0.81 0.12 0.31 0.00 56.12 0.75 4 Y E E 134.82 7.47 10.79 19.66 120.74 -136.23 -113.67 134.37 49.57 49.97 0.46 37.85 10.48 1.15 0.10 0.36 0.00 49.04 1.02 5 K C E 124.55 3.63 13.52 18.99 126.20 -169.82 -127.56 140.47 54.39 45.48 0.12 40.01 13.70 0.38 0.03 0.10 0.00 45.07 0.72 6 P C C 97.48 4.52 12.92 19.09 114.22 -104.51 -66.25 143.42 57.75 42.05 0.20 49.99 6.59 0.46 0.05 0.16 0.00 41.25 1.49 7 V C C 56.47 12.41 9.05 22.00 122.38 -147.08 -111.34 139.12 64.04 35.72 0.24 59.98 3.31 0.22 0.11 0.14 0.00 31.25 4.99 8 D C C 92.60 2.58 17.46 20.01 108.22 -126.59 -85.96 114.85 73.21 26.61 0.17 74.35 0.76 0.10 0.07 0.07 0.00 21.44 3.21 9 L H G 63.52 14.96 8.96 23.73 93.55 -165.75 -68.40 -18.61 25.33 2.48 72.20 12.99 3.45 7.12 5.96 68.10 0.00 2.20 0.18 10 S H G 87.52 2.00 14.67 17.44 90.51 71.99 -68.50 -17.60 23.88 2.35 73.77 4.06 3.91 13.87 5.13 70.78 0.01 2.06 0.19 11 K H G 142.83 1.99 15.20 17.40 95.75 54.77 -92.57 -2.48 23.70 2.23 74.07 5.13 4.97 11.08 5.19 71.46 0.00 2.00 0.17 12 V C C 36.68 16.72 6.87 22.47 114.94 102.78 -83.57 129.89 71.46 17.62 10.92 52.98 15.63 2.78 7.20 3.83 0.05 8.56 8.96 13 T C C 101.40 2.31 17.00 19.35 104.10 -167.58 -100.71 -8.96 75.76 15.57 8.67 59.88 9.25 5.60 5.42 3.69 0.02 10.16 5.98 14 S C C 61.60 6.53 14.08 21.88 123.67 46.32 -112.46 150.96 74.77 14.65 10.58 39.09 22.40 14.72 4.13 5.96 0.12 9.84 3.74 15 K C C 127.41 6.10 15.42 22.78 109.97 -118.95 -90.23 118.78 75.30 14.47 10.23 40.59 19.54 16.17 3.55 6.29 0.09 8.65 5.12 16 C C T 62.88 11.10 12.40 23.82 111.22 -137.45 -84.84 123.53 77.06 13.92 9.01 26.27 20.62 31.23 2.60 6.01 0.07 8.39 4.81 17 G C T 45.19 5.74 16.38 22.89 101.77 14.19 86.35 -4.91 85.67 7.95 6.38 29.29 24.42 32.66 1.24 4.99 0.01 5.24 2.16 18 S C C 51.55 7.05 14.87 23.08 118.96 117.54 -96.52 148.39 80.30 12.70 7.00 51.46 18.30 9.84 1.96 5.34 0.01 6.64 6.45 19 L C T 97.88 8.78 13.25 22.76 97.62 -122.44 -69.45 -21.23 78.01 7.33 14.66 13.41 16.27 48.33 2.40 11.94 0.05 4.62 2.97 20 G C T 47.78 4.75 15.80 21.37 98.72 61.18 -66.95 -20.20 83.43 3.80 12.77 11.94 17.28 54.06 1.53 11.30 0.01 2.77 1.11 21 N C C 86.40 7.04 15.28 23.21 102.31 51.58 -96.62 22.52 76.60 13.34 10.06 40.27 17.44 19.27 1.45 9.14 0.01 9.96 2.45 22 I C C 56.59 14.48 11.44 25.98 114.74 121.26 -94.01 128.32 58.91 40.08 1.01 46.27 10.04 2.48 0.30 0.85 0.00 35.53 4.52 23 H E E 115.34 5.56 17.87 24.29 113.66 -164.73 -104.34 118.72 33.22 66.00 0.78 26.80 5.17 1.66 0.24 0.59 0.00 62.60 2.94 24 H E E 77.95 11.98 12.66 25.18 124.69 138.84 -112.65 143.58 29.96 69.47 0.57 24.80 3.39 0.69 0.27 0.36 0.00 60.44 10.06 25 K C C 125.58 4.64 16.31 22.23 116.79 -135.43 -98.96 130.44 74.91 24.70 0.39 67.74 5.24 1.04 0.08 0.34 0.00 23.59 1.96 26 P C T 72.94 9.83 11.57 22.25 111.42 -106.96 -65.49 141.38 84.72 10.52 4.76 25.25 16.24 43.10 0.37 4.88 0.00 9.07 1.07 27 G C T 54.42 3.50 14.82 18.74 101.23 14.84 84.13 -2.10 87.28 6.42 6.31 12.49 18.81 55.49 0.45 6.57 0.00 4.90 1.29 28 G C T 46.92 5.27 13.81 19.97 112.13 -23.48 105.33 -7.79 87.13 6.22 6.64 21.15 30.66 35.26 0.47 6.84 0.00 4.33 1.30 29 G C C 38.70 6.45 13.36 20.90 120.37 -62.84 103.91 -172.85 82.78 14.73 2.48 41.03 29.19 13.09 0.36 2.24 0.00 12.47 1.62 30 Q C C 120.54 4.72 15.21 21.08 117.46 -70.94 -97.75 135.37 56.71 41.86 1.43 45.48 8.95 2.15 0.50 1.01 0.00 38.86 3.05 31 V E E 56.69 12.58 11.35 24.75 121.99 -165.76 -114.35 135.36 29.15 69.99 0.87 26.50 2.08 0.48 0.57 0.37 0.00 67.33 2.66 32 E E E 117.98 4.16 16.78 22.18 118.61 -151.35 -104.60 132.02 22.92 75.95 1.13 20.46 1.95 0.53 0.77 0.45 0.00 73.20 2.64 33 V E E 55.81 13.09 9.62 23.04 116.78 -150.57 -100.33 126.81 43.21 53.75 3.03 36.78 4.42 1.77 1.67 1.42 0.00 51.34 2.60 34 K C C 137.83 3.34 13.35 17.83 106.52 -157.80 -83.37 60.03 76.86 17.66 5.48 42.30 20.84 13.61 1.83 3.57 0.01 16.71 1.13 35 S C S 78.28 3.46 11.73 16.39 113.41 35.67 -102.95 119.99 80.69 11.21 8.10 30.72 33.89 16.98 2.40 5.37 0.02 9.30 1.32 36 E C C 126.45 4.11 11.96 17.64 116.52 -4.54 -97.68 136.82 75.36 15.67 8.96 46.42 20.93 8.28 3.12 5.86 0.02 13.74 1.62 37 K C C 141.63 3.81 12.37 18.04 116.31 -121.19 -89.24 134.17 69.00 23.56 7.45 57.75 6.70 4.06 3.48 4.11 0.02 19.39 4.50 38 L C C 61.75 12.44 9.24 22.16 118.39 -148.26 -101.08 134.11 70.41 24.90 4.69 61.83 6.04 1.94 3.14 1.78 0.01 20.27 5.00 39 D C C 88.44 3.32 17.08 20.90 108.67 -138.22 -91.76 108.58 80.02 16.48 3.49 74.54 3.50 1.58 2.44 1.07 0.00 13.48 3.38 40 F C C 64.32 14.38 10.47 25.00 96.73 173.88 -80.02 -16.74 50.16 2.85 46.99 41.69 4.58 5.04 38.62 7.35 0.01 1.82 0.89 41 K H H 121.94 5.39 13.08 20.24 92.73 80.40 -62.45 -37.15 21.60 1.95 76.46 8.42 3.59 9.64 56.95 19.37 0.14 1.45 0.44 42 D H H 111.19 1.43 15.73 16.50 93.98 48.91 -74.36 -22.35 21.40 2.57 76.03 6.87 3.86 10.80 57.06 18.69 0.24 1.97 0.51 43 R H H 110.78 7.40 13.38 21.87 98.67 49.63 -90.18 -16.52 24.68 4.27 71.05 10.06 5.37 10.41 55.89 13.86 0.28 3.19 0.93 44 V H H 46.42 14.25 9.65 23.61 106.62 81.13 -86.84 87.16 40.62 14.36 45.02 27.33 8.66 6.14 40.65 3.74 0.15 8.56 4.78 45 Q C C 121.79 3.60 15.04 19.45 100.12 73.10 -86.57 -16.96 51.71 10.24 38.05 35.56 7.29 8.19 35.25 3.80 0.05 7.68 2.18 46 S C H 65.32 4.93 13.76 19.87 112.84 53.49 -95.32 142.69 53.66 9.10 37.24 28.60 11.69 13.93 30.99 6.06 0.17 6.60 1.97 47 K C H 125.79 6.21 15.06 22.18 101.86 -106.03 -80.98 -4.95 54.14 10.49 35.37 24.14 12.30 18.81 27.31 7.29 0.39 6.98 2.78 48 I C T 77.15 10.97 12.52 23.88 108.24 70.73 -91.99 112.41 58.96 11.77 29.27 17.82 13.96 28.06 21.69 6.95 0.57 7.11 3.84 49 G C T 38.14 7.63 16.28 24.56 106.83 -1.28 87.19 -15.26 78.49 7.94 13.56 26.63 19.49 33.82 6.71 5.98 0.06 5.09 2.23 50 S C C 47.27 6.85 17.11 24.90 121.70 40.30 -111.85 148.91 75.39 10.78 13.83 49.23 15.44 10.28 6.39 7.68 0.03 6.02 4.93 51 L H G 72.45 14.23 12.31 26.04 95.93 -133.12 -71.98 -18.04 44.37 6.29 49.33 17.03 10.48 20.50 5.61 40.56 0.05 4.34 1.43 52 D H G 107.96 2.98 17.07 20.81 94.49 73.53 -73.07 -14.16 45.27 7.20 47.52 11.69 10.26 26.55 4.97 39.72 0.06 5.56 1.18 53 N C G 86.62 6.46 15.61 23.20 98.31 54.97 -96.44 7.24 45.75 9.08 45.18 21.00 10.35 17.41 3.97 38.70 0.02 7.21 1.34 54 I C C 45.67 17.03 10.86 27.54 116.62 108.43 -91.98 130.22 69.42 29.19 1.39 57.76 9.23 1.47 0.57 0.89 0.00 26.55 3.53 55 T E E 74.84 6.04 19.17 26.06 120.56 -167.83 -112.82 135.25 45.05 53.85 1.10 38.71 4.19 1.19 0.53 0.64 0.00 50.70 4.03 56 H E E 86.87 12.68 14.20 26.96 120.04 -151.39 -107.55 133.09 40.26 58.94 0.80 33.42 4.00 0.72 0.49 0.45 0.00 47.51 13.42 57 V C C 65.59 8.55 14.95 24.91 118.93 -150.06 -103.96 131.93 85.89 13.68 0.42 79.44 5.18 0.81 0.13 0.31 0.00 11.93 2.20 58 P C T 84.48 6.19 13.41 21.10 111.33 -104.38 -62.41 140.07 87.31 6.10 6.59 18.85 14.47 53.76 0.81 6.11 0.00 4.83 1.18 59 G C T 57.92 2.20 14.78 17.46 98.81 17.62 83.74 -2.32 88.01 4.41 7.59 13.27 17.00 57.25 0.84 7.29 0.00 3.18 1.18 60 G C C 37.48 8.27 11.71 20.93 114.97 97.45 88.74 4.13 82.46 8.69 8.86 36.60 26.40 19.47 0.97 8.66 0.01 4.86 3.05 61 G C C 41.28 5.46 12.49 19.41 117.75 -66.16 83.36 -161.41 83.13 10.22 6.66 32.44 23.89 27.73 0.85 5.98 0.01 6.72 2.37 62 N C C 126.53 2.47 13.77 17.06 101.74 -32.78 -89.22 22.51 80.22 14.34 5.44 35.87 22.79 22.51 0.71 4.87 0.00 11.48 1.76 63 K C C 115.06 5.98 11.26 18.99 118.53 132.67 -96.00 140.08 70.83 26.38 2.79 55.57 11.45 3.25 0.68 2.21 0.00 24.53 2.32 64 K C C 146.36 3.05 12.93 17.73 117.15 -137.19 -95.71 135.55 50.40 47.69 1.91 43.49 4.40 1.35 0.88 1.16 0.00 42.78 5.95 65 I E E 78.72 10.78 8.39 19.83 118.08 -152.42 -104.25 133.75 48.64 49.83 1.53 44.01 3.12 0.81 0.73 0.80 0.00 44.74 5.81 66 E C C 135.19 2.39 13.58 17.03 115.04 -138.44 -91.11 135.92 62.82 35.11 2.06 55.24 4.95 1.62 0.63 1.23 0.00 34.54 1.79 67 T C C 90.52 6.05 9.28 17.05 117.95 -154.13 -105.16 136.43 71.57 23.66 4.77 50.95 14.50 5.76 1.05 3.48 0.00 22.90 1.36 68 H C C 125.06 3.83 10.20 15.95 120.36 -163.87 -113.40 137.76 72.56 22.34 5.10 49.15 16.92 6.43 1.16 3.78 0.01 21.06 1.51 69 K C C 155.39 2.07 10.54 14.30 115.52 -129.17 -90.28 132.84 72.33 23.31 4.36 58.25 8.85 4.67 1.20 3.15 0.00 21.29 2.61 70 L C C 98.45 6.82 6.80 14.98 115.90 -147.04 -95.55 131.54 77.52 19.51 2.97 66.95 6.42 3.33 1.05 1.89 0.00 17.24 3.11 71 T C C 110.21 1.40 9.57 12.16 116.72 -158.59 -106.23 131.87 83.04 15.49 1.47 77.46 2.59 2.62 0.62 0.68 0.00 13.08 2.95 72 F C C 143.13 4.47 9.73 15.75 110.94 -127.09 -92.64 123.61 99.70 0.29 0.01 99.65 0.11 0.04 0.00 0.00 0.00 0.19 0.02