# 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 M C C 94.47 8.78 11.59 21.32 116.26 -159.66 -96.69 129.74 99.90 0.08 0.02 99.83 0.08 0.03 0.01 0.00 0.00 0.04 0.01 1 E C C 136.46 2.81 11.30 15.73 111.07 -147.56 -91.27 122.75 88.43 5.49 6.08 84.44 1.40 3.32 3.84 1.49 0.00 3.58 1.93 2 L C C 97.83 6.08 8.98 16.71 115.12 -157.67 -93.80 133.91 80.91 6.28 12.81 61.69 12.42 6.64 8.22 4.85 0.00 4.26 1.92 3 E C C 121.68 3.58 11.47 16.66 113.43 -136.71 -86.83 133.25 79.64 3.69 16.67 67.48 7.32 5.18 9.21 7.18 0.00 2.55 1.09 4 I C C 97.75 7.78 8.97 17.87 109.20 -143.87 -85.28 118.86 66.32 3.51 30.17 44.42 9.77 11.96 14.01 16.44 0.01 2.23 1.16 5 D C C 105.92 3.10 12.20 16.58 105.92 62.23 -86.02 55.07 65.46 2.80 31.74 37.28 12.69 15.76 13.20 18.40 0.02 1.61 1.04 6 E C C 118.82 4.82 12.10 18.50 109.18 111.35 -87.28 106.05 68.77 3.39 27.84 41.76 16.09 11.68 10.57 16.74 0.01 2.11 1.03 7 K C C 111.96 7.35 12.78 21.37 113.16 113.08 -91.51 127.69 75.87 9.76 14.37 55.66 11.26 9.45 5.54 8.32 0.01 8.25 1.50 8 K C C 104.48 9.24 14.52 24.56 117.68 -160.80 -102.68 134.48 67.39 29.42 3.19 52.50 10.42 3.60 1.10 1.89 0.00 29.04 1.45 9 Y E E 69.49 14.19 15.01 29.56 125.68 -164.95 -117.93 139.93 32.03 67.09 0.88 26.03 5.03 1.22 0.31 0.52 0.00 65.86 1.04 10 S E E 47.70 10.62 19.87 30.95 127.71 -167.74 -125.52 143.46 15.61 84.29 0.11 13.49 1.96 0.20 0.03 0.06 0.00 83.81 0.46 11 V E E 18.50 20.16 16.16 36.36 124.16 -162.89 -121.73 133.27 5.83 94.15 0.02 5.58 0.25 0.02 0.01 0.01 0.00 93.96 0.18 12 D E E 65.26 8.96 23.51 32.83 119.76 -160.75 -112.82 129.37 3.27 96.72 0.01 3.13 0.14 0.01 0.00 0.00 0.00 96.64 0.08 13 I E E 12.13 22.96 16.14 39.29 121.66 -167.96 -117.30 130.36 3.16 96.84 0.01 3.19 0.07 0.01 0.00 0.00 0.00 96.66 0.06 14 N E E 68.02 8.29 25.61 34.37 118.01 -160.90 -109.83 126.73 3.12 96.87 0.01 3.01 0.10 0.01 0.00 0.00 0.00 96.79 0.08 15 L E E 8.53 24.48 15.96 40.74 123.79 -169.85 -117.30 135.99 3.96 96.03 0.01 4.01 0.08 0.01 0.00 0.00 0.00 95.61 0.28 16 E E E 87.85 7.86 25.19 33.70 130.11 -172.86 -126.34 145.80 8.10 91.88 0.02 7.82 0.32 0.03 0.01 0.01 0.00 91.24 0.58 17 G E E 9.85 18.04 15.33 33.53 140.69 153.52 -155.78 165.95 36.38 63.57 0.05 33.89 1.88 0.13 0.01 0.04 0.00 62.44 1.61 18 T C S 92.81 4.78 20.13 25.91 97.00 -124.77 -90.03 -14.51 99.15 0.83 0.02 4.05 94.95 0.40 0.00 0.01 0.00 0.53 0.06 19 S C C 46.42 6.33 20.63 27.73 122.88 53.57 -121.57 134.14 98.37 1.46 0.17 49.74 48.65 0.35 0.10 0.05 0.00 0.47 0.64 20 V H H 52.47 15.98 14.05 29.92 93.24 -145.47 -62.20 -37.15 2.09 0.00 97.90 0.39 0.36 1.15 97.38 0.72 0.00 0.00 0.00 21 E H H 129.21 1.82 21.34 22.33 91.54 54.28 -63.32 -40.78 1.01 0.00 98.99 0.11 0.08 0.70 98.44 0.67 0.00 0.00 0.00 22 E H H 68.74 7.74 19.67 28.38 91.89 48.58 -65.99 -40.30 0.44 0.00 99.56 0.06 0.03 0.27 98.95 0.69 0.00 0.00 0.00 23 I H H 4.64 24.51 14.35 39.23 91.26 51.70 -63.32 -43.43 0.12 0.00 99.88 0.02 0.01 0.05 99.87 0.05 0.00 0.00 0.00 24 E H H 71.91 11.37 21.64 32.90 91.57 51.22 -62.84 -41.73 0.07 0.00 99.93 0.01 0.00 0.03 99.95 0.01 0.00 0.00 0.00 25 K H H 114.46 2.17 25.71 26.30 91.50 49.98 -63.96 -42.28 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 26 V H H 16.03 16.41 20.97 37.81 91.69 49.19 -64.03 -43.39 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 27 C H H 5.44 23.91 18.50 42.35 91.45 50.46 -63.77 -42.25 0.18 0.00 99.82 0.01 0.01 0.11 99.85 0.02 0.00 0.00 0.00 28 R H H 122.57 5.47 23.82 29.80 91.36 51.79 -63.27 -41.50 0.18 0.00 99.82 0.01 0.01 0.12 99.84 0.02 0.00 0.00 0.00 29 D H H 69.89 4.91 24.04 28.92 91.77 49.54 -65.06 -41.47 0.23 0.00 99.77 0.01 0.01 0.17 99.78 0.03 0.00 0.00 0.00 30 F H H 12.86 21.61 19.11 40.55 91.89 49.44 -64.33 -43.29 0.27 0.00 99.73 0.02 0.01 0.20 99.71 0.07 0.00 0.00 0.00 31 Y H H 49.77 16.95 19.58 35.89 91.89 50.36 -63.30 -42.06 0.38 0.00 99.62 0.03 0.02 0.26 99.56 0.13 0.00 0.00 0.00 32 A H H 57.67 2.44 23.04 24.15 91.53 50.50 -63.72 -41.53 1.41 0.00 98.59 0.09 0.06 1.17 98.31 0.37 0.00 0.00 0.00 33 Y H H 75.80 8.28 19.24 28.64 92.36 48.71 -66.05 -39.62 3.89 0.01 96.10 0.21 0.19 3.34 95.57 0.68 0.00 0.00 0.00 34 A H H 7.82 21.03 12.12 33.08 92.18 52.94 -66.77 -36.35 9.03 0.04 90.93 1.19 0.81 6.68 89.40 1.87 0.01 0.02 0.02 35 K H H 125.41 5.70 16.62 23.73 92.00 56.12 -65.92 -31.88 25.71 0.11 74.18 1.85 1.77 21.70 71.08 3.43 0.05 0.05 0.07 36 T H H 104.91 1.35 17.51 17.68 95.41 46.99 -81.20 -21.82 37.62 0.15 62.23 2.56 3.55 30.81 60.34 2.55 0.04 0.06 0.09 37 L C H 73.58 9.98 12.71 23.35 103.53 51.80 -93.84 -5.73 64.62 0.77 34.61 12.28 31.06 20.95 32.61 2.24 0.04 0.22 0.60 38 V C C 103.64 4.43 17.15 22.68 105.26 -122.17 -94.63 85.94 98.97 0.75 0.28 70.62 23.44 5.03 0.09 0.16 0.00 0.47 0.20 39 P C C 36.54 18.42 10.36 27.79 116.35 -162.90 -76.12 146.56 97.43 2.34 0.22 87.87 8.47 1.03 0.03 0.25 0.00 2.17 0.20 40 D E E 105.15 2.98 21.37 24.49 111.30 -131.22 -89.60 118.65 36.09 63.32 0.59 30.63 4.31 1.06 0.10 0.53 0.00 61.81 1.55 41 M E E 52.06 19.86 10.95 29.32 122.16 -166.53 -112.59 132.96 11.43 88.45 0.11 10.70 0.59 0.09 0.05 0.06 0.00 84.59 3.92 42 G E E 42.35 5.01 19.30 25.04 115.43 -175.57 -113.16 155.27 23.63 76.28 0.09 19.10 4.13 0.48 0.02 0.07 0.00 75.37 0.82 43 G E E 30.51 5.51 20.14 26.47 132.73 -27.50 120.71 -173.97 35.87 64.09 0.04 16.84 18.42 0.70 0.00 0.04 0.00 63.71 0.29 44 V E E 61.11 16.19 14.20 29.74 116.33 -53.72 -81.86 136.73 38.27 61.70 0.03 34.83 1.99 0.10 0.00 0.02 0.00 62.65 0.40 45 K E E 86.17 9.53 18.87 29.33 125.00 -169.35 -121.38 136.00 6.91 93.08 0.02 6.53 0.29 0.02 0.01 0.01 0.00 90.94 2.20 46 R E E 130.35 8.91 17.94 27.91 114.79 -125.38 -83.79 133.70 11.70 88.28 0.02 11.13 0.52 0.04 0.01 0.01 0.00 85.96 2.34 47 L C C 37.41 18.17 12.18 29.78 119.72 -145.04 -93.83 144.10 71.44 28.51 0.05 67.93 2.76 0.11 0.01 0.03 0.00 28.48 0.68 48 Q C C 104.21 4.21 20.75 24.80 114.15 -103.76 -73.14 146.48 81.07 18.83 0.11 74.81 4.86 0.31 0.02 0.09 0.00 19.23 0.67 49 T C C 58.74 15.51 12.54 27.35 118.96 -133.28 -98.00 137.52 59.75 40.10 0.15 52.06 5.88 0.39 0.03 0.13 0.00 40.59 0.92 50 K E E 99.29 7.62 17.51 26.18 123.26 -157.52 -113.44 140.54 15.17 84.75 0.07 12.91 1.97 0.18 0.01 0.05 0.00 84.39 0.48 51 K E E 114.10 8.51 16.35 26.09 119.67 -137.47 -102.83 132.95 3.92 96.05 0.02 3.48 0.28 0.03 0.00 0.01 0.00 96.03 0.15 52 G E E 17.48 14.42 13.54 28.38 129.93 -166.95 -116.78 160.79 2.00 97.99 0.01 1.74 0.11 0.01 0.00 0.00 0.00 98.08 0.05 53 K E E 116.03 5.52 20.02 26.65 121.13 -136.66 -115.00 136.08 1.55 98.45 0.00 1.34 0.08 0.00 0.00 0.00 0.00 98.54 0.03 54 I E E 40.52 17.46 13.02 30.47 120.33 -156.67 -109.43 131.60 2.50 97.48 0.01 2.28 0.10 0.01 0.00 0.00 0.00 97.55 0.05 55 T E E 52.16 7.45 19.25 27.88 125.47 -168.92 -116.37 146.02 4.23 95.74 0.03 3.79 0.22 0.03 0.01 0.01 0.00 95.87 0.08 56 T E E 51.93 13.67 14.15 28.10 123.77 -160.53 -117.22 140.52 5.75 94.20 0.05 5.11 0.47 0.07 0.02 0.02 0.00 93.97 0.33 57 R E E 106.79 8.56 15.18 24.87 122.91 -156.39 -115.81 137.55 12.83 87.08 0.08 11.23 1.53 0.19 0.03 0.05 0.00 86.04 0.94 58 R C E 144.32 5.08 15.00 21.64 115.03 -131.49 -90.05 134.83 52.21 47.62 0.17 43.25 8.05 0.58 0.05 0.15 0.00 46.14 1.79 59 S C C 36.27 10.14 10.13 21.65 116.56 -120.15 -89.67 138.23 91.46 8.28 0.25 82.81 7.45 1.03 0.06 0.22 0.00 7.23 1.20 60 P C T 99.52 3.29 12.75 17.44 93.83 -137.16 -67.67 -19.64 95.55 1.30 3.15 8.03 27.28 60.06 0.26 3.10 0.00 0.90 0.38 61 C C T 83.88 3.94 10.94 16.17 99.25 56.12 -89.96 -2.54 93.38 1.99 4.63 6.19 27.76 59.48 0.44 4.15 0.00 1.13 0.85 62 G C S 49.47 3.23 10.81 15.62 104.08 -101.14 82.42 2.29 87.48 3.09 9.43 18.72 44.94 23.78 1.06 8.39 0.00 1.56 1.54 63 E C T 137.81 2.16 10.99 14.38 107.17 89.25 -86.91 101.90 85.77 2.54 11.69 18.44 26.45 40.98 1.45 10.15 0.01 1.36 1.18 64 G C T 54.59 2.69 11.54 15.27 102.32 -16.00 81.05 -0.54 82.74 4.15 13.12 19.81 28.60 34.84 1.50 11.42 0.01 2.23 1.59 65 T C C 82.72 4.16 11.26 16.98 115.06 101.38 -96.25 134.62 82.02 7.04 10.94 32.78 27.69 22.16 1.37 9.77 0.01 4.40 1.84 66 N C C 108.32 4.61 13.11 19.30 100.67 -62.21 -71.04 49.75 81.07 12.96 5.97 45.99 17.97 17.05 0.65 5.99 0.00 10.85 1.49 67 T C C 62.00 7.27 12.53 21.54 120.91 140.66 -103.21 142.12 60.47 38.57 0.96 48.70 9.23 1.87 0.24 0.86 0.00 35.78 3.32 68 W E E 104.38 11.81 11.97 24.41 121.68 -148.62 -103.25 141.81 25.18 74.70 0.12 22.07 2.26 0.32 0.04 0.09 0.00 72.34 2.88 69 S E E 53.29 6.94 16.37 24.45 118.53 -143.93 -98.32 148.20 18.63 81.33 0.04 14.98 2.62 0.21 0.01 0.03 0.00 81.83 0.31 70 R E E 124.78 8.80 14.65 24.56 120.57 -121.25 -105.18 136.81 8.85 91.13 0.02 7.79 0.66 0.04 0.00 0.01 0.00 91.33 0.16 71 Y E E 63.19 12.82 13.71 27.67 127.18 -170.25 -124.83 143.96 3.07 96.93 0.00 2.84 0.10 0.00 0.00 0.00 0.00 96.97 0.08 72 R E E 134.53 5.90 17.98 25.33 117.66 -140.12 -98.38 131.32 1.62 98.37 0.00 1.46 0.05 0.00 0.00 0.00 0.00 98.46 0.03 73 I E E 35.27 17.10 13.73 30.87 125.99 -172.23 -121.46 140.39 1.97 98.03 0.00 1.79 0.04 0.00 0.00 0.00 0.00 98.14 0.02 74 S E E 40.67 8.49 19.88 29.54 118.63 -140.12 -100.01 135.55 1.25 98.75 0.00 1.13 0.03 0.00 0.00 0.00 0.00 98.82 0.02 75 V E E 30.88 16.44 16.45 33.33 123.22 -165.09 -119.18 133.02 1.66 98.34 0.00 1.51 0.07 0.00 0.00 0.00 0.00 98.36 0.06 76 H E E 53.94 12.02 19.18 32.21 121.39 -163.94 -112.60 134.56 5.03 94.97 0.01 4.49 0.29 0.02 0.00 0.00 0.00 95.11 0.09 77 R E E 97.72 12.55 19.65 32.03 124.35 -162.99 -118.25 137.15 11.11 88.88 0.01 9.80 0.77 0.04 0.00 0.01 0.00 89.28 0.11 78 R E E 53.66 16.11 18.19 34.22 125.03 -164.16 -118.60 137.37 6.35 93.65 0.01 5.92 0.25 0.01 0.00 0.00 0.00 93.70 0.11 79 S E E 32.42 12.48 21.41 34.40 122.88 -162.42 -116.39 135.08 1.47 98.53 0.00 1.33 0.07 0.00 0.00 0.00 0.00 98.55 0.05 80 F E E 20.68 20.72 18.24 38.94 125.78 -167.75 -122.90 135.79 0.46 99.54 0.00 0.41 0.02 0.00 0.00 0.00 0.00 99.56 0.01 81 S E E 37.85 10.27 24.56 35.32 119.19 -157.41 -109.90 129.93 1.01 98.98 0.00 0.89 0.04 0.00 0.00 0.00 0.00 99.05 0.02 82 A E E 8.63 22.98 16.45 39.36 123.15 -168.73 -119.94 133.21 7.86 92.02 0.11 7.26 0.50 0.10 0.04 0.05 0.00 91.68 0.37 83 H E E 92.98 7.30 24.39 32.03 115.52 -156.99 -105.97 123.29 32.21 67.64 0.15 25.35 6.60 0.58 0.04 0.11 0.00 66.21 1.09 84 L C C 30.64 19.59 13.07 31.90 129.67 141.09 -125.68 151.16 78.22 21.61 0.17 60.75 16.97 0.58 0.06 0.13 0.00 20.21 1.29 85 Y C C 105.90 5.72 19.38 25.65 114.56 -104.77 -73.78 143.19 99.13 0.67 0.20 97.58 1.63 0.13 0.14 0.03 0.00 0.38 0.11 86 P H H 78.95 7.60 13.87 22.97 92.23 -116.17 -57.83 -36.07 11.86 0.07 88.07 2.52 1.67 7.55 85.15 3.02 0.02 0.04 0.03 87 S H H 71.31 1.97 18.89 20.01 92.23 56.44 -65.00 -36.43 7.88 0.05 92.07 1.02 0.78 5.89 89.01 3.22 0.02 0.02 0.02 88 V H H 25.78 13.65 15.42 30.11 92.39 49.81 -66.37 -41.62 2.90 0.07 97.04 0.71 0.36 1.82 93.84 3.20 0.01 0.05 0.01 89 L H H 24.30 18.43 13.90 32.21 91.84 52.46 -63.07 -42.03 1.29 0.03 98.68 0.34 0.15 0.74 96.66 2.09 0.00 0.02 0.00 90 E H H 113.61 3.35 19.61 23.23 91.62 51.54 -64.32 -39.56 1.99 0.03 97.98 0.31 0.16 1.40 95.27 2.82 0.00 0.02 0.00 91 K H H 110.53 4.60 19.22 24.30 92.34 50.89 -66.32 -38.42 3.75 0.04 96.21 0.40 0.27 2.90 93.36 3.02 0.01 0.03 0.01 92 F H H 33.71 19.03 14.58 33.20 93.74 47.95 -71.53 -31.21 7.97 0.12 91.91 1.08 0.85 5.85 89.44 2.65 0.04 0.07 0.04 93 A H H 42.22 13.63 15.40 29.01 93.53 65.82 -71.13 -21.33 35.53 1.70 62.77 8.75 4.76 22.42 58.31 3.95 0.16 1.00 0.64 94 T C T 94.70 3.10 19.12 22.30 96.85 62.86 -86.16 -4.96 64.44 4.19 31.37 17.35 8.07 37.94 26.88 5.68 0.10 2.84 1.15 95 F C C 74.34 14.25 11.81 26.14 115.43 104.29 -83.18 134.69 77.11 12.80 10.10 50.68 18.97 7.21 7.97 2.96 0.05 9.43 2.72 96 L C C 109.79 4.84 17.44 23.74 115.34 -151.81 -99.21 125.82 75.21 20.99 3.79 67.75 3.86 2.57 2.75 1.20 0.00 17.20 4.66 97 K C C 91.00 13.90 12.44 26.01 116.59 -168.08 -101.74 131.09 72.68 25.67 1.65 60.87 8.99 1.67 1.19 0.69 0.00 17.62 8.97 98 G C C 30.57 7.44 15.48 23.95 127.56 -126.33 -85.68 174.68 93.44 6.01 0.55 82.89 8.58 1.87 0.17 0.37 0.00 4.95 1.17 99 S C T 83.92 2.84 16.54 19.99 109.73 -60.54 -70.02 139.97 94.85 3.91 1.25 5.94 16.46 72.68 0.18 1.03 0.00 3.04 0.66 100 N C T 99.64 6.14 17.05 24.10 96.30 12.41 67.17 16.10 93.73 5.51 0.76 8.00 14.74 70.63 0.06 0.77 0.00 5.48 0.32 101 V E E 22.22 19.73 11.41 31.01 121.82 112.60 -110.28 134.85 40.52 59.36 0.13 34.46 5.18 0.41 0.02 0.11 0.00 58.91 0.90 102 E E E 96.47 5.80 23.37 29.67 119.92 -160.43 -111.27 130.25 9.17 90.80 0.04 8.63 0.35 0.04 0.01 0.01 0.00 90.75 0.20 103 I E E 27.86 22.23 13.92 35.72 123.53 -168.54 -120.16 133.14 4.53 95.46 0.01 4.41 0.12 0.01 0.00 0.00 0.00 95.39 0.06 104 S E E 47.90 6.77 24.04 31.25 125.87 -171.27 -123.48 138.99 3.26 96.73 0.01 3.12 0.10 0.01 0.00 0.00 0.00 96.73 0.04 105 L E E 33.16 21.02 14.51 34.98 124.93 -163.73 -121.87 134.23 3.13 96.86 0.01 3.17 0.06 0.01 0.00 0.00 0.00 96.71 0.05 106 V E E 62.25 6.99 22.72 30.36 123.31 -169.63 -121.92 135.58 2.97 97.03 0.01 2.95 0.08 0.01 0.00 0.00 0.00 96.87 0.09 107 I E E 46.50 16.91 13.45 30.35 117.73 -151.11 -104.43 128.69 8.56 91.41 0.03 7.99 0.38 0.05 0.01 0.01 0.00 91.15 0.41 108 K E E 104.66 6.39 15.92 23.49 119.20 -162.07 -103.62 137.07 36.99 62.81 0.21 30.60 5.03 0.78 0.05 0.17 0.00 62.52 0.85 109 S C C 69.28 6.65 11.32 19.40 114.79 -135.40 -95.56 134.83 69.11 30.68 0.20 63.08 3.13 1.04 0.04 0.18 0.00 31.41 1.12 110 N C C 116.92 3.47 13.47 18.33 102.62 -134.11 -86.75 36.08 99.81 0.19 0.01 99.70 0.12 0.04 0.00 0.00 0.00 0.12 0.01