# 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 109.08 6.46 11.18 18.98 116.15 -162.17 -94.75 134.54 99.87 0.11 0.02 99.80 0.09 0.03 0.01 0.00 0.00 0.05 0.01 1 S C C 75.31 3.70 9.75 15.17 114.03 -157.26 -95.43 135.26 84.13 8.91 6.96 78.30 1.58 4.94 3.92 2.14 0.00 6.40 2.71 2 Q C C 127.42 2.91 9.20 13.76 110.83 -156.13 -92.08 119.20 76.40 13.08 10.52 53.96 14.26 7.83 6.49 4.36 0.02 10.08 3.01 3 V C C 95.25 4.62 8.61 14.93 110.25 -160.05 -91.28 117.66 71.35 13.70 14.95 50.01 13.16 7.66 9.90 5.57 0.03 10.91 2.77 4 E C C 126.46 3.38 10.14 15.12 108.86 -153.51 -88.44 111.20 75.11 8.81 16.09 52.00 14.03 8.54 11.48 5.22 0.01 6.78 1.94 5 K C C 131.71 3.62 9.73 14.97 109.33 56.51 -87.58 107.79 76.85 5.58 17.56 53.33 12.44 10.53 12.93 5.26 0.01 3.95 1.53 6 K C C 129.33 4.05 9.59 15.27 107.95 -139.76 -83.39 84.19 78.14 2.98 18.88 49.67 16.45 11.82 14.11 5.13 0.01 1.70 1.10 7 S C C 71.62 3.58 10.06 15.09 108.03 -147.56 -85.61 102.32 74.08 2.55 23.38 43.73 18.10 12.33 15.90 7.57 0.01 1.37 1.00 8 E C C 131.58 2.84 9.95 14.27 102.62 16.24 -79.41 0.27 62.73 3.37 33.91 33.74 13.82 15.78 21.46 12.02 0.04 1.92 1.24 9 Q C C 117.33 3.74 9.57 14.96 108.50 68.70 -85.12 84.61 60.14 4.34 35.52 35.45 12.02 13.14 22.68 12.60 0.04 2.62 1.43 10 Q C C 115.92 4.10 10.19 15.95 108.50 66.05 -86.31 90.36 59.45 4.46 36.09 38.75 11.31 9.42 23.37 13.02 0.03 2.79 1.31 11 Q C C 117.12 4.18 10.98 16.75 107.00 -144.28 -85.96 77.83 61.64 5.61 32.75 40.27 10.55 10.89 20.43 12.59 0.02 4.01 1.25 12 E C C 121.77 4.57 12.15 18.25 109.65 98.12 -88.70 113.74 62.77 9.99 27.24 39.22 13.01 10.99 15.63 11.52 0.05 7.92 1.67 13 V C C 70.71 9.26 11.58 22.09 116.90 -146.19 -99.69 132.24 66.79 18.67 14.54 50.70 10.18 5.44 8.91 5.62 0.01 17.38 1.75 14 V C C 73.94 7.86 15.21 24.31 115.72 -149.70 -97.25 129.85 60.93 33.24 5.83 50.39 6.32 3.10 3.28 2.28 0.00 32.83 1.81 15 I E E 70.06 11.42 15.01 27.26 118.68 -157.71 -106.80 129.99 43.63 54.96 1.41 37.94 3.86 0.98 0.67 0.60 0.00 54.78 1.16 16 H E E 57.31 13.29 16.36 30.35 121.58 -166.28 -112.10 135.69 21.98 77.45 0.57 18.96 2.39 0.51 0.22 0.25 0.00 77.05 0.61 17 K E E 87.67 10.48 20.12 31.02 124.06 -159.12 -118.47 135.56 11.12 88.71 0.17 9.91 0.95 0.14 0.05 0.06 0.00 88.60 0.28 18 I E E 18.32 20.45 16.34 37.07 122.48 -166.85 -119.24 131.54 4.58 95.39 0.04 4.40 0.16 0.02 0.01 0.01 0.00 95.29 0.11 19 R E E 96.32 8.93 23.71 33.14 117.32 -157.80 -108.73 126.12 2.83 97.16 0.01 2.68 0.09 0.01 0.00 0.00 0.00 97.16 0.05 20 I E E 9.62 23.50 16.80 40.71 120.89 -168.25 -116.23 129.44 1.62 98.37 0.01 1.64 0.03 0.00 0.00 0.00 0.00 98.30 0.02 21 N E E 55.97 9.31 26.03 35.95 118.49 -161.44 -109.38 126.63 1.03 98.97 0.00 1.00 0.02 0.00 0.00 0.00 0.00 98.95 0.02 22 L E E 6.26 25.05 17.38 42.93 122.82 -168.72 -116.52 134.64 1.41 98.58 0.01 1.43 0.02 0.00 0.00 0.00 0.00 98.50 0.04 23 T E E 49.39 9.78 25.78 36.02 127.55 -171.27 -124.17 142.41 4.31 95.67 0.01 4.15 0.15 0.01 0.00 0.00 0.00 95.48 0.19 24 S E E 10.86 19.87 15.09 35.26 138.26 164.58 -148.93 159.28 28.01 71.94 0.05 27.08 0.99 0.08 0.02 0.03 0.00 70.39 1.40 25 T C S 86.39 5.73 20.44 27.06 95.92 -142.18 -89.55 -11.63 99.19 0.78 0.03 3.09 95.65 0.67 0.00 0.01 0.00 0.50 0.06 26 K C C 94.00 6.41 19.29 26.74 109.63 78.93 -99.56 108.00 98.79 1.03 0.18 63.15 35.24 0.57 0.10 0.06 0.00 0.39 0.48 27 V H H 57.23 15.01 13.60 28.80 93.57 -165.86 -62.50 -37.84 3.70 0.02 96.28 0.84 0.59 2.07 94.48 2.01 0.00 0.00 0.01 28 K H H 140.32 1.60 21.09 21.68 91.59 54.16 -63.63 -40.43 2.49 0.01 97.50 0.25 0.23 1.90 95.03 2.58 0.00 0.00 0.00 29 Q H H 64.76 7.96 19.39 28.34 92.08 48.28 -66.08 -39.80 1.57 0.01 98.42 0.31 0.13 1.03 95.40 3.12 0.00 0.01 0.00 30 L H H 5.89 24.20 14.02 38.36 91.48 52.16 -63.68 -42.88 0.35 0.00 99.65 0.08 0.03 0.17 99.48 0.24 0.00 0.00 0.00 31 E H H 85.06 10.33 21.85 32.07 91.39 51.48 -63.12 -41.35 0.13 0.00 99.87 0.02 0.00 0.06 99.88 0.03 0.00 0.00 0.00 32 N H H 92.81 2.33 25.86 26.91 91.77 49.83 -64.70 -41.63 0.09 0.00 99.91 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 33 V H H 15.38 17.50 21.34 38.94 91.71 48.90 -64.14 -43.50 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 34 S H H 5.54 23.19 19.72 42.65 91.39 50.74 -63.66 -42.59 0.11 0.00 99.89 0.01 0.00 0.07 99.91 0.01 0.00 0.00 0.00 35 A H H 46.55 5.68 24.49 30.48 91.20 51.45 -63.34 -41.77 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 36 N H H 65.95 6.25 24.79 31.35 91.70 50.09 -64.94 -41.36 0.12 0.00 99.88 0.00 0.00 0.09 99.89 0.01 0.00 0.00 0.00 37 I H H 5.51 23.84 19.77 43.44 91.58 49.77 -63.97 -43.69 0.13 0.00 99.87 0.01 0.00 0.10 99.87 0.02 0.00 0.00 0.00 38 I H H 35.14 16.57 21.03 37.10 91.59 49.96 -62.97 -42.70 0.15 0.00 99.85 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 39 K H H 118.39 2.03 25.16 25.50 91.65 49.59 -63.80 -41.74 0.46 0.00 99.54 0.03 0.02 0.32 99.57 0.06 0.00 0.00 0.00 40 N H H 36.40 9.75 19.79 30.97 92.16 49.36 -65.27 -40.59 1.61 0.00 98.39 0.09 0.08 1.27 98.39 0.17 0.00 0.00 0.00 41 A H H 5.45 20.97 12.76 34.11 91.59 51.59 -64.18 -41.26 2.60 0.01 97.39 0.36 0.22 1.82 97.02 0.57 0.00 0.01 0.00 42 E H H 118.06 4.30 17.39 22.91 91.83 51.47 -64.31 -40.13 3.89 0.02 96.09 0.39 0.23 3.08 94.49 1.78 0.01 0.01 0.01 43 T H H 101.83 1.51 17.18 18.04 91.49 52.08 -66.85 -30.90 10.58 0.03 89.39 0.39 0.43 9.84 87.99 1.30 0.02 0.01 0.01 44 F C T 86.62 9.31 12.61 23.32 96.57 43.47 -96.86 6.88 73.11 0.08 26.82 0.87 2.84 68.55 25.76 1.86 0.01 0.03 0.09 45 K C T 170.39 1.03 18.64 18.48 93.81 -118.88 59.02 40.37 99.68 0.02 0.30 3.46 1.75 94.60 0.12 0.06 0.00 0.01 0.00 46 L C C 26.37 19.97 8.89 27.82 118.75 159.74 -93.87 138.95 97.66 2.31 0.03 96.00 1.72 0.09 0.01 0.01 0.00 2.02 0.15 47 V E E 93.38 3.44 23.18 26.31 112.62 -128.65 -87.60 128.80 44.79 55.15 0.05 44.14 0.78 0.07 0.01 0.03 0.00 54.10 0.86 48 K E E 60.18 20.55 11.08 30.06 121.49 -162.19 -108.81 134.98 9.21 90.75 0.05 9.25 0.27 0.03 0.03 0.02 0.00 85.75 4.66 49 K E E 125.31 4.49 18.94 24.27 106.06 -171.73 -102.82 9.27 24.41 75.54 0.05 20.33 3.66 0.23 0.01 0.04 0.00 74.82 0.90 50 G E E 29.39 5.08 19.91 25.77 134.02 -62.01 114.69 -175.27 47.28 52.71 0.02 15.39 31.40 0.48 0.00 0.02 0.00 52.43 0.28 51 P C C 63.62 12.40 15.80 28.48 115.17 -42.26 -70.59 143.74 55.23 44.74 0.03 49.02 4.29 0.14 0.00 0.03 0.00 46.01 0.50 52 V E E 37.80 15.02 15.93 31.67 122.72 -161.83 -117.83 132.85 17.93 82.05 0.03 16.83 0.72 0.03 0.02 0.01 0.00 73.21 9.17 53 R E E 140.18 6.03 20.96 28.26 115.74 -129.24 -86.36 132.22 35.89 64.10 0.01 35.72 0.75 0.03 0.01 0.01 0.00 58.50 4.99 54 L C C 29.69 20.95 11.86 31.92 118.96 -135.93 -84.68 144.92 89.82 10.17 0.01 88.33 2.13 0.03 0.00 0.01 0.00 9.08 0.42 55 P C C 57.48 7.36 18.61 26.94 115.46 -102.99 -66.30 152.15 93.05 6.90 0.05 88.99 3.88 0.21 0.01 0.04 0.00 6.40 0.47 56 T C C 80.01 9.64 14.82 25.16 110.05 -126.36 -83.81 95.45 67.60 32.29 0.11 52.03 14.41 0.50 0.02 0.11 0.00 31.95 0.98 57 K E E 99.07 7.86 15.96 24.99 123.77 72.69 -111.23 141.16 13.68 86.26 0.06 11.47 1.88 0.15 0.01 0.05 0.00 86.07 0.37 58 V E E 73.04 9.49 15.21 25.88 120.21 -150.49 -111.55 130.52 1.94 98.04 0.01 1.84 0.10 0.01 0.00 0.01 0.00 97.97 0.07 59 L E E 52.24 12.64 13.98 27.64 119.68 -161.54 -108.88 134.16 0.78 99.22 0.00 0.72 0.03 0.00 0.00 0.00 0.00 99.23 0.02 60 K E E 114.17 6.24 18.05 25.59 119.95 -158.73 -111.80 131.80 0.65 99.34 0.00 0.58 0.03 0.00 0.00 0.00 0.00 99.38 0.01 61 I E E 47.61 14.18 13.60 28.54 121.83 -165.98 -116.54 134.14 1.61 98.37 0.01 1.51 0.06 0.01 0.00 0.00 0.00 98.37 0.05 62 S E E 44.09 7.71 16.95 26.13 124.66 -165.88 -113.37 149.84 7.98 91.93 0.09 7.13 0.58 0.10 0.03 0.04 0.00 91.92 0.20 63 T E E 55.99 11.84 13.88 26.46 122.62 -153.45 -112.80 139.07 16.62 83.18 0.20 13.96 2.46 0.38 0.06 0.13 0.00 82.15 0.86 64 R E E 123.09 7.00 14.47 22.80 118.71 -140.22 -96.40 137.73 29.65 70.07 0.28 24.65 4.84 0.69 0.09 0.21 0.00 67.68 1.85 65 K C C 127.43 5.01 13.91 20.55 116.34 -133.10 -89.98 137.59 57.84 41.91 0.25 48.92 7.33 0.66 0.10 0.22 0.00 37.91 4.87 66 T C C 46.37 9.32 9.64 20.53 117.88 -116.33 -81.23 145.20 92.00 7.78 0.22 84.23 6.95 0.79 0.06 0.17 0.00 6.07 1.71 67 P C T 105.45 2.50 12.20 15.99 93.09 -126.43 -65.79 -20.93 96.33 1.09 2.58 7.39 27.11 61.63 0.22 2.56 0.00 0.75 0.33 68 N C T 104.89 3.28 10.38 14.89 98.55 53.78 -89.94 -1.72 94.76 1.61 3.63 6.30 28.59 59.78 0.37 3.34 0.00 0.93 0.69 69 G C S 42.77 4.14 10.16 15.92 113.09 -104.98 82.93 4.76 87.06 3.78 9.16 23.22 44.27 19.24 1.10 8.16 0.00 1.80 2.20 70 E C T 148.63 1.70 10.32 13.17 106.06 19.15 -78.27 97.67 85.65 2.09 12.26 10.37 17.89 56.67 1.32 11.50 0.01 1.27 0.98 71 G C T 60.97 1.37 11.66 13.29 98.58 6.78 81.77 0.35 85.86 2.09 12.04 13.22 19.42 52.75 1.33 11.14 0.00 1.25 0.90 72 S C C 59.08 5.03 9.03 15.98 117.10 119.75 -88.25 145.97 85.17 5.85 8.97 49.03 25.18 11.00 1.47 7.87 0.00 3.39 2.07 73 K C C 146.29 3.03 12.40 16.99 108.08 -128.34 -86.59 98.85 79.58 16.63 3.79 55.45 16.67 7.41 0.74 3.41 0.00 13.66 2.67 74 T C C 66.89 6.73 11.70 20.13 123.74 157.52 -108.77 146.45 59.08 39.96 0.96 49.02 7.67 1.60 0.27 0.80 0.00 37.23 3.39 75 W E E 117.85 9.75 11.77 22.66 119.81 -139.12 -100.89 139.82 33.61 66.19 0.19 29.47 3.05 0.52 0.05 0.15 0.00 64.65 2.11 76 D E E 72.77 7.47 15.05 23.84 119.94 -157.90 -109.06 137.83 19.63 80.30 0.06 16.41 2.53 0.27 0.01 0.06 0.00 80.26 0.45 77 T E E 69.97 8.39 15.02 24.60 121.97 -135.85 -111.53 138.03 10.19 89.80 0.02 9.28 0.55 0.04 0.00 0.01 0.00 89.87 0.25 78 Y E E 56.08 13.64 13.34 28.04 128.01 -170.66 -125.59 146.87 3.44 96.56 0.00 3.25 0.08 0.00 0.00 0.00 0.00 96.58 0.09 79 E E E 95.03 7.07 18.48 26.65 120.84 -145.56 -107.65 135.76 1.95 98.05 0.00 1.78 0.04 0.00 0.00 0.00 0.00 98.14 0.03 80 M E E 42.97 16.43 14.43 30.94 127.83 -170.42 -122.74 144.35 2.21 97.79 0.00 2.03 0.05 0.00 0.00 0.00 0.00 97.90 0.02 81 R E E 91.46 9.15 19.67 29.69 118.38 -143.22 -105.88 130.95 1.26 98.74 0.00 1.15 0.03 0.00 0.00 0.00 0.00 98.80 0.02 82 I E E 38.78 15.16 17.25 33.14 119.57 -159.99 -110.91 128.75 1.76 98.24 0.00 1.61 0.06 0.00 0.00 0.00 0.00 98.28 0.04 83 H E E 42.64 13.39 18.74 33.14 122.83 -167.23 -114.76 136.15 3.62 96.38 0.00 3.25 0.19 0.01 0.00 0.00 0.00 96.47 0.07 84 K E E 77.89 12.79 20.30 32.96 126.57 -165.19 -121.61 139.67 7.52 92.48 0.00 6.80 0.39 0.01 0.00 0.00 0.00 92.70 0.08 85 R E E 44.40 17.11 18.39 35.39 125.37 -164.15 -120.68 138.00 4.37 95.62 0.00 4.12 0.14 0.01 0.00 0.00 0.00 95.66 0.07 86 Y E E 64.00 11.91 22.60 35.12 120.48 -155.91 -113.85 130.16 0.94 99.06 0.00 0.86 0.03 0.00 0.00 0.00 0.00 99.09 0.02 87 I E E 9.49 22.64 18.30 41.26 120.86 -165.28 -115.80 128.13 0.28 99.72 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.73 0.01 88 D E E 49.06 9.64 25.72 35.87 115.96 -157.65 -104.39 124.67 0.68 99.32 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.36 0.01 89 L E E 10.67 23.19 15.26 38.60 119.54 -165.25 -110.16 129.44 10.46 89.30 0.25 9.77 0.52 0.14 0.10 0.11 0.00 88.98 0.37 90 E C E 92.10 7.29 22.33 29.91 110.99 -159.20 -98.79 113.18 52.03 47.60 0.37 29.31 22.10 1.75 0.09 0.27 0.00 45.62 0.87 91 A C S 36.76 11.44 17.31 29.47 127.35 33.18 -129.77 146.04 87.27 12.17 0.56 24.94 59.84 2.20 0.24 0.26 0.00 11.91 0.61 92 P C C 56.54 9.28 17.19 27.36 109.38 -68.48 -68.21 140.97 91.62 2.44 5.93 80.84 6.81 4.13 4.53 1.37 0.00 1.75 0.57 93 A H H 52.80 10.08 14.53 25.36 95.75 -131.17 -65.90 -34.25 46.64 0.65 52.72 28.52 9.90 8.08 50.38 2.55 0.01 0.26 0.30 94 H H H 119.28 3.08 19.35 22.33 93.50 58.78 -65.44 -35.53 19.32 0.35 80.33 8.42 4.07 7.40 77.42 2.36 0.04 0.16 0.14 95 I H H 30.28 15.03 16.14 31.56 93.05 52.10 -66.59 -41.22 7.98 0.39 91.62 3.99 1.30 3.15 88.89 2.29 0.02 0.29 0.08 96 V H H 24.13 18.20 15.01 32.98 92.12 52.04 -63.55 -41.74 2.83 0.23 96.94 1.29 0.43 1.23 95.08 1.72 0.01 0.22 0.02 97 K H H 114.27 4.07 20.02 24.56 91.90 52.20 -64.31 -39.63 2.51 0.21 97.28 0.87 0.34 1.38 94.65 2.49 0.01 0.23 0.02 98 R H H 113.63 6.12 19.47 26.27 92.37 51.28 -66.83 -38.74 3.71 0.26 96.03 0.94 0.44 2.34 92.64 3.32 0.02 0.27 0.03 99 I H H 19.56 21.20 14.47 35.05 92.99 50.01 -67.88 -35.41 5.99 0.46 93.56 1.27 0.73 3.95 89.93 3.60 0.05 0.41 0.06 100 T H H 55.15 13.13 16.48 29.49 93.49 58.32 -74.83 -20.19 25.28 0.93 73.79 3.31 2.56 18.97 70.62 3.48 0.17 0.63 0.26 101 Q C T 127.74 2.24 19.93 21.81 95.95 56.62 -87.65 -5.37 60.39 1.64 37.97 8.96 5.08 44.04 35.29 4.92 0.09 1.06 0.55 102 I C C 46.14 17.03 10.40 27.04 117.53 106.44 -83.09 136.88 90.04 7.50 2.46 64.10 23.45 2.83 1.97 0.76 0.00 5.21 1.66 103 T C C 96.01 3.11 20.93 24.62 114.48 -146.63 -102.28 122.96 82.95 16.22 0.83 80.05 2.08 0.96 0.48 0.29 0.00 13.57 2.56 104 I C C 36.94 20.87 10.68 30.38 120.31 -166.16 -111.33 129.75 62.40 37.44 0.15 60.64 2.38 0.09 0.13 0.05 0.00 14.24 22.47 105 E C C 102.44 5.12 19.59 25.23 118.32 -127.00 -78.15 148.00 99.28 0.71 0.02 98.84 0.61 0.05 0.00 0.00 0.00 0.39 0.11 106 P C T 87.32 6.59 15.95 23.91 111.15 -86.35 -60.79 139.14 99.08 0.51 0.41 0.85 3.40 95.01 0.03 0.27 0.00 0.34 0.09 107 G C T 41.34 5.41 18.49 24.99 96.66 23.58 87.49 -5.09 98.69 0.96 0.36 1.37 3.56 93.89 0.02 0.29 0.00 0.81 0.06 108 V C C 25.76 18.76 12.26 31.17 119.23 119.21 -96.89 134.99 60.70 39.21 0.09 54.59 4.85 0.31 0.01 0.09 0.00 39.30 0.84 109 D E E 81.06 5.81 22.53 29.02 118.41 -152.26 -106.60 131.16 14.16 85.80 0.04 13.54 0.44 0.07 0.01 0.02 0.00 85.61 0.31 110 V E E 25.16 22.18 13.07 34.73 126.21 -171.35 -126.24 137.76 6.86 93.13 0.01 6.67 0.11 0.01 0.00 0.00 0.00 93.14 0.06 111 E E E 97.06 5.36 24.22 30.05 121.64 -164.71 -115.50 132.30 3.23 96.77 0.00 3.20 0.05 0.00 0.00 0.00 0.00 96.71 0.03 112 V E E 26.12 21.82 13.14 34.56 122.39 -165.53 -116.62 132.18 3.30 96.69 0.00 3.41 0.03 0.00 0.00 0.00 0.00 96.53 0.03 113 I E E 77.86 5.80 22.48 28.86 120.96 -167.00 -115.97 131.85 2.86 97.13 0.00 2.87 0.04 0.00 0.00 0.00 0.00 97.02 0.06 114 I E E 60.22 15.54 12.34 27.93 117.67 -151.80 -102.56 129.15 8.80 91.18 0.02 8.56 0.22 0.02 0.01 0.01 0.00 90.85 0.33 115 A E E 54.49 6.61 13.42 21.69 119.57 -157.40 -101.61 145.80 48.32 51.58 0.10 47.50 0.49 0.12 0.03 0.05 0.00 51.13 0.68 116 A C C 78.14 4.00 14.40 19.81 112.72 -105.28 -77.17 139.43 99.64 0.35 0.00 99.61 0.09 0.02 0.00 0.00 0.00 0.27 0.01